NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
20129 |
2f3v   |
6907 | 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 9.485 11.119 -25.067
2 2H ALA 1 2HT ALA 1 7.810 11.480 -25.165
3 3H ALA 1 3HT ALA 1 8.462 10.173 -26.065
4 HA ALA 1 HA ALA 1 7.280 9.387 -24.178
5 1HB ALA 1 1HB ALA 1 9.688 8.556 -25.034
6 2HB ALA 1 2HB ALA 1 8.782 7.760 -23.746
7 3HB ALA 1 3HB ALA 1 10.067 8.900 -23.346
8 H THR 2 H THR 2 6.440 9.979 -22.302
9 HA THR 2 HA THR 2 7.699 12.074 -20.742
10 HB THR 2 HB THR 2 5.329 12.274 -21.079
11 HG1 THR 2 1HG THR 2 4.643 12.343 -18.916
12 1HG2 THR 2 1HG2 THR 2 3.998 10.525 -21.253
13 2HG2 THR 2 2HG2 THR 2 4.208 10.218 -19.529
14 3HG2 THR 2 3HG2 THR 2 5.284 9.454 -20.697
15 H SER 3 H SER 3 9.196 11.566 -19.295
16 HA SER 3 HA SER 3 9.449 8.934 -18.199
17 1HB SER 3 2HB SER 3 11.321 10.651 -18.699
18 2HB SER 3 1HB SER 3 10.886 11.358 -17.143
19 HG SER 3 HG SER 3 11.569 8.630 -17.522
20 H THR 4 H THR 4 8.194 8.189 -16.630
21 HA THR 4 HA THR 4 6.782 9.970 -14.855
22 HB THR 4 HB THR 4 6.414 7.383 -13.900
23 HG1 THR 4 1HG THR 4 6.432 7.285 -16.728
24 1HG2 THR 4 1HG2 THR 4 4.867 9.373 -15.191
25 2HG2 THR 4 2HG2 THR 4 4.325 8.022 -14.195
26 3HG2 THR 4 3HG2 THR 4 4.506 7.816 -15.937
27 H LYS 5 H LYS 5 7.487 10.668 -12.955
28 HA LYS 5 HA LYS 5 10.000 9.828 -11.902
29 1HB LYS 5 2HB LYS 5 8.519 12.102 -11.694
30 2HB LYS 5 1HB LYS 5 8.210 11.363 -10.129
31 1HG LYS 5 2HG LYS 5 10.621 11.226 -9.725
32 2HG LYS 5 1HG LYS 5 10.919 11.989 -11.287
33 1HD LYS 5 2HD LYS 5 10.881 13.932 -10.182
34 2HD LYS 5 1HD LYS 5 9.134 13.706 -10.074
35 1HE LYS 5 2HE LYS 5 9.945 14.168 -7.877
36 2HE LYS 5 1HE LYS 5 9.506 12.461 -7.941
37 1HZ LYS 5 1HZ LYS 5 11.555 12.484 -6.880
38 2HZ LYS 5 2HZ LYS 5 12.200 13.668 -7.900
39 3HZ LYS 5 3HZ LYS 5 11.962 12.096 -8.476
40 H LYS 6 H LYS 6 10.195 7.874 -11.003
41 HA LYS 6 HA LYS 6 8.084 6.959 -9.167
42 1HB LYS 6 2HB LYS 6 9.535 5.636 -11.253
43 2HB LYS 6 1HB LYS 6 9.907 4.854 -9.724
44 1HG LYS 6 2HG LYS 6 8.056 3.711 -10.634
45 2HG LYS 6 1HG LYS 6 7.429 4.707 -9.320
46 1HD LYS 6 2HD LYS 6 6.745 6.407 -10.970
47 2HD LYS 6 1HD LYS 6 7.318 5.354 -12.266
48 1HE LYS 6 2HE LYS 6 4.989 5.003 -12.137
49 2HE LYS 6 1HE LYS 6 5.730 3.603 -11.362
50 1HZ LYS 6 1HZ LYS 6 4.561 5.952 -9.972
51 2HZ LYS 6 2HZ LYS 6 5.319 4.649 -9.208
52 3HZ LYS 6 3HZ LYS 6 3.880 4.405 -10.062
53 H LEU 7 H LEU 7 8.518 7.042 -7.074
54 HA LEU 7 HA LEU 7 11.238 7.515 -6.175
55 1HB LEU 7 2HB LEU 7 10.218 7.908 -3.983
56 2HB LEU 7 1HB LEU 7 9.475 8.880 -5.238
57 HG LEU 7 HG LEU 7 7.901 6.584 -5.140
58 1HD1 LEU 7 1HD1 LEU 7 9.097 6.056 -2.996
59 2HD1 LEU 7 2HD1 LEU 7 7.344 6.199 -2.865
60 3HD1 LEU 7 3HD1 LEU 7 8.380 7.518 -2.322
61 1HD2 LEU 7 1HD2 LEU 7 7.616 9.356 -4.934
62 2HD2 LEU 7 2HD2 LEU 7 6.834 8.696 -3.498
63 3HD2 LEU 7 3HD2 LEU 7 6.335 8.158 -5.101
64 H HIS 8 H HIS 8 12.548 5.939 -5.568
65 HA HIS 8 HA HIS 8 11.556 3.263 -5.152
66 1HB HIS 8 2HB HIS 8 13.964 4.363 -6.045
67 2HB HIS 8 1HB HIS 8 14.360 3.642 -4.488
68 HD1 HIS 8 1HD HIS 8 14.836 1.209 -4.522
69 HD2 HIS 8 2HD HIS 8 12.650 2.415 -7.843
70 HE1 HIS 8 1HE HIS 8 14.662 -0.828 -5.987
71 HE2 HIS 8 2HE HIS 8 13.254 -0.099 -7.945
72 H LYS 9 H LYS 9 10.336 3.418 -3.272
73 HA LYS 9 HA LYS 9 11.603 4.331 -0.828
74 1HB LYS 9 2HB LYS 9 8.990 4.338 -1.721
75 2HB LYS 9 1HB LYS 9 9.003 3.051 -0.523
76 1HG LYS 9 2HG LYS 9 8.990 4.526 1.129
77 2HG LYS 9 1HG LYS 9 10.434 5.311 0.492
78 1HD LYS 9 2HD LYS 9 9.221 6.876 -0.690
79 2HD LYS 9 1HD LYS 9 7.784 5.855 -0.773
80 1HE LYS 9 2HE LYS 9 7.036 6.511 1.266
81 2HE LYS 9 1HE LYS 9 8.662 6.696 1.923
82 1HZ LYS 9 1HZ LYS 9 8.853 8.814 1.098
83 2HZ LYS 9 2HZ LYS 9 7.205 8.774 1.478
84 3HZ LYS 9 3HZ LYS 9 7.707 8.577 -0.125
85 H GLU 10 H GLU 10 11.577 3.032 1.114
86 HA GLU 10 HA GLU 10 12.276 0.246 0.517
87 1HB GLU 10 2HB GLU 10 13.404 2.286 2.230
88 2HB GLU 10 1HB GLU 10 13.016 0.847 3.162
89 1HG GLU 10 2HG GLU 10 15.153 0.382 2.516
90 2HG GLU 10 1HG GLU 10 14.243 -0.389 1.218
91 HA PRO 11 HA PRO 11 8.901 -1.293 2.877
92 1HB PRO 11 2HB PRO 11 9.872 -3.474 4.089
93 2HB PRO 11 1HB PRO 11 9.764 -3.370 2.329
94 1HG PRO 11 2HG PRO 11 12.144 -2.911 4.090
95 2HG PRO 11 1HG PRO 11 12.029 -3.868 2.601
96 1HD PRO 11 2HD PRO 11 12.996 -1.328 2.649
97 2HD PRO 11 1HD PRO 11 12.144 -2.008 1.247
98 H ALA 12 H ALA 12 7.998 -1.705 5.012
99 HA ALA 12 HA ALA 12 9.531 -0.318 7.116
100 1HB ALA 12 1HB ALA 12 6.535 -0.488 6.997
101 2HB ALA 12 2HB ALA 12 7.444 0.795 6.201
102 3HB ALA 12 3HB ALA 12 7.536 0.605 7.951
103 H THR 13 H THR 13 7.886 -0.869 9.244
104 HA THR 13 HA THR 13 8.209 -3.774 9.566
105 HB THR 13 HB THR 13 8.794 -3.430 11.853
106 HG1 THR 13 1HG THR 13 7.409 -1.758 12.391
107 1HG2 THR 13 1HG2 THR 13 10.629 -2.981 10.276
108 2HG2 THR 13 2HG2 THR 13 10.771 -2.070 11.780
109 3HG2 THR 13 3HG2 THR 13 10.208 -1.269 10.312
110 H LEU 14 H LEU 14 6.917 -4.302 11.809
111 HA LEU 14 HA LEU 14 4.136 -3.682 11.149
112 1HB LEU 14 2HB LEU 14 4.672 -6.034 11.265
113 2HB LEU 14 1HB LEU 14 5.364 -5.840 12.864
114 HG LEU 14 HG LEU 14 3.103 -5.228 13.716
115 1HD1 LEU 14 1HD1 LEU 14 1.156 -5.659 12.350
116 2HD1 LEU 14 2HD1 LEU 14 2.181 -6.115 10.989
117 3HD1 LEU 14 3HD1 LEU 14 2.179 -4.451 11.572
118 1HD2 LEU 14 1HD2 LEU 14 3.840 -7.863 12.594
119 2HD2 LEU 14 2HD2 LEU 14 2.166 -7.656 13.111
120 3HD2 LEU 14 3HD2 LEU 14 3.482 -7.395 14.256
121 H ILE 15 H ILE 15 3.238 -2.061 12.229
122 HA ILE 15 HA ILE 15 3.889 -1.750 15.087
123 HB ILE 15 HB ILE 15 3.185 0.534 13.250
124 1HG1 ILE 15 2HG1 ILE 15 5.341 -0.482 12.585
125 2HG1 ILE 15 1HG1 ILE 15 5.549 1.134 13.254
126 1HG2 ILE 15 1HG2 ILE 15 4.513 1.605 15.339
127 2HG2 ILE 15 2HG2 ILE 15 3.736 0.231 16.125
128 3HG2 ILE 15 3HG2 ILE 15 2.760 1.428 15.273
129 1HD1 ILE 15 1HD1 ILE 15 5.919 -1.369 14.870
130 2HD1 ILE 15 2HD1 ILE 15 6.395 0.277 15.288
131 3HD1 ILE 15 3HD1 ILE 15 7.225 -0.579 13.987
132 H LYS 16 H LYS 16 1.479 -1.194 12.550
133 HA LYS 16 HA LYS 16 -0.628 -1.752 14.499
134 1HB LYS 16 2HB LYS 16 -0.153 0.809 14.032
135 2HB LYS 16 1HB LYS 16 -1.093 0.490 12.581
136 1HG LYS 16 2HG LYS 16 -3.029 0.296 13.714
137 2HG LYS 16 1HG LYS 16 -2.265 -0.484 15.100
138 1HD LYS 16 2HD LYS 16 -1.704 1.523 16.089
139 2HD LYS 16 1HD LYS 16 -1.715 2.400 14.557
140 1HE LYS 16 2HE LYS 16 -4.288 1.693 14.659
141 2HE LYS 16 1HE LYS 16 -3.945 1.731 16.387
142 1HZ LYS 16 1HZ LYS 16 -3.698 3.957 16.380
143 2HZ LYS 16 2HZ LYS 16 -4.676 3.870 15.004
144 3HZ LYS 16 3HZ LYS 16 -2.997 4.004 14.840
145 H ALA 17 H ALA 17 -2.394 -2.799 13.656
146 HA ALA 17 HA ALA 17 -2.370 -3.305 10.754
147 1HB ALA 17 1HB ALA 17 -2.457 -5.238 13.012
148 2HB ALA 17 2HB ALA 17 -1.639 -5.352 11.453
149 3HB ALA 17 3HB ALA 17 -3.380 -5.609 11.556
150 H ILE 18 H ILE 18 -4.174 -2.621 9.828
151 HA ILE 18 HA ILE 18 -6.746 -3.097 11.093
152 HB ILE 18 HB ILE 18 -6.034 -0.303 10.206
153 1HG1 ILE 18 2HG1 ILE 18 -6.222 -1.435 13.008
154 2HG1 ILE 18 1HG1 ILE 18 -4.755 -0.865 12.217
155 1HG2 ILE 18 1HG2 ILE 18 -8.155 0.177 11.541
156 2HG2 ILE 18 2HG2 ILE 18 -8.453 -1.560 11.463
157 3HG2 ILE 18 3HG2 ILE 18 -8.344 -0.616 9.978
158 1HD1 ILE 18 1HD1 ILE 18 -6.249 0.614 13.898
159 2HD1 ILE 18 2HD1 ILE 18 -6.943 1.088 12.348
160 3HD1 ILE 18 3HD1 ILE 18 -5.215 1.288 12.639
161 H ASP 19 H ASP 19 -8.522 -2.939 9.642
162 HA ASP 19 HA ASP 19 -7.911 -3.732 6.988
163 1HB ASP 19 2HB ASP 19 -10.510 -2.979 8.331
164 2HB ASP 19 1HB ASP 19 -10.417 -3.546 6.667
165 H GLY 20 H GLY 20 -6.583 -1.863 6.384
166 1HA GLY 20 2HA GLY 20 -6.239 0.171 5.351
167 2HA GLY 20 1HA GLY 20 -7.760 -0.188 4.548
168 H ASP 21 H ASP 21 -6.420 1.189 7.531
169 HA ASP 21 HA ASP 21 -8.408 3.312 7.413
170 1HB ASP 21 2HB ASP 21 -8.115 1.438 9.766
171 2HB ASP 21 1HB ASP 21 -8.917 3.002 9.869
172 H THR 22 H THR 22 -5.745 1.897 9.274
173 HA THR 22 HA THR 22 -4.123 4.209 9.046
174 HB THR 22 HB THR 22 -5.467 5.257 10.676
175 HG1 THR 22 1HG THR 22 -3.431 4.011 12.198
176 1HG2 THR 22 1HG2 THR 22 -6.698 4.267 12.233
177 2HG2 THR 22 2HG2 THR 22 -5.330 3.335 12.841
178 3HG2 THR 22 3HG2 THR 22 -6.258 2.744 11.462
179 H VAL 23 H VAL 23 -2.325 3.084 8.645
180 HA VAL 23 HA VAL 23 -1.473 1.101 10.650
181 HB VAL 23 HB VAL 23 -0.931 0.918 7.682
182 1HG1 VAL 23 1HG1 VAL 23 0.336 -0.278 9.916
183 2HG1 VAL 23 2HG1 VAL 23 0.624 -0.576 8.203
184 3HG1 VAL 23 3HG1 VAL 23 -0.570 -1.537 9.076
185 1HG2 VAL 23 1HG2 VAL 23 -2.939 -0.508 9.414
186 2HG2 VAL 23 2HG2 VAL 23 -2.435 -1.101 7.831
187 3HG2 VAL 23 3HG2 VAL 23 -3.241 0.462 7.972
188 H LYS 24 H LYS 24 0.213 1.918 11.698
189 HA LYS 24 HA LYS 24 1.880 3.939 10.504
190 1HB LYS 24 2HB LYS 24 1.226 3.102 13.141
191 2HB LYS 24 1HB LYS 24 2.973 3.009 12.970
192 1HG LYS 24 2HG LYS 24 3.111 5.312 12.374
193 2HG LYS 24 1HG LYS 24 1.356 5.441 12.250
194 1HD LYS 24 2HD LYS 24 2.163 4.445 14.845
195 2HD LYS 24 1HD LYS 24 2.925 5.996 14.484
196 1HE LYS 24 2HE LYS 24 0.891 6.523 15.546
197 2HE LYS 24 1HE LYS 24 0.617 6.814 13.829
198 1HZ LYS 24 1HZ LYS 24 -1.038 5.407 15.339
199 2HZ LYS 24 2HZ LYS 24 -0.034 4.153 14.812
200 3HZ LYS 24 3HZ LYS 24 -0.842 5.117 13.683
201 H LEU 25 H LEU 25 3.745 3.660 9.504
202 HA LEU 25 HA LEU 25 5.057 1.024 9.677
203 1HB LEU 25 2HB LEU 25 4.525 2.879 7.419
204 2HB LEU 25 1HB LEU 25 6.063 2.038 7.403
205 HG LEU 25 HG LEU 25 4.723 -0.115 7.676
206 1HD1 LEU 25 1HD1 LEU 25 2.368 0.432 6.495
207 2HD1 LEU 25 2HD1 LEU 25 2.573 1.882 7.478
208 3HD1 LEU 25 3HD1 LEU 25 2.584 0.292 8.240
209 1HD2 LEU 25 1HD2 LEU 25 3.910 1.037 5.093
210 2HD2 LEU 25 2HD2 LEU 25 4.863 -0.405 5.447
211 3HD2 LEU 25 3HD2 LEU 25 5.624 1.185 5.484
212 H MET 26 H MET 26 7.221 0.944 10.115
213 HA MET 26 HA MET 26 8.394 3.244 11.328
214 1HB MET 26 2HB MET 26 9.147 0.406 10.926
215 2HB MET 26 1HB MET 26 10.473 1.538 11.150
216 1HG MET 26 2HG MET 26 8.354 1.949 13.081
217 2HG MET 26 1HG MET 26 8.993 0.308 13.129
218 1HE MET 26 1HE MET 26 10.118 0.992 15.904
219 2HE MET 26 2HE MET 26 11.747 0.559 15.380
220 3HE MET 26 3HE MET 26 10.349 -0.265 14.689
221 H TYR 27 H TYR 27 8.812 4.880 9.943
222 HA TYR 27 HA TYR 27 10.586 4.292 7.663
223 1HB TYR 27 2HB TYR 27 8.368 5.151 6.989
224 2HB TYR 27 1HB TYR 27 8.642 6.592 7.962
225 HD1 TYR 27 1HD TYR 27 10.517 8.151 7.320
226 HD2 TYR 27 2HD TYR 27 9.216 4.986 4.793
227 HE1 TYR 27 1HE TYR 27 11.608 9.240 5.405
228 HE2 TYR 27 2HE TYR 27 10.306 6.065 2.870
229 HH TYR 27 HH TYR 27 11.080 8.228 2.169
230 H LYS 28 H LYS 28 12.605 4.895 8.037
231 HA LYS 28 HA LYS 28 14.422 6.092 8.696
232 1HB LYS 28 2HB LYS 28 13.043 7.933 7.559
233 2HB LYS 28 1HB LYS 28 12.600 8.440 9.183
234 1HG LYS 28 2HG LYS 28 14.980 8.750 9.715
235 2HG LYS 28 1HG LYS 28 15.391 8.298 8.060
236 1HD LYS 28 2HD LYS 28 13.371 10.399 8.213
237 2HD LYS 28 1HD LYS 28 14.905 10.852 8.959
238 1HE LYS 28 2HE LYS 28 15.006 11.506 6.672
239 2HE LYS 28 1HE LYS 28 16.045 10.093 6.862
240 1HZ LYS 28 1HZ LYS 28 14.098 8.751 6.070
241 2HZ LYS 28 2HZ LYS 28 14.795 9.762 4.909
242 3HZ LYS 28 3HZ LYS 28 13.343 10.206 5.652
243 H GLY 29 H GLY 29 12.636 4.693 10.643
244 1HA GLY 29 2HA GLY 29 13.157 4.234 12.897
245 2HA GLY 29 1HA GLY 29 13.860 5.837 13.038
246 H GLN 30 H GLN 30 11.199 6.696 11.587
247 HA GLN 30 HA GLN 30 9.649 6.845 14.085
248 1HB GLN 30 2HB GLN 30 10.210 8.813 11.934
249 2HB GLN 30 1HB GLN 30 8.607 8.858 12.653
250 1HG GLN 30 2HG GLN 30 9.401 10.010 14.359
251 2HG GLN 30 1HG GLN 30 10.479 8.675 14.764
252 1HE2 GLN 30 1HE2 GLN 30 12.026 10.182 15.486
253 2HE2 GLN 30 2HE2 GLN 30 13.001 11.070 14.370
254 HA PRO 31 HA PRO 31 6.465 4.632 11.918
255 1HB PRO 31 2HB PRO 31 4.482 4.867 13.704
256 2HB PRO 31 1HB PRO 31 5.919 3.894 14.045
257 1HG PRO 31 2HG PRO 31 5.249 6.667 14.952
258 2HG PRO 31 1HG PRO 31 5.960 5.330 15.874
259 1HD PRO 31 2HD PRO 31 7.415 7.387 14.787
260 2HD PRO 31 1HD PRO 31 8.073 5.772 15.114
261 H MET 32 H MET 32 4.931 5.109 10.433
262 HA MET 32 HA MET 32 3.476 7.643 10.645
263 1HB MET 32 2HB MET 32 5.011 6.748 8.200
264 2HB MET 32 1HB MET 32 3.903 8.110 8.247
265 1HG MET 32 2HG MET 32 5.992 8.192 10.291
266 2HG MET 32 1HG MET 32 6.586 8.256 8.634
267 1HE MET 32 1HE MET 32 5.033 11.087 11.368
268 2HE MET 32 2HE MET 32 4.391 9.448 11.258
269 3HE MET 32 3HE MET 32 3.479 10.799 10.587
270 H THR 33 H THR 33 1.383 7.416 10.218
271 HA THR 33 HA THR 33 0.350 4.860 9.419
272 HB THR 33 HB THR 33 -1.064 7.461 10.014
273 HG1 THR 33 1HG THR 33 -0.704 5.161 11.629
274 1HG2 THR 33 1HG2 THR 33 -2.299 4.734 10.100
275 2HG2 THR 33 2HG2 THR 33 -2.377 5.759 8.667
276 3HG2 THR 33 3HG2 THR 33 -3.088 6.309 10.184
277 H PHE 34 H PHE 34 -0.258 4.219 7.459
278 HA PHE 34 HA PHE 34 -0.999 6.193 5.429
279 1HB PHE 34 2HB PHE 34 0.934 3.955 4.833
280 2HB PHE 34 1HB PHE 34 0.405 5.236 3.754
281 HD1 PHE 34 1HD PHE 34 3.021 4.152 5.739
282 HD2 PHE 34 2HD PHE 34 0.882 7.680 4.718
283 HE1 PHE 34 1HE PHE 34 4.964 5.512 6.390
284 HE2 PHE 34 2HE PHE 34 2.818 9.051 5.368
285 HZ PHE 34 HZ PHE 34 4.865 7.966 6.204
286 H ARG 35 H ARG 35 -2.756 5.541 4.256
287 HA ARG 35 HA ARG 35 -3.339 2.690 4.082
288 1HB ARG 35 2HB ARG 35 -5.716 3.093 4.751
289 2HB ARG 35 1HB ARG 35 -4.548 3.267 6.054
290 1HG ARG 35 2HG ARG 35 -5.030 5.428 6.363
291 2HG ARG 35 1HG ARG 35 -5.131 5.757 4.632
292 1HD ARG 35 2HD ARG 35 -7.252 4.555 6.402
293 2HD ARG 35 1HD ARG 35 -7.296 6.118 5.591
294 HE ARG 35 HE ARG 35 -7.818 3.521 4.422
295 1HH1 ARG 35 1HH1 ARG 35 -7.097 6.886 3.828
296 2HH1 ARG 35 2HH1 ARG 35 -7.740 6.867 2.222
297 1HH2 ARG 35 1HH2 ARG 35 -8.660 3.497 2.310
298 2HH2 ARG 35 2HH2 ARG 35 -8.625 4.945 1.358
299 H LEU 36 H LEU 36 -3.119 2.666 1.848
300 HA LEU 36 HA LEU 36 -5.346 3.897 0.437
301 1HB LEU 36 2HB LEU 36 -2.568 4.745 0.141
302 2HB LEU 36 1HB LEU 36 -3.306 4.278 -1.381
303 HG LEU 36 HG LEU 36 -4.932 6.076 0.298
304 1HD1 LEU 36 1HD1 LEU 36 -3.285 7.520 0.727
305 2HD1 LEU 36 2HD1 LEU 36 -3.328 7.888 -0.997
306 3HD1 LEU 36 3HD1 LEU 36 -2.169 6.714 -0.374
307 1HD2 LEU 36 1HD2 LEU 36 -4.466 5.441 -2.525
308 2HD2 LEU 36 2HD2 LEU 36 -4.728 7.154 -2.194
309 3HD2 LEU 36 3HD2 LEU 36 -5.936 5.966 -1.704
310 H LEU 37 H LEU 37 -6.136 1.769 0.251
311 HA LEU 37 HA LEU 37 -4.870 0.292 -1.913
312 1HB LEU 37 2HB LEU 37 -5.045 -1.847 -0.684
313 2HB LEU 37 1HB LEU 37 -3.870 -0.729 -0.002
314 HG LEU 37 HG LEU 37 -6.591 -0.660 1.178
315 1HD1 LEU 37 1HD1 LEU 37 -4.824 -3.053 1.229
316 2HD1 LEU 37 2HD1 LEU 37 -6.585 -2.947 1.223
317 3HD1 LEU 37 3HD1 LEU 37 -5.685 -2.599 2.699
318 1HD2 LEU 37 1HD2 LEU 37 -5.428 -0.130 3.145
319 2HD2 LEU 37 2HD2 LEU 37 -4.550 0.702 1.862
320 3HD2 LEU 37 3HD2 LEU 37 -3.916 -0.800 2.532
321 H LEU 38 H LEU 38 -6.481 0.416 -3.350
322 HA LEU 38 HA LEU 38 -8.977 -0.925 -2.705
323 1HB LEU 38 2HB LEU 38 -8.962 1.887 -3.802
324 2HB LEU 38 1HB LEU 38 -10.378 0.896 -3.509
325 HG LEU 38 HG LEU 38 -8.498 1.845 -1.347
326 1HD1 LEU 38 1HD1 LEU 38 -11.059 2.990 -2.410
327 2HD1 LEU 38 2HD1 LEU 38 -9.516 3.798 -2.138
328 3HD1 LEU 38 3HD1 LEU 38 -10.506 3.303 -0.765
329 1HD2 LEU 38 1HD2 LEU 38 -9.770 0.735 0.146
330 2HD2 LEU 38 2HD2 LEU 38 -10.166 -0.272 -1.247
331 3HD2 LEU 38 3HD2 LEU 38 -11.261 1.019 -0.752
332 H VAL 39 H VAL 39 -9.133 -2.392 -4.253
333 HA VAL 39 HA VAL 39 -8.864 -1.549 -7.042
334 HB VAL 39 HB VAL 39 -7.563 -4.081 -6.038
335 1HG1 VAL 39 1HG1 VAL 39 -6.495 -4.052 -8.267
336 2HG1 VAL 39 2HG1 VAL 39 -7.472 -2.646 -8.690
337 3HG1 VAL 39 3HG1 VAL 39 -8.252 -4.191 -8.349
338 1HG2 VAL 39 1HG2 VAL 39 -6.529 -1.317 -6.227
339 2HG2 VAL 39 2HG2 VAL 39 -5.478 -2.598 -6.829
340 3HG2 VAL 39 3HG2 VAL 39 -6.051 -2.640 -5.162
341 H ASP 40 H ASP 40 -10.532 -2.256 -8.215
342 HA ASP 40 HA ASP 40 -11.889 -4.731 -7.407
343 1HB ASP 40 2HB ASP 40 -12.962 -2.062 -7.238
344 2HB ASP 40 1HB ASP 40 -13.895 -3.007 -8.394
345 H THR 41 H THR 41 -11.280 -5.969 -9.103
346 HA THR 41 HA THR 41 -12.467 -5.393 -11.667
347 HB THR 41 HB THR 41 -9.466 -5.714 -11.470
348 HG1 THR 41 1HG THR 41 -11.101 -3.458 -11.933
349 1HG2 THR 41 1HG2 THR 41 -9.331 -5.844 -13.695
350 2HG2 THR 41 2HG2 THR 41 -10.658 -4.709 -13.944
351 3HG2 THR 41 3HG2 THR 41 -11.000 -6.402 -13.590
352 HA PRO 42 HA PRO 42 -12.580 -9.860 -10.780
353 1HB PRO 42 2HB PRO 42 -14.712 -10.386 -12.372
354 2HB PRO 42 1HB PRO 42 -14.874 -9.728 -10.740
355 1HG PRO 42 2HG PRO 42 -14.963 -8.308 -13.373
356 2HG PRO 42 1HG PRO 42 -16.005 -8.097 -11.954
357 1HD PRO 42 2HD PRO 42 -13.960 -6.416 -12.522
358 2HD PRO 42 1HD PRO 42 -14.463 -6.780 -10.859
359 H GLU 43 H GLU 43 -12.359 -11.772 -12.122
360 HA GLU 43 HA GLU 43 -10.585 -11.337 -14.315
361 1HB GLU 43 2HB GLU 43 -10.408 -13.240 -12.706
362 2HB GLU 43 1HB GLU 43 -11.857 -13.929 -13.426
363 1HG GLU 43 2HG GLU 43 -10.624 -13.922 -15.623
364 2HG GLU 43 1HG GLU 43 -9.171 -13.522 -14.707
365 H THR 44 H THR 44 -13.976 -11.606 -14.069
366 HA THR 44 HA THR 44 -14.618 -12.859 -16.493
367 HB THR 44 HB THR 44 -16.666 -11.095 -16.190
368 HG1 THR 44 1HG THR 44 -15.847 -11.558 -13.537
369 1HG2 THR 44 1HG2 THR 44 -17.505 -13.162 -16.046
370 2HG2 THR 44 2HG2 THR 44 -17.382 -12.893 -14.307
371 3HG2 THR 44 3HG2 THR 44 -16.115 -13.780 -15.156
372 H LYS 45 H LYS 45 -15.235 -11.990 -18.520
373 HA LYS 45 HA LYS 45 -13.519 -10.256 -19.733
374 1HB LYS 45 2HB LYS 45 -16.268 -11.189 -20.352
375 2HB LYS 45 1HB LYS 45 -15.675 -9.809 -21.266
376 1HG LYS 45 2HG LYS 45 -13.576 -11.341 -21.614
377 2HG LYS 45 1HG LYS 45 -14.730 -12.628 -21.259
378 1HD LYS 45 2HD LYS 45 -15.663 -10.604 -23.178
379 2HD LYS 45 1HD LYS 45 -14.304 -11.587 -23.727
380 1HE LYS 45 2HE LYS 45 -15.549 -13.462 -23.864
381 2HE LYS 45 1HE LYS 45 -16.484 -13.069 -22.421
382 1HZ LYS 45 1HZ LYS 45 -17.896 -11.669 -23.655
383 2HZ LYS 45 2HZ LYS 45 -17.736 -13.074 -24.584
384 3HZ LYS 45 3HZ LYS 45 -16.879 -11.679 -25.007
385 H HIS 46 H HIS 46 -16.806 -9.353 -18.672
386 HA HIS 46 HA HIS 46 -16.136 -6.538 -18.911
387 1HB HIS 46 2HB HIS 46 -18.587 -8.128 -18.735
388 2HB HIS 46 1HB HIS 46 -18.645 -6.664 -17.759
389 HD1 HIS 46 1HD HIS 46 -17.336 -7.356 -21.276
390 HD2 HIS 46 2HD HIS 46 -19.855 -4.760 -19.230
391 HE1 HIS 46 1HE HIS 46 -18.167 -5.726 -23.001
392 HE2 HIS 46 2HE HIS 46 -19.623 -4.114 -21.723
393 HA PRO 47 HA PRO 47 -14.806 -6.750 -14.581
394 1HB PRO 47 2HB PRO 47 -13.831 -4.204 -14.494
395 2HB PRO 47 1HB PRO 47 -12.922 -5.572 -15.144
396 1HG PRO 47 2HG PRO 47 -14.497 -3.480 -16.596
397 2HG PRO 47 1HG PRO 47 -12.907 -4.162 -16.993
398 1HD PRO 47 2HD PRO 47 -15.159 -4.955 -18.245
399 2HD PRO 47 1HD PRO 47 -13.819 -6.073 -17.919
400 H LYS 48 H LYS 48 -16.645 -6.764 -13.388
401 HA LYS 48 HA LYS 48 -17.931 -4.161 -12.910
402 1HB LYS 48 2HB LYS 48 -19.133 -6.441 -14.065
403 2HB LYS 48 1HB LYS 48 -19.768 -6.324 -12.429
404 1HG LYS 48 2HG LYS 48 -21.005 -4.528 -12.911
405 2HG LYS 48 1HG LYS 48 -19.717 -3.774 -13.853
406 1HD LYS 48 2HD LYS 48 -20.908 -6.143 -15.105
407 2HD LYS 48 1HD LYS 48 -22.024 -4.792 -14.891
408 1HE LYS 48 2HE LYS 48 -20.824 -4.788 -17.074
409 2HE LYS 48 1HE LYS 48 -20.590 -3.326 -16.118
410 1HZ LYS 48 1HZ LYS 48 -18.599 -4.690 -17.235
411 2HZ LYS 48 2HZ LYS 48 -18.626 -5.423 -15.710
412 3HZ LYS 48 3HZ LYS 48 -18.414 -3.750 -15.841
413 H LYS 49 H LYS 49 -16.923 -3.721 -10.992
414 HA LYS 49 HA LYS 49 -16.411 -3.838 -8.777
415 1HB LYS 49 2HB LYS 49 -18.869 -5.598 -8.698
416 2HB LYS 49 1HB LYS 49 -18.113 -4.831 -7.308
417 1HG LYS 49 2HG LYS 49 -18.582 -2.624 -8.343
418 2HG LYS 49 1HG LYS 49 -19.470 -3.462 -9.618
419 1HD LYS 49 2HD LYS 49 -20.109 -3.711 -6.682
420 2HD LYS 49 1HD LYS 49 -20.895 -2.559 -7.764
421 1HE LYS 49 2HE LYS 49 -20.849 -5.334 -8.728
422 2HE LYS 49 1HE LYS 49 -21.793 -5.075 -7.262
423 1HZ LYS 49 1HZ LYS 49 -22.117 -3.550 -9.791
424 2HZ LYS 49 2HZ LYS 49 -23.053 -3.371 -8.393
425 3HZ LYS 49 3HZ LYS 49 -23.122 -4.811 -9.279
426 H GLY 50 H GLY 50 -14.486 -4.895 -8.667
427 1HA GLY 50 2HA GLY 50 -14.143 -7.671 -9.101
428 2HA GLY 50 1HA GLY 50 -12.987 -6.601 -8.323
429 H VAL 51 H VAL 51 -12.397 -8.013 -6.710
430 HA VAL 51 HA VAL 51 -14.276 -9.415 -5.095
431 HB VAL 51 HB VAL 51 -12.327 -9.843 -3.596
432 1HG1 VAL 51 1HG1 VAL 51 -10.922 -10.843 -5.662
433 2HG1 VAL 51 2HG1 VAL 51 -12.456 -10.508 -6.465
434 3HG1 VAL 51 3HG1 VAL 51 -12.412 -11.564 -5.054
435 1HG2 VAL 51 1HG2 VAL 51 -10.260 -8.905 -3.895
436 2HG2 VAL 51 2HG2 VAL 51 -11.284 -7.559 -4.397
437 3HG2 VAL 51 3HG2 VAL 51 -10.527 -8.593 -5.611
438 H GLU 52 H GLU 52 -14.992 -8.998 -3.025
439 HA GLU 52 HA GLU 52 -14.690 -6.209 -2.136
440 1HB GLU 52 2HB GLU 52 -16.809 -6.709 -0.823
441 2HB GLU 52 1HB GLU 52 -16.975 -6.634 -2.572
442 1HG GLU 52 2HG GLU 52 -17.661 -8.744 -2.704
443 2HG GLU 52 1HG GLU 52 -16.387 -9.315 -1.627
444 H LYS 53 H LYS 53 -15.330 -6.184 0.402
445 HA LYS 53 HA LYS 53 -13.087 -7.165 1.751
446 1HB LYS 53 2HB LYS 53 -14.448 -6.641 3.836
447 2HB LYS 53 1HB LYS 53 -14.195 -5.315 2.710
448 1HG LYS 53 2HG LYS 53 -16.378 -4.989 2.623
449 2HG LYS 53 1HG LYS 53 -16.585 -6.604 1.943
450 1HD LYS 53 2HD LYS 53 -16.718 -7.543 4.193
451 2HD LYS 53 1HD LYS 53 -16.477 -5.938 4.885
452 1HE LYS 53 2HE LYS 53 -18.581 -5.501 3.213
453 2HE LYS 53 1HE LYS 53 -18.883 -7.159 3.729
454 1HZ LYS 53 1HZ LYS 53 -18.983 -4.694 5.260
455 2HZ LYS 53 2HZ LYS 53 -18.305 -6.022 6.059
456 3HZ LYS 53 3HZ LYS 53 -19.876 -6.121 5.441
457 H TYR 54 H TYR 54 -12.759 -9.345 1.536
458 HA TYR 54 HA TYR 54 -14.775 -11.303 1.886
459 1HB TYR 54 2HB TYR 54 -12.489 -11.512 0.700
460 2HB TYR 54 1HB TYR 54 -11.843 -11.831 2.307
461 HD1 TYR 54 1HD TYR 54 -12.445 -13.878 3.506
462 HD2 TYR 54 2HD TYR 54 -13.876 -13.133 -0.430
463 HE1 TYR 54 1HE TYR 54 -13.078 -16.244 3.294
464 HE2 TYR 54 2HE TYR 54 -14.514 -15.498 -0.652
465 HH TYR 54 HH TYR 54 -13.992 -17.643 0.297
466 H GLY 55 H GLY 55 -12.500 -9.761 4.076
467 1HA GLY 55 2HA GLY 55 -13.982 -10.214 6.374
468 2HA GLY 55 1HA GLY 55 -12.870 -11.568 6.242
469 HA PRO 56 HA PRO 56 -10.787 -7.764 8.166
470 1HB PRO 56 2HB PRO 56 -10.903 -8.380 10.781
471 2HB PRO 56 1HB PRO 56 -12.218 -7.530 9.962
472 1HG PRO 56 2HG PRO 56 -11.989 -10.430 10.669
473 2HG PRO 56 1HG PRO 56 -13.384 -9.347 10.829
474 1HD PRO 56 2HD PRO 56 -13.073 -11.109 8.766
475 2HD PRO 56 1HD PRO 56 -13.979 -9.590 8.627
476 H GLU 57 H GLU 57 -10.410 -11.090 7.979
477 HA GLU 57 HA GLU 57 -8.353 -11.855 9.570
478 1HB GLU 57 2HB GLU 57 -8.885 -12.473 6.675
479 2HB GLU 57 1HB GLU 57 -7.559 -13.227 7.550
480 1HG GLU 57 2HG GLU 57 -10.402 -13.339 8.507
481 2HG GLU 57 1HG GLU 57 -9.714 -14.532 7.407
482 H ALA 58 H ALA 58 -8.167 -9.574 6.940
483 HA ALA 58 HA ALA 58 -5.537 -9.550 6.225
484 1HB ALA 58 1HB ALA 58 -6.792 -7.993 5.095
485 2HB ALA 58 2HB ALA 58 -5.873 -6.954 6.183
486 3HB ALA 58 3HB ALA 58 -7.543 -7.371 6.566
487 H SER 59 H SER 59 -6.915 -7.913 9.068
488 HA SER 59 HA SER 59 -4.615 -6.732 10.052
489 1HB SER 59 2HB SER 59 -5.737 -6.840 12.284
490 2HB SER 59 1HB SER 59 -6.776 -6.219 11.001
491 HG SER 59 HG SER 59 -7.723 -8.289 10.866
492 H ALA 60 H ALA 60 -5.446 -10.084 9.987
493 HA ALA 60 HA ALA 60 -3.572 -10.816 12.070
494 1HB ALA 60 1HB ALA 60 -4.248 -13.105 11.604
495 2HB ALA 60 2HB ALA 60 -5.147 -12.569 10.185
496 3HB ALA 60 3HB ALA 60 -5.664 -12.072 11.796
497 H PHE 61 H PHE 61 -3.728 -10.670 8.585
498 HA PHE 61 HA PHE 61 -1.596 -12.309 7.884
499 1HB PHE 61 2HB PHE 61 -2.523 -9.729 6.603
500 2HB PHE 61 1HB PHE 61 -1.408 -10.864 5.856
501 HD1 PHE 61 1HD PHE 61 -3.759 -10.103 4.409
502 HD2 PHE 61 2HD PHE 61 -3.314 -13.123 7.378
503 HE1 PHE 61 1HE PHE 61 -5.663 -11.327 3.448
504 HE2 PHE 61 2HE PHE 61 -5.217 -14.350 6.418
505 HZ PHE 61 HZ PHE 61 -6.394 -13.452 4.451
506 H THR 62 H THR 62 -1.632 -9.114 9.254
507 HA THR 62 HA THR 62 1.017 -8.356 8.693
508 HB THR 62 HB THR 62 0.422 -7.136 11.099
509 HG1 THR 62 1HG THR 62 -2.009 -7.248 9.681
510 1HG2 THR 62 1HG2 THR 62 0.469 -6.406 8.332
511 2HG2 THR 62 2HG2 THR 62 0.788 -5.419 9.758
512 3HG2 THR 62 3HG2 THR 62 -0.860 -5.592 9.156
513 H LYS 63 H LYS 63 -0.175 -10.763 10.764
514 HA LYS 63 HA LYS 63 2.068 -10.661 12.600
515 1HB LYS 63 2HB LYS 63 -0.115 -12.737 12.520
516 2HB LYS 63 1HB LYS 63 0.937 -12.326 13.867
517 1HG LYS 63 2HG LYS 63 -0.151 -10.019 13.786
518 2HG LYS 63 1HG LYS 63 -1.369 -10.769 12.753
519 1HD LYS 63 2HD LYS 63 -2.398 -11.203 14.711
520 2HD LYS 63 1HD LYS 63 -1.266 -12.556 14.780
521 1HE LYS 63 2HE LYS 63 0.210 -11.363 16.202
522 2HE LYS 63 1HE LYS 63 -0.643 -9.845 15.925
523 1HZ LYS 63 1HZ LYS 63 -2.238 -10.367 17.410
524 2HZ LYS 63 2HZ LYS 63 -1.031 -11.355 18.063
525 3HZ LYS 63 3HZ LYS 63 -2.212 -12.020 17.052
526 H LYS 64 H LYS 64 0.549 -13.307 10.784
527 HA LYS 64 HA LYS 64 3.110 -14.666 10.619
528 1HB LYS 64 2HB LYS 64 0.361 -15.499 9.678
529 2HB LYS 64 1HB LYS 64 1.795 -16.514 9.629
530 1HG LYS 64 2HG LYS 64 1.836 -15.904 12.216
531 2HG LYS 64 1HG LYS 64 0.105 -15.722 11.924
532 1HD LYS 64 2HD LYS 64 0.471 -18.047 10.683
533 2HD LYS 64 1HD LYS 64 1.811 -18.150 11.827
534 1HE LYS 64 2HE LYS 64 0.298 -17.836 13.686
535 2HE LYS 64 1HE LYS 64 -1.054 -17.590 12.581
536 1HZ LYS 64 1HZ LYS 64 0.293 -20.062 13.351
537 2HZ LYS 64 2HZ LYS 64 -0.264 -19.956 11.758
538 3HZ LYS 64 3HZ LYS 64 -1.346 -19.774 13.044
539 H MET 65 H MET 65 0.611 -13.538 8.342
540 HA MET 65 HA MET 65 2.076 -14.147 6.023
541 1HB MET 65 2HB MET 65 -0.147 -12.167 6.479
542 2HB MET 65 1HB MET 65 0.510 -12.539 4.897
543 1HG MET 65 2HG MET 65 -0.400 -14.813 6.554
544 2HG MET 65 1HG MET 65 -1.636 -13.747 5.888
545 1HE MET 65 1HE MET 65 -2.291 -14.454 2.700
546 2HE MET 65 2HE MET 65 -2.812 -14.440 4.385
547 3HE MET 65 3HE MET 65 -2.551 -15.974 3.554
548 H TRP 66 H TRP 66 2.584 -11.685 8.318
549 HA TRP 66 HA TRP 66 3.778 -9.827 6.478
550 1HB TRP 66 2HB TRP 66 2.614 -9.142 8.604
551 2HB TRP 66 1HB TRP 66 3.968 -9.828 9.491
552 HD1 TRP 66 HD TRP 66 2.838 -6.697 7.833
553 HE1 TRP 66 1HE TRP 66 4.743 -4.967 7.806
554 HE3 TRP 66 3HE TRP 66 6.711 -9.727 9.233
555 HZ2 TRP 66 2HZ TRP 66 7.513 -4.895 8.313
556 HZ3 TRP 66 3HZ TRP 66 8.959 -8.746 9.443
557 HH2 TRP 66 HH TRP 66 9.350 -6.378 8.993
558 H GLU 67 H GLU 67 4.721 -12.321 8.719
559 HA GLU 67 HA GLU 67 7.553 -11.829 8.239
560 1HB GLU 67 2HB GLU 67 6.201 -12.603 10.484
561 2HB GLU 67 1HB GLU 67 6.784 -14.148 9.879
562 1HG GLU 67 2HG GLU 67 9.071 -13.228 9.829
563 2HG GLU 67 1HG GLU 67 8.456 -11.730 10.524
564 H ASN 68 H ASN 68 4.983 -13.947 7.231
565 HA ASN 68 HA ASN 68 7.015 -15.679 5.931
566 1HB ASN 68 2HB ASN 68 5.449 -17.494 5.958
567 2HB ASN 68 1HB ASN 68 5.517 -16.807 7.577
568 1HD2 ASN 68 1HD2 ASN 68 3.580 -17.033 8.431
569 2HD2 ASN 68 2HD2 ASN 68 2.082 -16.612 7.676
570 H ALA 69 H ALA 69 4.219 -13.709 5.375
571 HA ALA 69 HA ALA 69 4.241 -14.403 2.517
572 1HB ALA 69 1HB ALA 69 2.123 -14.461 4.124
573 2HB ALA 69 2HB ALA 69 2.008 -14.047 2.416
574 3HB ALA 69 3HB ALA 69 2.037 -12.770 3.631
575 H LYS 70 H LYS 70 4.072 -12.668 0.926
576 HA LYS 70 HA LYS 70 5.893 -10.612 1.290
577 1HB LYS 70 2HB LYS 70 3.946 -11.339 -0.728
578 2HB LYS 70 1HB LYS 70 4.005 -9.594 -0.531
579 1HG LYS 70 2HG LYS 70 5.525 -10.395 -2.277
580 2HG LYS 70 1HG LYS 70 6.376 -9.578 -0.966
581 1HD LYS 70 2HD LYS 70 6.156 -12.391 -0.405
582 2HD LYS 70 1HD LYS 70 6.866 -12.144 -2.001
583 1HE LYS 70 2HE LYS 70 8.808 -11.623 -1.062
584 2HE LYS 70 1HE LYS 70 8.047 -10.277 -0.216
585 1HZ LYS 70 1HZ LYS 70 7.663 -12.943 0.905
586 2HZ LYS 70 2HZ LYS 70 7.862 -11.458 1.690
587 3HZ LYS 70 3HZ LYS 70 9.206 -12.264 1.054
588 H LYS 71 H LYS 71 5.738 -9.421 3.017
589 HA LYS 71 HA LYS 71 3.260 -8.348 3.954
590 1HB LYS 71 2HB LYS 71 4.340 -7.886 5.935
591 2HB LYS 71 1HB LYS 71 5.094 -9.349 5.331
592 1HG LYS 71 2HG LYS 71 6.291 -6.621 4.968
593 2HG LYS 71 1HG LYS 71 6.619 -7.669 6.353
594 1HD LYS 71 2HD LYS 71 8.344 -8.334 5.044
595 2HD LYS 71 1HD LYS 71 7.109 -9.411 4.391
596 1HE LYS 71 2HE LYS 71 6.636 -7.648 2.664
597 2HE LYS 71 1HE LYS 71 8.061 -6.792 3.248
598 1HZ LYS 71 1HZ LYS 71 7.875 -9.188 1.629
599 2HZ LYS 71 2HZ LYS 71 9.054 -9.235 2.841
600 3HZ LYS 71 3HZ LYS 71 9.084 -8.004 1.681
601 H ILE 72 H ILE 72 3.378 -6.072 4.938
602 HA ILE 72 HA ILE 72 3.155 -4.306 2.799
603 HB ILE 72 HB ILE 72 2.916 -2.535 4.521
604 1HG1 ILE 72 2HG1 ILE 72 3.258 -4.725 6.557
605 2HG1 ILE 72 1HG1 ILE 72 4.591 -3.680 6.079
606 1HG2 ILE 72 1HG2 ILE 72 1.096 -4.207 3.812
607 2HG2 ILE 72 2HG2 ILE 72 0.836 -3.263 5.274
608 3HG2 ILE 72 3HG2 ILE 72 1.356 -4.943 5.391
609 1HD1 ILE 72 1HD1 ILE 72 2.022 -2.483 7.004
610 2HD1 ILE 72 2HD1 ILE 72 3.655 -1.819 7.058
611 3HD1 ILE 72 3HD1 ILE 72 3.189 -3.104 8.173
612 H GLU 73 H GLU 73 4.264 -2.707 2.027
613 HA GLU 73 HA GLU 73 6.679 -1.646 3.151
614 1HB GLU 73 2HB GLU 73 6.855 -3.007 0.454
615 2HB GLU 73 1HB GLU 73 8.168 -2.291 1.378
616 1HG GLU 73 2HG GLU 73 7.982 -4.030 3.055
617 2HG GLU 73 1HG GLU 73 6.602 -4.725 2.205
618 H VAL 74 H VAL 74 7.368 0.285 1.856
619 HA VAL 74 HA VAL 74 5.041 1.342 0.421
620 HB VAL 74 HB VAL 74 5.592 2.798 2.177
621 1HG1 VAL 74 1HG1 VAL 74 7.735 1.957 2.813
622 2HG1 VAL 74 2HG1 VAL 74 7.885 3.691 2.530
623 3HG1 VAL 74 3HG1 VAL 74 8.466 2.547 1.320
624 1HG2 VAL 74 1HG2 VAL 74 7.099 4.147 -0.029
625 2HG2 VAL 74 2HG2 VAL 74 5.939 4.827 1.111
626 3HG2 VAL 74 3HG2 VAL 74 5.380 3.793 -0.203
627 H GLU 75 H GLU 75 5.193 2.276 -1.602
628 HA GLU 75 HA GLU 75 7.719 1.819 -3.051
629 1HB GLU 75 2HB GLU 75 5.562 0.296 -3.445
630 2HB GLU 75 1HB GLU 75 5.136 1.625 -4.512
631 1HG GLU 75 2HG GLU 75 6.454 0.804 -6.081
632 2HG GLU 75 1HG GLU 75 7.843 0.946 -5.007
633 H PHE 76 H PHE 76 4.572 3.341 -3.792
634 HA PHE 76 HA PHE 76 5.973 5.873 -4.257
635 1HB PHE 76 2HB PHE 76 4.540 6.150 -6.350
636 2HB PHE 76 1HB PHE 76 5.885 5.020 -6.458
637 HD1 PHE 76 1HD PHE 76 2.304 5.434 -6.617
638 HD2 PHE 76 2HD PHE 76 5.450 2.579 -6.373
639 HE1 PHE 76 1HE PHE 76 0.753 3.669 -7.349
640 HE2 PHE 76 2HE PHE 76 3.906 0.809 -7.106
641 HZ PHE 76 HZ PHE 76 1.554 1.353 -7.595
642 H ASP 77 H ASP 77 4.588 7.738 -4.287
643 HA ASP 77 HA ASP 77 2.171 7.334 -2.671
644 1HB ASP 77 2HB ASP 77 4.253 9.429 -2.792
645 2HB ASP 77 1HB ASP 77 2.607 10.012 -2.564
646 H LYS 78 H LYS 78 0.311 8.711 -3.105
647 HA LYS 78 HA LYS 78 -0.164 8.925 -5.960
648 1HB LYS 78 2HB LYS 78 -1.825 7.880 -4.420
649 2HB LYS 78 1HB LYS 78 -2.063 9.452 -3.668
650 1HG LYS 78 2HG LYS 78 -3.836 9.064 -5.222
651 2HG LYS 78 1HG LYS 78 -2.796 10.339 -5.862
652 1HD LYS 78 2HD LYS 78 -1.674 8.049 -6.897
653 2HD LYS 78 1HD LYS 78 -3.403 7.695 -6.938
654 1HE LYS 78 2HE LYS 78 -3.745 9.891 -8.079
655 2HE LYS 78 1HE LYS 78 -1.992 10.058 -8.169
656 1HZ LYS 78 1HZ LYS 78 -2.071 7.807 -9.334
657 2HZ LYS 78 2HZ LYS 78 -2.592 9.156 -10.209
658 3HZ LYS 78 3HZ LYS 78 -3.725 8.097 -9.536
659 H GLY 79 H GLY 79 -0.059 11.038 -3.124
660 1HA GLY 79 2HA GLY 79 0.819 13.274 -3.343
661 2HA GLY 79 1HA GLY 79 0.145 13.330 -4.965
662 H GLN 80 H GLN 80 -1.705 12.027 -2.327
663 HA GLN 80 HA GLN 80 -3.384 14.451 -2.354
664 1HB GLN 80 2HB GLN 80 -4.206 11.557 -2.059
665 2HB GLN 80 1HB GLN 80 -5.290 12.919 -1.814
666 1HG GLN 80 2HG GLN 80 -4.492 13.565 -4.232
667 2HG GLN 80 1HG GLN 80 -4.130 11.843 -4.327
668 1HE2 GLN 80 1HE2 GLN 80 -5.721 10.516 -4.861
669 2HE2 GLN 80 2HE2 GLN 80 -7.403 10.910 -4.869
670 H ARG 81 H ARG 81 -2.154 11.771 -0.426
671 HA ARG 81 HA ARG 81 -1.522 11.685 1.750
672 1HB ARG 81 2HB ARG 81 -0.929 13.586 2.775
673 2HB ARG 81 1HB ARG 81 -1.437 14.381 1.297
674 1HG ARG 81 2HG ARG 81 -2.416 15.609 3.015
675 2HG ARG 81 1HG ARG 81 -3.725 14.607 2.399
676 1HD ARG 81 2HD ARG 81 -4.057 13.981 4.517
677 2HD ARG 81 1HD ARG 81 -2.577 13.037 4.360
678 HE ARG 81 HE ARG 81 -1.627 14.458 5.855
679 1HH1 ARG 81 1HH1 ARG 81 -4.205 16.168 4.238
680 2HH1 ARG 81 2HH1 ARG 81 -3.987 17.620 5.159
681 1HH2 ARG 81 1HH2 ARG 81 -1.340 16.367 7.067
682 2HH2 ARG 81 2HH2 ARG 81 -2.363 17.732 6.764
683 H THR 82 H THR 82 -4.641 13.411 1.450
684 HA THR 82 HA THR 82 -5.726 11.510 3.413
685 HB THR 82 HB THR 82 -6.000 13.667 4.300
686 HG1 THR 82 1HG THR 82 -8.435 13.210 2.926
687 1HG2 THR 82 1HG2 THR 82 -7.319 15.401 2.858
688 2HG2 THR 82 2HG2 THR 82 -6.623 14.498 1.513
689 3HG2 THR 82 3HG2 THR 82 -5.568 15.251 2.709
690 H ASP 83 H ASP 83 -7.022 9.977 2.645
691 HA ASP 83 HA ASP 83 -8.443 10.504 0.117
692 1HB ASP 83 2HB ASP 83 -6.760 8.306 0.933
693 2HB ASP 83 1HB ASP 83 -8.371 7.723 0.527
694 H LYS 84 H LYS 84 -8.675 8.617 3.136
695 HA LYS 84 HA LYS 84 -11.606 8.767 2.896
696 1HB LYS 84 2HB LYS 84 -10.693 6.483 2.934
697 2HB LYS 84 1HB LYS 84 -9.924 6.817 4.480
698 1HG LYS 84 2HG LYS 84 -11.872 6.669 5.642
699 2HG LYS 84 1HG LYS 84 -12.851 7.240 4.289
700 1HD LYS 84 2HD LYS 84 -11.517 4.663 3.839
701 2HD LYS 84 1HD LYS 84 -12.720 4.656 5.130
702 1HE LYS 84 2HE LYS 84 -14.256 4.398 3.538
703 2HE LYS 84 1HE LYS 84 -13.939 6.073 3.087
704 1HZ LYS 84 1HZ LYS 84 -11.989 4.874 1.771
705 2HZ LYS 84 2HZ LYS 84 -13.526 5.104 1.106
706 3HZ LYS 84 3HZ LYS 84 -13.112 3.608 1.777
707 H TYR 85 H TYR 85 -9.190 8.516 5.514
708 HA TYR 85 HA TYR 85 -10.875 10.306 7.121
709 1HB TYR 85 2HB TYR 85 -8.657 8.421 7.947
710 2HB TYR 85 1HB TYR 85 -9.543 9.469 9.050
711 HD1 TYR 85 1HD TYR 85 -12.040 9.112 9.308
712 HD2 TYR 85 2HD TYR 85 -9.513 6.318 7.332
713 HE1 TYR 85 1HE TYR 85 -13.754 7.372 9.589
714 HE2 TYR 85 2HE TYR 85 -11.221 4.570 7.606
715 HH TYR 85 HH TYR 85 -13.131 4.072 9.048
716 H GLY 86 H GLY 86 -7.627 9.894 5.836
717 1HA GLY 86 2HA GLY 86 -6.413 11.872 5.170
718 2HA GLY 86 1HA GLY 86 -7.097 12.703 6.555
719 H ARG 87 H ARG 87 -5.374 9.597 6.172
720 HA ARG 87 HA ARG 87 -3.349 10.625 8.042
721 1HB ARG 87 2HB ARG 87 -4.489 7.826 8.094
722 2HB ARG 87 1HB ARG 87 -3.278 8.484 9.187
723 1HG ARG 87 2HG ARG 87 -4.848 9.917 10.217
724 2HG ARG 87 1HG ARG 87 -6.047 9.622 8.957
725 1HD ARG 87 2HD ARG 87 -6.397 7.393 9.691
726 2HD ARG 87 1HD ARG 87 -4.994 7.454 10.758
727 HE ARG 87 HE ARG 87 -7.638 8.424 11.313
728 1HH1 ARG 87 1HH1 ARG 87 -4.253 8.769 12.089
729 2HH1 ARG 87 2HH1 ARG 87 -4.552 9.446 13.655
730 1HH2 ARG 87 1HH2 ARG 87 -8.034 9.313 13.374
731 2HH2 ARG 87 2HH2 ARG 87 -6.698 9.753 14.384
732 H GLY 88 H GLY 88 -1.749 10.930 6.574
733 1HA GLY 88 2HA GLY 88 -0.069 10.426 5.092
734 2HA GLY 88 1HA GLY 88 -0.076 8.849 5.857
735 H LEU 89 H LEU 89 0.634 9.004 3.251
736 HA LEU 89 HA LEU 89 -1.693 7.822 1.893
737 1HB LEU 89 2HB LEU 89 -0.832 8.766 -0.232
738 2HB LEU 89 1HB LEU 89 -1.379 9.973 0.913
739 HG LEU 89 HG LEU 89 1.531 9.275 0.763
740 1HD1 LEU 89 1HD1 LEU 89 0.941 9.711 -1.526
741 2HD1 LEU 89 2HD1 LEU 89 1.809 11.101 -0.874
742 3HD1 LEU 89 3HD1 LEU 89 0.056 11.163 -1.060
743 1HD2 LEU 89 1HD2 LEU 89 1.843 11.122 2.002
744 2HD2 LEU 89 2HD2 LEU 89 0.145 10.904 2.422
745 3HD2 LEU 89 3HD2 LEU 89 0.599 12.033 1.146
746 H ALA 90 H ALA 90 -1.140 5.679 2.101
747 HA ALA 90 HA ALA 90 0.806 4.710 0.310
748 1HB ALA 90 1HB ALA 90 1.992 5.359 2.645
749 2HB ALA 90 2HB ALA 90 2.575 4.111 1.544
750 3HB ALA 90 3HB ALA 90 1.583 3.666 2.931
751 H TYR 91 H TYR 91 0.681 2.514 -0.107
752 HA TYR 91 HA TYR 91 -1.833 1.345 0.737
753 1HB TYR 91 2HB TYR 91 -0.060 0.011 -1.254
754 2HB TYR 91 1HB TYR 91 -1.812 0.184 -1.248
755 HD1 TYR 91 1HD TYR 91 -1.623 3.275 -0.737
756 HD2 TYR 91 2HD TYR 91 0.122 0.672 -3.605
757 HE1 TYR 91 1HE TYR 91 -1.444 5.153 -2.288
758 HE2 TYR 91 2HE TYR 91 0.310 2.548 -5.189
759 HH TYR 91 HH TYR 91 -1.305 5.177 -5.134
760 H ILE 92 H ILE 92 -2.082 -0.476 1.863
761 HA ILE 92 HA ILE 92 0.252 -1.562 3.219
762 HB ILE 92 HB ILE 92 -2.721 -1.905 3.620
763 1HG1 ILE 92 2HG1 ILE 92 -2.094 -0.934 5.882
764 2HG1 ILE 92 1HG1 ILE 92 -0.505 -0.606 5.198
765 1HG2 ILE 92 1HG2 ILE 92 -0.910 -3.898 4.192
766 2HG2 ILE 92 2HG2 ILE 92 -2.491 -3.690 4.937
767 3HG2 ILE 92 3HG2 ILE 92 -1.055 -3.035 5.721
768 1HD1 ILE 92 1HD1 ILE 92 -2.645 1.090 5.161
769 2HD1 ILE 92 2HD1 ILE 92 -2.692 0.377 3.548
770 3HD1 ILE 92 3HD1 ILE 92 -1.233 1.193 4.110
771 H TYR 93 H TYR 93 1.328 -3.123 2.162
772 HA TYR 93 HA TYR 93 -0.110 -4.932 0.387
773 1HB TYR 93 2HB TYR 93 2.746 -4.248 0.870
774 2HB TYR 93 1HB TYR 93 2.396 -5.861 0.260
775 HD1 TYR 93 1HD TYR 93 0.807 -2.566 -0.488
776 HD2 TYR 93 2HD TYR 93 3.007 -5.889 -1.977
777 HE1 TYR 93 1HE TYR 93 0.629 -1.656 -2.764
778 HE2 TYR 93 2HE TYR 93 2.836 -4.988 -4.257
779 HH TYR 93 HH TYR 93 2.300 -2.089 -5.055
780 H ALA 94 H ALA 94 -0.984 -6.739 1.125
781 HA ALA 94 HA ALA 94 0.210 -8.025 3.494
782 1HB ALA 94 1HB ALA 94 -2.212 -9.110 3.495
783 2HB ALA 94 2HB ALA 94 -2.603 -7.616 2.645
784 3HB ALA 94 3HB ALA 94 -1.883 -7.552 4.254
785 H ASP 95 H ASP 95 1.195 -9.889 3.139
786 HA ASP 95 HA ASP 95 2.006 -11.708 2.017
787 1HB ASP 95 2HB ASP 95 0.380 -13.439 1.643
788 2HB ASP 95 1HB ASP 95 -0.092 -12.548 3.084
789 H GLY 96 H GLY 96 2.139 -9.511 0.416
790 1HA GLY 96 2HA GLY 96 2.317 -8.835 -1.778
791 2HA GLY 96 1HA GLY 96 2.523 -10.543 -2.126
792 H LYS 97 H LYS 97 -0.466 -9.646 -0.680
793 HA LYS 97 HA LYS 97 -1.792 -9.487 -3.287
794 1HB LYS 97 2HB LYS 97 -1.779 -11.808 -1.761
795 2HB LYS 97 1HB LYS 97 -3.320 -11.059 -1.366
796 1HG LYS 97 2HG LYS 97 -4.100 -11.211 -3.538
797 2HG LYS 97 1HG LYS 97 -2.478 -11.354 -4.217
798 1HD LYS 97 2HD LYS 97 -3.693 -13.454 -2.436
799 2HD LYS 97 1HD LYS 97 -3.875 -13.469 -4.191
800 1HE LYS 97 2HE LYS 97 -1.929 -14.534 -4.322
801 2HE LYS 97 1HE LYS 97 -1.143 -13.078 -3.715
802 1HZ LYS 97 1HZ LYS 97 -0.481 -14.473 -2.100
803 2HZ LYS 97 2HZ LYS 97 -1.750 -15.564 -2.346
804 3HZ LYS 97 3HZ LYS 97 -2.008 -14.156 -1.444
805 H MET 98 H MET 98 -3.065 -7.756 -3.330
806 HA MET 98 HA MET 98 -3.626 -6.207 -1.032
807 1HB MET 98 2HB MET 98 -4.626 -6.147 -3.868
808 2HB MET 98 1HB MET 98 -5.280 -5.058 -2.653
809 1HG MET 98 2HG MET 98 -3.653 -3.721 -3.461
810 2HG MET 98 1HG MET 98 -2.703 -4.578 -2.249
811 1HE MET 98 1HE MET 98 -4.185 -4.926 -5.616
812 2HE MET 98 2HE MET 98 -3.461 -6.486 -6.002
813 3HE MET 98 3HE MET 98 -2.817 -5.012 -6.725
814 H VAL 99 H VAL 99 -5.118 -6.508 0.477
815 HA VAL 99 HA VAL 99 -6.946 -8.611 0.494
816 HB VAL 99 HB VAL 99 -6.195 -7.476 2.537
817 1HG1 VAL 99 1HG1 VAL 99 -8.125 -5.252 2.052
818 2HG1 VAL 99 2HG1 VAL 99 -6.499 -5.158 1.377
819 3HG1 VAL 99 3HG1 VAL 99 -6.722 -5.313 3.120
820 1HG2 VAL 99 1HG2 VAL 99 -9.181 -7.473 2.111
821 2HG2 VAL 99 2HG2 VAL 99 -8.391 -7.381 3.686
822 3HG2 VAL 99 3HG2 VAL 99 -8.190 -8.816 2.681
823 H ASN 100 H ASN 100 -7.291 -5.295 -0.598
824 HA ASN 100 HA ASN 100 -8.912 -4.227 -1.780
825 1HB ASN 100 2HB ASN 100 -9.840 -7.043 -2.385
826 2HB ASN 100 1HB ASN 100 -10.357 -5.593 -3.238
827 1HD2 ASN 100 1HD2 ASN 100 -8.439 -8.166 -3.504
828 2HD2 ASN 100 2HD2 ASN 100 -7.192 -7.531 -4.516
829 H GLU 101 H GLU 101 -10.143 -3.116 -0.378
830 HA GLU 101 HA GLU 101 -12.558 -4.443 0.634
831 1HB GLU 101 2HB GLU 101 -10.897 -2.523 2.273
832 2HB GLU 101 1HB GLU 101 -12.339 -3.384 2.794
833 1HG GLU 101 2HG GLU 101 -10.515 -5.332 1.899
834 2HG GLU 101 1HG GLU 101 -9.606 -4.201 2.902
835 H ALA 102 H ALA 102 -14.282 -3.411 -0.107
836 HA ALA 102 HA ALA 102 -14.579 -0.580 0.101
837 1HB ALA 102 1HB ALA 102 -14.739 -1.475 -2.735
838 2HB ALA 102 2HB ALA 102 -13.159 -1.096 -2.047
839 3HB ALA 102 3HB ALA 102 -14.428 0.130 -2.073
840 H LEU 103 H LEU 103 -16.690 -0.039 0.196
841 HA LEU 103 HA LEU 103 -18.950 -0.268 0.293
842 1HB LEU 103 2HB LEU 103 -18.451 -2.067 -2.079
843 2HB LEU 103 1HB LEU 103 -20.035 -1.522 -1.562
844 HG LEU 103 HG LEU 103 -17.875 0.434 -2.294
845 1HD1 LEU 103 1HD1 LEU 103 -17.961 -0.656 -4.306
846 2HD1 LEU 103 2HD1 LEU 103 -19.288 0.489 -4.503
847 3HD1 LEU 103 3HD1 LEU 103 -19.626 -1.188 -4.072
848 1HD2 LEU 103 1HD2 LEU 103 -19.703 1.946 -2.617
849 2HD2 LEU 103 2HD2 LEU 103 -19.889 1.188 -1.036
850 3HD2 LEU 103 3HD2 LEU 103 -20.879 0.652 -2.394
851 H VAL 104 H VAL 104 -20.746 -1.845 0.674
852 HA VAL 104 HA VAL 104 -19.741 -4.377 1.796
853 HB VAL 104 HB VAL 104 -21.906 -2.697 3.063
854 1HG1 VAL 104 1HG1 VAL 104 -22.341 -4.736 3.933
855 2HG1 VAL 104 2HG1 VAL 104 -21.002 -4.321 5.003
856 3HG1 VAL 104 3HG1 VAL 104 -20.721 -5.346 3.595
857 1HG2 VAL 104 1HG2 VAL 104 -20.152 -1.367 3.610
858 2HG2 VAL 104 2HG2 VAL 104 -18.965 -2.654 3.386
859 3HG2 VAL 104 3HG2 VAL 104 -19.931 -2.591 4.860
860 H ARG 105 H ARG 105 -20.501 -5.753 0.268
861 HA ARG 105 HA ARG 105 -21.987 -7.081 -0.827
862 1HB ARG 105 2HB ARG 105 -23.476 -6.080 1.459
863 2HB ARG 105 1HB ARG 105 -24.529 -6.377 0.082
864 1HG ARG 105 2HG ARG 105 -23.089 -8.640 0.041
865 2HG ARG 105 1HG ARG 105 -23.029 -8.272 1.766
866 1HD ARG 105 2HD ARG 105 -25.443 -8.174 1.866
867 2HD ARG 105 1HD ARG 105 -25.553 -8.411 0.123
868 HE ARG 105 HE ARG 105 -25.122 -10.427 2.124
869 1HH1 ARG 105 1HH1 ARG 105 -24.676 -9.595 -1.236
870 2HH1 ARG 105 2HH1 ARG 105 -24.592 -11.242 -1.762
871 1HH2 ARG 105 1HH2 ARG 105 -25.012 -12.595 1.434
872 2HH2 ARG 105 2HH2 ARG 105 -24.782 -12.945 -0.248
873 H GLN 106 H GLN 106 -24.046 -4.231 -0.281
874 HA GLN 106 HA GLN 106 -23.781 -3.461 -3.074
875 1HB GLN 106 2HB GLN 106 -26.105 -4.849 -1.991
876 2HB GLN 106 1HB GLN 106 -26.528 -3.300 -2.707
877 1HG GLN 106 2HG GLN 106 -24.968 -4.225 -4.652
878 2HG GLN 106 1HG GLN 106 -25.500 -5.764 -3.976
879 1HE2 GLN 106 1HE2 GLN 106 -26.433 -5.893 -6.190
880 2HE2 GLN 106 2HE2 GLN 106 -28.022 -5.256 -6.427
881 H GLY 107 H GLY 107 -25.452 -2.846 0.003
882 1HA GLY 107 2HA GLY 107 -24.658 -0.054 -0.142
883 2HA GLY 107 1HA GLY 107 -26.389 -0.348 -0.197
884 H LEU 108 H LEU 108 -23.527 -1.257 1.721
885 HA LEU 108 HA LEU 108 -23.205 -1.451 3.963
886 1HB LEU 108 2HB LEU 108 -24.216 0.911 3.775
887 2HB LEU 108 1HB LEU 108 -25.691 0.184 4.382
888 HG LEU 108 HG LEU 108 -24.557 -0.475 6.436
889 1HD1 LEU 108 1HD1 LEU 108 -22.204 0.777 6.635
890 2HD1 LEU 108 2HD1 LEU 108 -22.175 0.384 4.917
891 3HD1 LEU 108 3HD1 LEU 108 -22.360 -0.900 6.111
892 1HD2 LEU 108 1HD2 LEU 108 -24.431 2.388 5.577
893 2HD2 LEU 108 2HD2 LEU 108 -23.900 1.908 7.188
894 3HD2 LEU 108 3HD2 LEU 108 -25.561 1.601 6.679
895 H ALA 109 H ALA 109 -24.490 -3.563 2.789
896 HA ALA 109 HA ALA 109 -25.676 -5.443 3.278
897 1HB ALA 109 1HB ALA 109 -25.995 -6.030 5.583
898 2HB ALA 109 2HB ALA 109 -25.812 -4.348 6.082
899 3HB ALA 109 3HB ALA 109 -24.434 -5.225 5.419
900 H LYS 110 H LYS 110 -27.429 -4.787 1.960
901 HA LYS 110 HA LYS 110 -29.677 -3.459 3.257
902 1HB LYS 110 2HB LYS 110 -28.702 -3.216 0.750
903 2HB LYS 110 1HB LYS 110 -29.934 -4.440 0.474
904 1HG LYS 110 2HG LYS 110 -31.622 -2.988 0.747
905 2HG LYS 110 1HG LYS 110 -30.818 -2.144 2.074
906 1HD LYS 110 2HD LYS 110 -30.797 -0.518 0.447
907 2HD LYS 110 1HD LYS 110 -29.237 -1.291 0.164
908 1HE LYS 110 2HE LYS 110 -29.984 -2.391 -1.741
909 2HE LYS 110 1HE LYS 110 -31.680 -2.238 -1.280
910 1HZ LYS 110 1HZ LYS 110 -31.389 0.215 -1.620
911 2HZ LYS 110 2HZ LYS 110 -31.309 -0.720 -3.026
912 3HZ LYS 110 3HZ LYS 110 -29.890 -0.123 -2.326
Start of MODEL 2
1 1H ALA 1 1HT ALA 1 8.139 16.686 -21.987
2 2H ALA 1 2HT ALA 1 6.749 17.670 -22.204
3 3H ALA 1 3HT ALA 1 7.292 16.653 -23.477
4 HA ALA 1 HA ALA 1 5.546 15.512 -22.638
5 1HB ALA 1 1HB ALA 1 6.526 13.546 -22.118
6 2HB ALA 1 2HB ALA 1 7.488 14.245 -20.816
7 3HB ALA 1 3HB ALA 1 8.004 14.432 -22.492
8 H THR 2 H THR 2 5.052 14.170 -20.359
9 HA THR 2 HA THR 2 4.401 16.334 -18.487
10 HB THR 2 HB THR 2 2.650 14.858 -17.640
11 HG1 THR 2 1HG THR 2 3.505 13.004 -19.606
12 1HG2 THR 2 1HG2 THR 2 1.344 15.646 -19.233
13 2HG2 THR 2 2HG2 THR 2 1.829 14.303 -20.268
14 3HG2 THR 2 3HG2 THR 2 2.722 15.823 -20.320
15 H SER 3 H SER 3 5.373 16.456 -16.575
16 HA SER 3 HA SER 3 7.395 14.610 -15.819
17 1HB SER 3 2HB SER 3 7.562 16.970 -15.223
18 2HB SER 3 1HB SER 3 6.100 16.849 -14.244
19 HG SER 3 HG SER 3 7.602 16.527 -12.757
20 H THR 4 H THR 4 7.287 12.827 -14.614
21 HA THR 4 HA THR 4 4.735 12.215 -13.288
22 HB THR 4 HB THR 4 5.946 9.834 -13.303
23 HG1 THR 4 1HG THR 4 7.143 9.623 -15.220
24 1HG2 THR 4 1HG2 THR 4 4.912 10.589 -15.967
25 2HG2 THR 4 2HG2 THR 4 3.826 10.767 -14.589
26 3HG2 THR 4 3HG2 THR 4 4.539 9.195 -14.954
27 H LYS 5 H LYS 5 4.706 11.370 -11.189
28 HA LYS 5 HA LYS 5 6.714 12.410 -9.455
29 1HB LYS 5 2HB LYS 5 4.060 11.513 -9.201
30 2HB LYS 5 1HB LYS 5 5.017 10.465 -8.161
31 1HG LYS 5 2HG LYS 5 5.207 13.462 -8.068
32 2HG LYS 5 1HG LYS 5 4.064 12.538 -7.091
33 1HD LYS 5 2HD LYS 5 5.687 11.705 -5.736
34 2HD LYS 5 1HD LYS 5 6.891 11.664 -7.025
35 1HE LYS 5 2HE LYS 5 5.909 14.259 -5.887
36 2HE LYS 5 1HE LYS 5 7.205 13.350 -5.110
37 1HZ LYS 5 1HZ LYS 5 8.619 13.689 -6.874
38 2HZ LYS 5 2HZ LYS 5 7.778 15.155 -6.844
39 3HZ LYS 5 3HZ LYS 5 7.371 13.970 -7.981
40 H LYS 6 H LYS 6 8.338 11.396 -8.373
41 HA LYS 6 HA LYS 6 9.133 8.792 -9.375
42 1HB LYS 6 2HB LYS 6 10.635 10.899 -8.960
43 2HB LYS 6 1HB LYS 6 10.666 10.317 -7.301
44 1HG LYS 6 2HG LYS 6 12.570 9.389 -8.237
45 2HG LYS 6 1HG LYS 6 11.398 8.074 -8.316
46 1HD LYS 6 2HD LYS 6 11.358 9.806 -10.667
47 2HD LYS 6 1HD LYS 6 12.910 9.006 -10.413
48 1HE LYS 6 2HE LYS 6 10.330 7.480 -10.286
49 2HE LYS 6 1HE LYS 6 11.123 7.807 -11.827
50 1HZ LYS 6 1HZ LYS 6 12.831 6.719 -9.752
51 2HZ LYS 6 2HZ LYS 6 12.749 6.339 -11.398
52 3HZ LYS 6 3HZ LYS 6 11.631 5.669 -10.320
53 H LEU 7 H LEU 7 8.453 7.003 -8.414
54 HA LEU 7 HA LEU 7 7.500 7.053 -5.684
55 1HB LEU 7 2HB LEU 7 6.764 5.634 -7.894
56 2HB LEU 7 1HB LEU 7 7.741 4.453 -7.042
57 HG LEU 7 HG LEU 7 5.292 4.332 -6.550
58 1HD1 LEU 7 1HD1 LEU 7 7.420 3.917 -4.913
59 2HD1 LEU 7 2HD1 LEU 7 5.754 3.490 -4.529
60 3HD1 LEU 7 3HD1 LEU 7 6.434 5.007 -3.940
61 1HD2 LEU 7 1HD2 LEU 7 5.237 6.463 -4.627
62 2HD2 LEU 7 2HD2 LEU 7 4.131 6.129 -5.959
63 3HD2 LEU 7 3HD2 LEU 7 5.572 7.104 -6.235
64 H HIS 8 H HIS 8 8.296 5.729 -3.990
65 HA HIS 8 HA HIS 8 11.112 4.930 -4.342
66 1HB HIS 8 2HB HIS 8 9.745 6.470 -2.208
67 2HB HIS 8 1HB HIS 8 10.960 5.312 -1.681
68 HD1 HIS 8 1HD HIS 8 10.670 8.218 -4.117
69 HD2 HIS 8 2HD HIS 8 13.490 6.280 -1.758
70 HE1 HIS 8 1HE HIS 8 12.777 9.574 -4.338
71 HE2 HIS 8 2HE HIS 8 14.455 8.414 -2.857
72 H LYS 9 H LYS 9 11.723 2.937 -3.688
73 HA LYS 9 HA LYS 9 9.649 1.244 -2.461
74 1HB LYS 9 2HB LYS 9 10.677 -0.665 -3.632
75 2HB LYS 9 1HB LYS 9 10.080 0.556 -4.746
76 1HG LYS 9 2HG LYS 9 12.652 1.356 -4.425
77 2HG LYS 9 1HG LYS 9 12.810 -0.394 -4.272
78 1HD LYS 9 2HD LYS 9 11.407 -0.532 -6.401
79 2HD LYS 9 1HD LYS 9 11.726 1.194 -6.581
80 1HE LYS 9 2HE LYS 9 13.930 0.877 -7.058
81 2HE LYS 9 1HE LYS 9 14.048 -0.573 -6.062
82 1HZ LYS 9 1HZ LYS 9 12.881 -1.811 -7.762
83 2HZ LYS 9 2HZ LYS 9 14.246 -1.069 -8.430
84 3HZ LYS 9 3HZ LYS 9 12.710 -0.420 -8.710
85 H GLU 10 H GLU 10 10.097 0.727 -0.451
86 HA GLU 10 HA GLU 10 12.704 -0.255 0.297
87 1HB GLU 10 2HB GLU 10 12.063 2.464 0.765
88 2HB GLU 10 1HB GLU 10 11.970 1.652 2.320
89 1HG GLU 10 2HG GLU 10 14.190 2.635 1.793
90 2HG GLU 10 1HG GLU 10 14.225 0.912 2.157
91 HA PRO 11 HA PRO 11 10.009 -2.666 2.847
92 1HB PRO 11 2HB PRO 11 11.801 -3.876 4.444
93 2HB PRO 11 1HB PRO 11 11.694 -4.244 2.719
94 1HG PRO 11 2HG PRO 11 13.631 -2.479 4.162
95 2HG PRO 11 1HG PRO 11 13.933 -3.641 2.857
96 1HD PRO 11 2HD PRO 11 13.698 -0.938 2.472
97 2HD PRO 11 1HD PRO 11 13.334 -2.149 1.227
98 H ALA 12 H ALA 12 8.870 -2.451 4.705
99 HA ALA 12 HA ALA 12 9.921 -0.569 6.719
100 1HB ALA 12 1HB ALA 12 7.003 -1.105 6.252
101 2HB ALA 12 2HB ALA 12 7.889 0.120 5.344
102 3HB ALA 12 3HB ALA 12 7.753 0.249 7.098
103 H THR 13 H THR 13 8.019 -1.001 8.701
104 HA THR 13 HA THR 13 8.537 -3.805 9.448
105 HB THR 13 HB THR 13 8.146 -1.843 11.623
106 HG1 THR 13 1HG THR 13 10.306 -1.114 11.431
107 1HG2 THR 13 1HG2 THR 13 10.561 -3.303 11.832
108 2HG2 THR 13 2HG2 THR 13 9.291 -4.411 11.313
109 3HG2 THR 13 3HG2 THR 13 9.087 -3.463 12.786
110 H LEU 14 H LEU 14 7.076 -3.976 11.734
111 HA LEU 14 HA LEU 14 4.522 -4.584 10.867
112 1HB LEU 14 2HB LEU 14 3.916 -4.618 13.293
113 2HB LEU 14 1HB LEU 14 5.326 -5.568 12.867
114 HG LEU 14 HG LEU 14 6.318 -3.035 13.572
115 1HD1 LEU 14 1HD1 LEU 14 4.561 -2.229 14.779
116 2HD1 LEU 14 2HD1 LEU 14 5.366 -3.175 16.031
117 3HD1 LEU 14 3HD1 LEU 14 3.961 -3.836 15.193
118 1HD2 LEU 14 1HD2 LEU 14 6.376 -5.797 14.636
119 2HD2 LEU 14 2HD2 LEU 14 6.904 -4.507 15.717
120 3HD2 LEU 14 3HD2 LEU 14 7.700 -4.733 14.160
121 H ILE 15 H ILE 15 2.456 -3.663 11.421
122 HA ILE 15 HA ILE 15 2.533 -0.718 11.489
123 HB ILE 15 HB ILE 15 0.073 -1.114 10.572
124 1HG1 ILE 15 2HG1 ILE 15 0.072 -2.994 8.942
125 2HG1 ILE 15 1HG1 ILE 15 1.600 -3.546 9.621
126 1HG2 ILE 15 1HG2 ILE 15 1.908 0.161 9.511
127 2HG2 ILE 15 2HG2 ILE 15 0.898 -0.707 8.353
128 3HG2 ILE 15 3HG2 ILE 15 2.487 -1.339 8.785
129 1HD1 ILE 15 1HD1 ILE 15 -0.894 -4.366 10.393
130 2HD1 ILE 15 2HD1 ILE 15 -0.470 -3.182 11.631
131 3HD1 ILE 15 3HD1 ILE 15 0.591 -4.558 11.325
132 H LYS 16 H LYS 16 0.150 0.065 12.173
133 HA LYS 16 HA LYS 16 -0.386 -1.228 14.765
134 1HB LYS 16 2HB LYS 16 0.288 1.446 14.163
135 2HB LYS 16 1HB LYS 16 -1.409 1.460 14.625
136 1HG LYS 16 2HG LYS 16 -0.889 1.246 16.765
137 2HG LYS 16 1HG LYS 16 0.086 -0.188 16.437
138 1HD LYS 16 2HD LYS 16 1.806 1.084 17.122
139 2HD LYS 16 1HD LYS 16 1.705 1.800 15.512
140 1HE LYS 16 2HE LYS 16 0.688 3.708 16.276
141 2HE LYS 16 1HE LYS 16 -0.032 2.898 17.666
142 1HZ LYS 16 1HZ LYS 16 2.879 3.091 17.598
143 2HZ LYS 16 2HZ LYS 16 1.818 3.190 18.913
144 3HZ LYS 16 3HZ LYS 16 2.024 4.522 17.890
145 H ALA 17 H ALA 17 -2.682 -0.617 15.579
146 HA ALA 17 HA ALA 17 -4.553 -1.211 13.388
147 1HB ALA 17 1HB ALA 17 -5.880 -2.402 14.882
148 2HB ALA 17 2HB ALA 17 -5.184 -1.600 16.291
149 3HB ALA 17 3HB ALA 17 -4.239 -2.793 15.398
150 H ILE 18 H ILE 18 -6.026 0.251 12.825
151 HA ILE 18 HA ILE 18 -6.900 2.253 14.774
152 HB ILE 18 HB ILE 18 -6.078 3.044 11.983
153 1HG1 ILE 18 2HG1 ILE 18 -4.116 2.315 13.322
154 2HG1 ILE 18 1HG1 ILE 18 -4.079 4.034 12.941
155 1HG2 ILE 18 1HG2 ILE 18 -7.586 4.634 12.664
156 2HG2 ILE 18 2HG2 ILE 18 -6.079 5.327 13.262
157 3HG2 ILE 18 3HG2 ILE 18 -7.154 4.473 14.367
158 1HD1 ILE 18 1HD1 ILE 18 -5.396 3.585 15.455
159 2HD1 ILE 18 2HD1 ILE 18 -3.975 4.563 15.085
160 3HD1 ILE 18 3HD1 ILE 18 -3.795 2.844 15.440
161 H ASP 19 H ASP 19 -8.870 3.365 14.146
162 HA ASP 19 HA ASP 19 -10.749 1.582 12.943
163 1HB ASP 19 2HB ASP 19 -12.389 3.383 13.386
164 2HB ASP 19 1HB ASP 19 -11.418 3.001 14.804
165 H GLY 20 H GLY 20 -9.360 1.590 10.889
166 1HA GLY 20 2HA GLY 20 -10.724 2.535 8.744
167 2HA GLY 20 1HA GLY 20 -9.663 3.875 9.153
168 H ASP 21 H ASP 21 -8.066 3.901 7.699
169 HA ASP 21 HA ASP 21 -6.782 1.342 7.018
170 1HB ASP 21 2HB ASP 21 -7.071 3.894 5.431
171 2HB ASP 21 1HB ASP 21 -5.982 2.592 4.965
172 H THR 22 H THR 22 -6.375 4.333 8.578
173 HA THR 22 HA THR 22 -3.709 4.958 8.180
174 HB THR 22 HB THR 22 -3.804 6.146 10.275
175 HG1 THR 22 1HG THR 22 -6.195 4.740 10.843
176 1HG2 THR 22 1HG2 THR 22 -5.751 7.484 10.043
177 2HG2 THR 22 2HG2 THR 22 -6.593 6.212 9.160
178 3HG2 THR 22 3HG2 THR 22 -5.215 7.032 8.426
179 H VAL 23 H VAL 23 -2.069 3.580 8.282
180 HA VAL 23 HA VAL 23 -1.857 1.832 10.645
181 HB VAL 23 HB VAL 23 -0.618 0.217 9.270
182 1HG1 VAL 23 1HG1 VAL 23 -3.116 0.599 7.722
183 2HG1 VAL 23 2HG1 VAL 23 -3.260 0.423 9.471
184 3HG1 VAL 23 3HG1 VAL 23 -2.484 -0.842 8.518
185 1HG2 VAL 23 1HG2 VAL 23 -1.137 0.690 6.670
186 2HG2 VAL 23 2HG2 VAL 23 0.369 1.149 7.464
187 3HG2 VAL 23 3HG2 VAL 23 -0.911 2.342 7.246
188 H LYS 24 H LYS 24 -0.227 2.405 11.916
189 HA LYS 24 HA LYS 24 1.850 4.162 10.934
190 1HB LYS 24 2HB LYS 24 0.649 4.303 13.212
191 2HB LYS 24 1HB LYS 24 1.722 3.000 13.704
192 1HG LYS 24 2HG LYS 24 3.625 4.331 13.518
193 2HG LYS 24 1HG LYS 24 2.801 5.527 12.515
194 1HD LYS 24 2HD LYS 24 1.692 5.082 15.219
195 2HD LYS 24 1HD LYS 24 3.268 5.871 15.135
196 1HE LYS 24 2HE LYS 24 2.376 7.782 14.406
197 2HE LYS 24 1HE LYS 24 1.394 6.951 13.200
198 1HZ LYS 24 1HZ LYS 24 -0.385 6.878 14.565
199 2HZ LYS 24 2HZ LYS 24 0.354 8.227 15.265
200 3HZ LYS 24 3HZ LYS 24 0.538 6.701 15.972
201 H LEU 25 H LEU 25 3.438 3.246 9.805
202 HA LEU 25 HA LEU 25 4.704 0.822 10.907
203 1HB LEU 25 2HB LEU 25 5.490 0.433 8.534
204 2HB LEU 25 1HB LEU 25 3.785 0.182 8.836
205 HG LEU 25 HG LEU 25 4.641 2.852 7.835
206 1HD1 LEU 25 1HD1 LEU 25 5.076 0.336 6.421
207 2HD1 LEU 25 2HD1 LEU 25 5.694 1.953 6.083
208 3HD1 LEU 25 3HD1 LEU 25 4.086 1.489 5.526
209 1HD2 LEU 25 1HD2 LEU 25 2.337 1.377 6.736
210 2HD2 LEU 25 2HD2 LEU 25 2.475 3.062 7.241
211 3HD2 LEU 25 3HD2 LEU 25 2.242 1.796 8.446
212 H MET 26 H MET 26 7.047 0.626 10.319
213 HA MET 26 HA MET 26 8.379 3.094 10.983
214 1HB MET 26 2HB MET 26 8.909 0.486 11.539
215 2HB MET 26 1HB MET 26 10.018 0.767 10.204
216 1HG MET 26 2HG MET 26 10.714 2.867 11.535
217 2HG MET 26 1HG MET 26 9.940 2.056 12.897
218 1HE MET 26 1HE MET 26 11.903 0.022 10.009
219 2HE MET 26 2HE MET 26 13.537 0.418 10.539
220 3HE MET 26 3HE MET 26 12.444 1.700 10.018
221 H TYR 27 H TYR 27 8.391 4.520 9.323
222 HA TYR 27 HA TYR 27 9.666 3.627 6.820
223 1HB TYR 27 2HB TYR 27 7.271 4.075 6.470
224 2HB TYR 27 1HB TYR 27 7.479 5.698 7.117
225 HD1 TYR 27 1HD TYR 27 8.740 7.390 5.838
226 HD2 TYR 27 2HD TYR 27 7.914 3.541 4.225
227 HE1 TYR 27 1HE TYR 27 9.279 8.223 3.590
228 HE2 TYR 27 2HE TYR 27 8.450 4.363 1.972
229 HH TYR 27 HH TYR 27 8.425 7.233 1.005
230 H LYS 28 H LYS 28 11.365 4.783 6.123
231 HA LYS 28 HA LYS 28 13.079 6.278 6.130
232 1HB LYS 28 2HB LYS 28 10.660 7.772 6.086
233 2HB LYS 28 1HB LYS 28 11.788 8.626 7.130
234 1HG LYS 28 2HG LYS 28 12.691 7.663 4.455
235 2HG LYS 28 1HG LYS 28 11.724 9.134 4.585
236 1HD LYS 28 2HD LYS 28 13.827 10.023 4.749
237 2HD LYS 28 1HD LYS 28 13.489 9.719 6.455
238 1HE LYS 28 2HE LYS 28 15.689 8.917 5.998
239 2HE LYS 28 1HE LYS 28 14.641 7.516 6.209
240 1HZ LYS 28 1HZ LYS 28 15.603 6.865 4.305
241 2HZ LYS 28 2HZ LYS 28 16.050 8.430 3.849
242 3HZ LYS 28 3HZ LYS 28 14.471 7.889 3.575
243 H GLY 29 H GLY 29 12.458 4.780 8.589
244 1HA GLY 29 2HA GLY 29 13.531 4.618 10.630
245 2HA GLY 29 1HA GLY 29 14.263 6.187 10.329
246 H GLN 30 H GLN 30 10.967 6.464 9.882
247 HA GLN 30 HA GLN 30 10.451 7.055 12.707
248 1HB GLN 30 2HB GLN 30 10.306 8.953 10.400
249 2HB GLN 30 1HB GLN 30 9.164 9.131 11.725
250 1HG GLN 30 2HG GLN 30 10.740 9.854 13.172
251 2HG GLN 30 1HG GLN 30 12.008 8.852 12.466
252 1HE2 GLN 30 1HE2 GLN 30 12.654 11.352 13.145
253 2HE2 GLN 30 2HE2 GLN 30 12.845 12.348 11.746
254 HA PRO 31 HA PRO 31 6.622 5.016 11.816
255 1HB PRO 31 2HB PRO 31 5.154 5.832 13.930
256 2HB PRO 31 1HB PRO 31 6.483 4.678 14.092
257 1HG PRO 31 2HG PRO 31 6.450 7.619 14.650
258 2HG PRO 31 1HG PRO 31 7.175 6.308 15.599
259 1HD PRO 31 2HD PRO 31 8.615 7.905 13.934
260 2HD PRO 31 1HD PRO 31 9.054 6.220 14.279
261 H MET 32 H MET 32 5.036 5.503 10.437
262 HA MET 32 HA MET 32 3.706 8.106 10.627
263 1HB MET 32 2HB MET 32 4.730 6.965 8.024
264 2HB MET 32 1HB MET 32 3.876 8.486 8.237
265 1HG MET 32 2HG MET 32 5.699 9.497 9.291
266 2HG MET 32 1HG MET 32 6.489 7.952 9.598
267 1HE MET 32 1HE MET 32 8.137 10.569 6.730
268 2HE MET 32 2HE MET 32 8.420 10.105 8.408
269 3HE MET 32 3HE MET 32 6.954 10.981 7.971
270 H THR 33 H THR 33 1.556 8.017 10.312
271 HA THR 33 HA THR 33 0.370 5.409 9.844
272 HB THR 33 HB THR 33 -1.735 7.140 10.153
273 HG1 THR 33 1HG THR 33 -0.510 8.926 10.573
274 1HG2 THR 33 1HG2 THR 33 -0.411 6.286 12.654
275 2HG2 THR 33 2HG2 THR 33 -0.883 5.030 11.509
276 3HG2 THR 33 3HG2 THR 33 -2.095 6.141 12.148
277 H PHE 34 H PHE 34 -0.549 4.768 8.003
278 HA PHE 34 HA PHE 34 -1.338 6.766 6.011
279 1HB PHE 34 2HB PHE 34 0.430 4.376 5.453
280 2HB PHE 34 1HB PHE 34 -0.278 5.412 4.219
281 HD1 PHE 34 1HD PHE 34 0.205 8.020 4.680
282 HD2 PHE 34 2HD PHE 34 2.615 4.770 5.991
283 HE1 PHE 34 1HE PHE 34 2.145 9.525 4.830
284 HE2 PHE 34 2HE PHE 34 4.560 6.267 6.144
285 HZ PHE 34 HZ PHE 34 4.325 8.649 5.564
286 H ARG 35 H ARG 35 -2.791 5.919 4.364
287 HA ARG 35 HA ARG 35 -4.438 3.739 5.422
288 1HB ARG 35 2HB ARG 35 -6.138 4.684 3.754
289 2HB ARG 35 1HB ARG 35 -5.771 5.657 5.173
290 1HG ARG 35 2HG ARG 35 -4.520 7.193 3.945
291 2HG ARG 35 1HG ARG 35 -4.341 6.093 2.577
292 1HD ARG 35 2HD ARG 35 -6.830 6.253 2.259
293 2HD ARG 35 1HD ARG 35 -6.829 7.540 3.464
294 HE ARG 35 HE ARG 35 -4.959 8.294 1.606
295 1HH1 ARG 35 1HH1 ARG 35 -8.359 7.512 1.544
296 2HH1 ARG 35 2HH1 ARG 35 -8.704 8.563 0.211
297 1HH2 ARG 35 1HH2 ARG 35 -5.410 9.676 -0.147
298 2HH2 ARG 35 2HH2 ARG 35 -7.030 9.790 -0.749
299 H LEU 36 H LEU 36 -4.331 1.822 4.476
300 HA LEU 36 HA LEU 36 -2.736 1.060 2.412
301 1HB LEU 36 2HB LEU 36 -5.347 -0.067 3.374
302 2HB LEU 36 1HB LEU 36 -4.466 -0.824 2.063
303 HG LEU 36 HG LEU 36 -3.885 -2.014 4.020
304 1HD1 LEU 36 1HD1 LEU 36 -1.558 -0.153 3.866
305 2HD1 LEU 36 2HD1 LEU 36 -2.013 -1.105 2.453
306 3HD1 LEU 36 3HD1 LEU 36 -1.589 -1.914 3.961
307 1HD2 LEU 36 1HD2 LEU 36 -2.893 0.387 5.469
308 2HD2 LEU 36 2HD2 LEU 36 -3.503 -1.143 6.099
309 3HD2 LEU 36 3HD2 LEU 36 -4.626 0.057 5.461
310 H LEU 37 H LEU 37 -3.032 0.568 0.200
311 HA LEU 37 HA LEU 37 -4.290 2.557 -1.309
312 1HB LEU 37 2HB LEU 37 -3.721 1.247 -3.250
313 2HB LEU 37 1HB LEU 37 -2.396 1.200 -2.104
314 HG LEU 37 HG LEU 37 -3.658 -1.047 -1.364
315 1HD1 LEU 37 1HD1 LEU 37 -4.127 -2.077 -3.772
316 2HD1 LEU 37 2HD1 LEU 37 -4.610 -0.413 -4.095
317 3HD1 LEU 37 3HD1 LEU 37 -5.391 -1.322 -2.801
318 1HD2 LEU 37 1HD2 LEU 37 -1.817 -0.913 -3.746
319 2HD2 LEU 37 2HD2 LEU 37 -2.016 -2.256 -2.619
320 3HD2 LEU 37 3HD2 LEU 37 -1.291 -0.745 -2.071
321 H LEU 38 H LEU 38 -6.220 2.711 -2.334
322 HA LEU 38 HA LEU 38 -8.080 0.446 -2.132
323 1HB LEU 38 2HB LEU 38 -8.898 3.300 -1.618
324 2HB LEU 38 1HB LEU 38 -9.871 1.856 -1.411
325 HG LEU 38 HG LEU 38 -7.438 2.526 0.245
326 1HD1 LEU 38 1HD1 LEU 38 -8.739 3.554 1.773
327 2HD1 LEU 38 2HD1 LEU 38 -10.133 2.524 1.440
328 3HD1 LEU 38 3HD1 LEU 38 -9.758 3.875 0.370
329 1HD2 LEU 38 1HD2 LEU 38 -9.491 0.593 1.130
330 2HD2 LEU 38 2HD2 LEU 38 -7.743 0.584 1.367
331 3HD2 LEU 38 3HD2 LEU 38 -8.428 0.076 -0.177
332 H VAL 39 H VAL 39 -10.054 0.821 -3.541
333 HA VAL 39 HA VAL 39 -9.240 1.232 -6.198
334 HB VAL 39 HB VAL 39 -12.075 1.295 -5.158
335 1HG1 VAL 39 1HG1 VAL 39 -12.191 1.984 -7.370
336 2HG1 VAL 39 2HG1 VAL 39 -12.425 0.241 -7.496
337 3HG1 VAL 39 3HG1 VAL 39 -10.854 0.948 -7.867
338 1HG2 VAL 39 1HG2 VAL 39 -12.085 -0.943 -4.929
339 2HG2 VAL 39 2HG2 VAL 39 -10.343 -0.747 -4.745
340 3HG2 VAL 39 3HG2 VAL 39 -11.021 -1.192 -6.311
341 H ASP 40 H ASP 40 -9.995 2.827 -7.724
342 HA ASP 40 HA ASP 40 -9.875 5.496 -6.617
343 1HB ASP 40 2HB ASP 40 -10.157 4.657 -9.510
344 2HB ASP 40 1HB ASP 40 -9.674 6.242 -8.914
345 H THR 41 H THR 41 -11.532 6.838 -6.307
346 HA THR 41 HA THR 41 -14.163 6.061 -7.387
347 HB THR 41 HB THR 41 -13.478 7.481 -4.806
348 HG1 THR 41 1HG THR 41 -13.300 5.119 -4.974
349 1HG2 THR 41 1HG2 THR 41 -15.497 8.397 -4.883
350 2HG2 THR 41 2HG2 THR 41 -16.131 6.764 -4.676
351 3HG2 THR 41 3HG2 THR 41 -15.964 7.446 -6.294
352 HA PRO 42 HA PRO 42 -13.222 10.004 -9.536
353 1HB PRO 42 2HB PRO 42 -15.440 9.028 -11.233
354 2HB PRO 42 1HB PRO 42 -13.817 9.554 -11.695
355 1HG PRO 42 2HG PRO 42 -14.499 6.973 -11.772
356 2HG PRO 42 1HG PRO 42 -12.878 7.481 -11.262
357 1HD PRO 42 2HD PRO 42 -15.211 6.626 -9.583
358 2HD PRO 42 1HD PRO 42 -13.492 6.208 -9.417
359 H GLU 43 H GLU 43 -14.562 11.873 -10.013
360 HA GLU 43 HA GLU 43 -16.532 12.316 -7.993
361 1HB GLU 43 2HB GLU 43 -14.918 13.906 -9.714
362 2HB GLU 43 1HB GLU 43 -16.591 14.383 -9.966
363 1HG GLU 43 2HG GLU 43 -16.812 14.662 -7.503
364 2HG GLU 43 1HG GLU 43 -15.081 14.352 -7.364
365 H THR 44 H THR 44 -18.401 13.943 -9.253
366 HA THR 44 HA THR 44 -20.250 12.003 -10.203
367 HB THR 44 HB THR 44 -20.682 14.943 -10.574
368 HG1 THR 44 1HG THR 44 -20.622 13.567 -8.100
369 1HG2 THR 44 1HG2 THR 44 -22.336 12.618 -10.476
370 2HG2 THR 44 2HG2 THR 44 -22.769 14.285 -10.854
371 3HG2 THR 44 3HG2 THR 44 -22.782 13.727 -9.180
372 H LYS 45 H LYS 45 -21.254 11.875 -12.249
373 HA LYS 45 HA LYS 45 -21.302 11.774 -14.520
374 1HB LYS 45 2HB LYS 45 -20.174 14.490 -14.010
375 2HB LYS 45 1HB LYS 45 -20.138 13.865 -15.653
376 1HG LYS 45 2HG LYS 45 -22.115 15.107 -15.510
377 2HG LYS 45 1HG LYS 45 -22.622 13.421 -15.379
378 1HD LYS 45 2HD LYS 45 -22.095 14.256 -12.757
379 2HD LYS 45 1HD LYS 45 -22.969 15.590 -13.512
380 1HE LYS 45 2HE LYS 45 -24.625 13.840 -14.323
381 2HE LYS 45 1HE LYS 45 -23.835 12.726 -13.209
382 1HZ LYS 45 1HZ LYS 45 -25.901 14.218 -12.521
383 2HZ LYS 45 2HZ LYS 45 -24.662 15.297 -12.119
384 3HZ LYS 45 3HZ LYS 45 -24.705 13.758 -11.416
385 H HIS 46 H HIS 46 -18.927 10.803 -12.917
386 HA HIS 46 HA HIS 46 -17.032 10.606 -15.166
387 1HB HIS 46 2HB HIS 46 -16.601 11.214 -12.318
388 2HB HIS 46 1HB HIS 46 -15.518 9.988 -12.970
389 HD1 HIS 46 1HD HIS 46 -15.265 11.286 -15.840
390 HD2 HIS 46 2HD HIS 46 -14.757 13.259 -12.219
391 HE1 HIS 46 1HE HIS 46 -13.820 13.278 -16.357
392 HE2 HIS 46 2HE HIS 46 -13.457 14.410 -14.137
393 HA PRO 47 HA PRO 47 -17.074 6.207 -15.324
394 1HB PRO 47 2HB PRO 47 -14.566 5.570 -14.154
395 2HB PRO 47 1HB PRO 47 -14.937 5.721 -15.873
396 1HG PRO 47 2HG PRO 47 -13.709 7.689 -14.021
397 2HG PRO 47 1HG PRO 47 -13.461 7.471 -15.763
398 1HD PRO 47 2HD PRO 47 -14.887 9.524 -14.805
399 2HD PRO 47 1HD PRO 47 -15.354 8.703 -16.309
400 H LYS 48 H LYS 48 -17.395 4.333 -14.049
401 HA LYS 48 HA LYS 48 -18.632 4.636 -11.632
402 1HB LYS 48 2HB LYS 48 -18.195 2.192 -11.273
403 2HB LYS 48 1HB LYS 48 -18.882 2.593 -12.842
404 1HG LYS 48 2HG LYS 48 -17.268 1.184 -13.547
405 2HG LYS 48 1HG LYS 48 -16.302 2.659 -13.501
406 1HD LYS 48 2HD LYS 48 -15.017 1.008 -12.402
407 2HD LYS 48 1HD LYS 48 -15.689 2.026 -11.128
408 1HE LYS 48 2HE LYS 48 -17.576 0.318 -10.990
409 2HE LYS 48 1HE LYS 48 -16.548 -0.729 -11.969
410 1HZ LYS 48 1HZ LYS 48 -14.804 -0.391 -10.222
411 2HZ LYS 48 2HZ LYS 48 -16.154 -1.280 -9.723
412 3HZ LYS 48 3HZ LYS 48 -15.990 0.338 -9.261
413 H LYS 49 H LYS 49 -18.070 4.171 -9.456
414 HA LYS 49 HA LYS 49 -15.266 4.783 -8.846
415 1HB LYS 49 2HB LYS 49 -16.186 5.357 -6.563
416 2HB LYS 49 1HB LYS 49 -16.712 6.399 -7.878
417 1HG LYS 49 2HG LYS 49 -18.839 5.234 -7.981
418 2HG LYS 49 1HG LYS 49 -18.310 4.128 -6.711
419 1HD LYS 49 2HD LYS 49 -19.262 5.560 -5.281
420 2HD LYS 49 1HD LYS 49 -17.879 6.611 -5.597
421 1HE LYS 49 2HE LYS 49 -19.222 7.523 -7.556
422 2HE LYS 49 1HE LYS 49 -20.608 6.684 -6.859
423 1HZ LYS 49 1HZ LYS 49 -19.087 8.378 -5.050
424 2HZ LYS 49 2HZ LYS 49 -20.758 8.151 -5.172
425 3HZ LYS 49 3HZ LYS 49 -19.965 9.181 -6.253
426 H GLY 50 H GLY 50 -14.826 3.910 -6.415
427 1HA GLY 50 2HA GLY 50 -15.117 0.997 -6.672
428 2HA GLY 50 1HA GLY 50 -13.876 1.823 -5.742
429 H VAL 51 H VAL 51 -14.113 1.524 -3.639
430 HA VAL 51 HA VAL 51 -16.847 1.432 -2.536
431 HB VAL 51 HB VAL 51 -14.455 -0.000 -1.381
432 1HG1 VAL 51 1HG1 VAL 51 -16.485 -1.295 -0.337
433 2HG1 VAL 51 2HG1 VAL 51 -17.341 0.210 -0.675
434 3HG1 VAL 51 3HG1 VAL 51 -15.921 0.220 0.370
435 1HG2 VAL 51 1HG2 VAL 51 -14.704 -1.336 -3.189
436 2HG2 VAL 51 2HG2 VAL 51 -16.354 -0.798 -3.495
437 3HG2 VAL 51 3HG2 VAL 51 -16.037 -1.997 -2.241
438 H GLU 52 H GLU 52 -17.051 2.158 -0.302
439 HA GLU 52 HA GLU 52 -15.204 4.371 0.253
440 1HB GLU 52 2HB GLU 52 -18.035 3.871 1.187
441 2HB GLU 52 1HB GLU 52 -17.045 5.228 1.708
442 1HG GLU 52 2HG GLU 52 -16.917 5.342 -1.049
443 2HG GLU 52 1HG GLU 52 -18.584 4.869 -0.720
444 H LYS 53 H LYS 53 -15.217 4.903 2.744
445 HA LYS 53 HA LYS 53 -13.866 2.760 4.017
446 1HB LYS 53 2HB LYS 53 -13.935 4.303 6.028
447 2HB LYS 53 1HB LYS 53 -13.164 4.948 4.586
448 1HG LYS 53 2HG LYS 53 -16.031 5.526 4.805
449 2HG LYS 53 1HG LYS 53 -15.024 6.252 6.059
450 1HD LYS 53 2HD LYS 53 -14.047 6.457 3.271
451 2HD LYS 53 1HD LYS 53 -15.469 7.414 3.688
452 1HE LYS 53 2HE LYS 53 -13.914 8.922 4.327
453 2HE LYS 53 1HE LYS 53 -13.918 7.965 5.808
454 1HZ LYS 53 1HZ LYS 53 -11.884 7.139 5.385
455 2HZ LYS 53 2HZ LYS 53 -11.717 8.528 4.434
456 3HZ LYS 53 3HZ LYS 53 -12.125 7.054 3.712
457 H TYR 54 H TYR 54 -15.172 0.993 4.294
458 HA TYR 54 HA TYR 54 -17.761 1.247 5.550
459 1HB TYR 54 2HB TYR 54 -17.565 -1.352 5.501
460 2HB TYR 54 1HB TYR 54 -17.785 -0.474 3.993
461 HD1 TYR 54 1HD TYR 54 -14.994 -1.692 6.170
462 HD2 TYR 54 2HD TYR 54 -16.445 -1.070 2.219
463 HE1 TYR 54 1HE TYR 54 -12.968 -2.750 5.266
464 HE2 TYR 54 2HE TYR 54 -14.422 -2.128 1.304
465 HH TYR 54 HH TYR 54 -12.686 -3.733 2.046
466 H GLY 55 H GLY 55 -14.503 0.528 6.520
467 1HA GLY 55 2HA GLY 55 -14.608 1.057 9.127
468 2HA GLY 55 1HA GLY 55 -15.350 -0.535 9.098
469 HA PRO 56 HA PRO 56 -10.838 -1.267 9.583
470 1HB PRO 56 2HB PRO 56 -11.044 -3.262 11.379
471 2HB PRO 56 1HB PRO 56 -11.151 -1.562 11.849
472 1HG PRO 56 2HG PRO 56 -13.348 -3.546 11.405
473 2HG PRO 56 1HG PRO 56 -13.167 -2.347 12.699
474 1HD PRO 56 2HD PRO 56 -14.763 -1.973 10.517
475 2HD PRO 56 1HD PRO 56 -13.989 -0.641 11.401
476 H GLU 57 H GLU 57 -13.419 -2.970 8.273
477 HA GLU 57 HA GLU 57 -12.563 -5.559 7.921
478 1HB GLU 57 2HB GLU 57 -14.411 -3.761 6.599
479 2HB GLU 57 1HB GLU 57 -13.653 -4.848 5.444
480 1HG GLU 57 2HG GLU 57 -14.788 -6.618 6.185
481 2HG GLU 57 1HG GLU 57 -14.567 -6.175 7.877
482 H ALA 58 H ALA 58 -11.312 -2.660 6.469
483 HA ALA 58 HA ALA 58 -9.882 -3.954 4.358
484 1HB ALA 58 1HB ALA 58 -8.660 -1.481 4.937
485 2HB ALA 58 2HB ALA 58 -10.393 -1.271 5.200
486 3HB ALA 58 3HB ALA 58 -9.800 -1.854 3.644
487 H SER 59 H SER 59 -9.208 -3.099 7.678
488 HA SER 59 HA SER 59 -6.403 -3.343 7.619
489 1HB SER 59 2HB SER 59 -6.504 -3.411 10.008
490 2HB SER 59 1HB SER 59 -7.803 -2.341 9.479
491 HG SER 59 HG SER 59 -7.941 -4.689 10.841
492 H ALA 60 H ALA 60 -8.960 -5.699 7.756
493 HA ALA 60 HA ALA 60 -7.640 -7.907 8.797
494 1HB ALA 60 1HB ALA 60 -9.687 -7.905 6.581
495 2HB ALA 60 2HB ALA 60 -10.047 -7.835 8.307
496 3HB ALA 60 3HB ALA 60 -9.273 -9.266 7.626
497 H PHE 61 H PHE 61 -7.278 -6.367 5.706
498 HA PHE 61 HA PHE 61 -6.209 -8.440 4.186
499 1HB PHE 61 2HB PHE 61 -5.965 -5.466 4.140
500 2HB PHE 61 1HB PHE 61 -4.860 -6.409 3.144
501 HD1 PHE 61 1HD PHE 61 -8.398 -5.594 3.751
502 HD2 PHE 61 2HD PHE 61 -5.599 -7.491 1.167
503 HE1 PHE 61 1HE PHE 61 -10.136 -5.790 2.021
504 HE2 PHE 61 2HE PHE 61 -7.332 -7.691 -0.569
505 HZ PHE 61 HZ PHE 61 -9.602 -6.839 -0.143
506 H THR 62 H THR 62 -4.760 -6.476 6.686
507 HA THR 62 HA THR 62 -2.093 -7.468 6.129
508 HB THR 62 HB THR 62 -1.379 -6.052 7.969
509 HG1 THR 62 1HG THR 62 -4.118 -5.468 8.393
510 1HG2 THR 62 1HG2 THR 62 -2.179 -3.855 7.249
511 2HG2 THR 62 2HG2 THR 62 -3.425 -4.638 6.277
512 3HG2 THR 62 3HG2 THR 62 -1.723 -4.876 5.887
513 H LYS 63 H LYS 63 -4.783 -8.292 8.109
514 HA LYS 63 HA LYS 63 -3.194 -9.872 9.955
515 1HB LYS 63 2HB LYS 63 -6.022 -9.001 9.782
516 2HB LYS 63 1HB LYS 63 -5.718 -10.531 10.592
517 1HG LYS 63 2HG LYS 63 -4.298 -9.485 12.197
518 2HG LYS 63 1HG LYS 63 -4.330 -7.960 11.308
519 1HD LYS 63 2HD LYS 63 -6.973 -9.003 12.047
520 2HD LYS 63 1HD LYS 63 -5.947 -8.566 13.414
521 1HE LYS 63 2HE LYS 63 -5.676 -6.500 11.525
522 2HE LYS 63 1HE LYS 63 -7.398 -6.869 11.611
523 1HZ LYS 63 1HZ LYS 63 -6.309 -5.184 13.258
524 2HZ LYS 63 2HZ LYS 63 -5.895 -6.583 14.113
525 3HZ LYS 63 3HZ LYS 63 -7.519 -6.242 13.789
526 H LYS 64 H LYS 64 -4.874 -10.283 6.991
527 HA LYS 64 HA LYS 64 -5.228 -13.143 7.327
528 1HB LYS 64 2HB LYS 64 -6.848 -11.594 6.103
529 2HB LYS 64 1HB LYS 64 -5.670 -11.572 4.798
530 1HG LYS 64 2HG LYS 64 -6.181 -14.277 5.585
531 2HG LYS 64 1HG LYS 64 -7.704 -13.449 5.258
532 1HD LYS 64 2HD LYS 64 -7.238 -13.176 3.049
533 2HD LYS 64 1HD LYS 64 -5.502 -13.025 3.322
534 1HE LYS 64 2HE LYS 64 -6.747 -15.659 3.874
535 2HE LYS 64 1HE LYS 64 -6.601 -15.173 2.185
536 1HZ LYS 64 1HZ LYS 64 -4.687 -16.469 3.204
537 2HZ LYS 64 2HZ LYS 64 -4.297 -15.048 4.034
538 3HZ LYS 64 3HZ LYS 64 -4.291 -15.068 2.342
539 H MET 65 H MET 65 -3.669 -11.161 4.800
540 HA MET 65 HA MET 65 -1.958 -13.402 4.112
541 1HB MET 65 2HB MET 65 -2.518 -10.727 2.873
542 2HB MET 65 1HB MET 65 -1.134 -11.682 2.357
543 1HG MET 65 2HG MET 65 -3.701 -13.113 2.459
544 2HG MET 65 1HG MET 65 -3.575 -11.838 1.246
545 1HE MET 65 1HE MET 65 -2.286 -12.947 -1.477
546 2HE MET 65 2HE MET 65 -0.702 -12.551 -0.807
547 3HE MET 65 3HE MET 65 -2.109 -11.573 -0.385
548 H TRP 66 H TRP 66 -1.475 -9.980 5.026
549 HA TRP 66 HA TRP 66 1.315 -10.142 5.196
550 1HB TRP 66 2HB TRP 66 0.044 -8.017 5.069
551 2HB TRP 66 1HB TRP 66 -0.493 -8.270 6.725
552 HD1 TRP 66 HD TRP 66 2.660 -7.424 4.709
553 HE1 TRP 66 1HE TRP 66 4.381 -6.362 6.303
554 HE3 TRP 66 3HE TRP 66 0.209 -8.124 9.142
555 HZ2 TRP 66 2HZ TRP 66 4.663 -5.885 9.070
556 HZ3 TRP 66 3HZ TRP 66 1.273 -7.336 11.215
557 HH2 TRP 66 HH TRP 66 3.454 -6.240 11.179
558 H GLU 67 H GLU 67 -1.056 -11.434 7.269
559 HA GLU 67 HA GLU 67 0.667 -11.431 9.612
560 1HB GLU 67 2HB GLU 67 -1.919 -11.186 9.575
561 2HB GLU 67 1HB GLU 67 -1.920 -12.934 9.400
562 1HG GLU 67 2HG GLU 67 -0.671 -13.153 11.479
563 2HG GLU 67 1HG GLU 67 -0.647 -11.399 11.654
564 H ASN 68 H ASN 68 -0.892 -13.856 7.518
565 HA ASN 68 HA ASN 68 0.654 -15.998 8.667
566 1HB ASN 68 2HB ASN 68 -1.754 -15.963 7.483
567 2HB ASN 68 1HB ASN 68 -0.768 -16.396 6.089
568 1HD2 ASN 68 1HD2 ASN 68 -2.766 -17.933 7.603
569 2HD2 ASN 68 2HD2 ASN 68 -1.958 -19.373 8.109
570 H ALA 69 H ALA 69 0.900 -13.895 5.906
571 HA ALA 69 HA ALA 69 3.192 -15.449 4.911
572 1HB ALA 69 1HB ALA 69 1.037 -14.054 3.589
573 2HB ALA 69 2HB ALA 69 2.211 -15.194 2.932
574 3HB ALA 69 3HB ALA 69 2.609 -13.478 3.029
575 H LYS 70 H LYS 70 5.134 -14.377 4.370
576 HA LYS 70 HA LYS 70 5.594 -11.961 5.961
577 1HB LYS 70 2HB LYS 70 7.641 -13.757 4.652
578 2HB LYS 70 1HB LYS 70 7.940 -12.512 5.857
579 1HG LYS 70 2HG LYS 70 7.464 -13.884 7.550
580 2HG LYS 70 1HG LYS 70 6.026 -14.515 6.747
581 1HD LYS 70 2HD LYS 70 7.490 -16.352 6.985
582 2HD LYS 70 1HD LYS 70 7.600 -15.868 5.292
583 1HE LYS 70 2HE LYS 70 9.708 -14.930 5.567
584 2HE LYS 70 1HE LYS 70 9.516 -14.771 7.312
585 1HZ LYS 70 1HZ LYS 70 10.175 -16.881 7.665
586 2HZ LYS 70 2HZ LYS 70 10.937 -16.697 6.166
587 3HZ LYS 70 3HZ LYS 70 9.441 -17.479 6.264
588 H LYS 71 H LYS 71 4.933 -10.284 4.676
589 HA LYS 71 HA LYS 71 6.521 -9.833 2.253
590 1HB LYS 71 2HB LYS 71 4.552 -8.985 1.069
591 2HB LYS 71 1HB LYS 71 4.344 -10.672 1.517
592 1HG LYS 71 2HG LYS 71 3.284 -9.246 3.652
593 2HG LYS 71 1HG LYS 71 2.760 -8.363 2.217
594 1HD LYS 71 2HD LYS 71 2.520 -11.286 2.027
595 2HD LYS 71 1HD LYS 71 1.488 -10.535 3.245
596 1HE LYS 71 2HE LYS 71 0.173 -9.563 1.706
597 2HE LYS 71 1HE LYS 71 1.535 -9.137 0.670
598 1HZ LYS 71 1HZ LYS 71 1.594 -11.499 -0.035
599 2HZ LYS 71 2HZ LYS 71 0.178 -10.693 -0.481
600 3HZ LYS 71 3HZ LYS 71 0.163 -11.762 0.829
601 H ILE 72 H ILE 72 7.478 -7.915 2.280
602 HA ILE 72 HA ILE 72 6.693 -5.957 4.279
603 HB ILE 72 HB ILE 72 9.140 -6.735 3.467
604 1HG1 ILE 72 2HG1 ILE 72 9.711 -4.206 4.281
605 2HG1 ILE 72 1HG1 ILE 72 8.045 -4.358 4.826
606 1HG2 ILE 72 1HG2 ILE 72 8.883 -4.098 2.065
607 2HG2 ILE 72 2HG2 ILE 72 8.628 -5.620 1.211
608 3HG2 ILE 72 3HG2 ILE 72 10.184 -5.286 1.972
609 1HD1 ILE 72 1HD1 ILE 72 10.412 -5.374 6.015
610 2HD1 ILE 72 2HD1 ILE 72 9.389 -6.733 5.548
611 3HD1 ILE 72 3HD1 ILE 72 8.750 -5.468 6.599
612 H GLU 73 H GLU 73 6.298 -3.705 3.733
613 HA GLU 73 HA GLU 73 5.473 -3.293 0.946
614 1HB GLU 73 2HB GLU 73 3.421 -2.175 1.714
615 2HB GLU 73 1HB GLU 73 3.472 -3.871 2.176
616 1HG GLU 73 2HG GLU 73 4.575 -2.075 4.194
617 2HG GLU 73 1HG GLU 73 2.874 -1.783 3.831
618 H VAL 74 H VAL 74 5.401 -1.172 0.196
619 HA VAL 74 HA VAL 74 6.733 0.839 1.882
620 HB VAL 74 HB VAL 74 8.332 0.016 0.222
621 1HG1 VAL 74 1HG1 VAL 74 7.401 -0.768 -1.665
622 2HG1 VAL 74 2HG1 VAL 74 7.569 0.895 -2.227
623 3HG1 VAL 74 3HG1 VAL 74 6.030 0.337 -1.569
624 1HG2 VAL 74 1HG2 VAL 74 8.910 2.165 -0.817
625 2HG2 VAL 74 2HG2 VAL 74 8.450 2.361 0.873
626 3HG2 VAL 74 3HG2 VAL 74 7.312 2.787 -0.407
627 H GLU 75 H GLU 75 6.178 3.044 1.425
628 HA GLU 75 HA GLU 75 3.511 3.301 0.240
629 1HB GLU 75 2HB GLU 75 5.016 5.150 2.097
630 2HB GLU 75 1HB GLU 75 3.398 5.446 1.475
631 1HG GLU 75 2HG GLU 75 3.087 4.607 3.634
632 2HG GLU 75 1HG GLU 75 2.736 3.255 2.560
633 H PHE 76 H PHE 76 3.060 5.428 -0.841
634 HA PHE 76 HA PHE 76 5.146 5.913 -2.812
635 1HB PHE 76 2HB PHE 76 2.218 6.636 -2.697
636 2HB PHE 76 1HB PHE 76 3.290 7.221 -3.960
637 HD1 PHE 76 1HD PHE 76 4.134 3.924 -2.867
638 HD2 PHE 76 2HD PHE 76 1.521 6.113 -5.418
639 HE1 PHE 76 1HE PHE 76 3.702 1.884 -4.168
640 HE2 PHE 76 2HE PHE 76 1.087 4.075 -6.724
641 HZ PHE 76 HZ PHE 76 2.178 1.956 -6.099
642 H ASP 77 H ASP 77 5.351 8.223 -3.608
643 HA ASP 77 HA ASP 77 5.734 9.949 -1.278
644 1HB ASP 77 2HB ASP 77 6.890 9.926 -4.056
645 2HB ASP 77 1HB ASP 77 7.031 11.347 -3.025
646 H LYS 78 H LYS 78 3.674 10.752 -0.936
647 HA LYS 78 HA LYS 78 2.137 11.916 -3.063
648 1HB LYS 78 2HB LYS 78 1.614 11.016 -0.462
649 2HB LYS 78 1HB LYS 78 1.306 12.746 -0.417
650 1HG LYS 78 2HG LYS 78 0.151 11.031 -2.581
651 2HG LYS 78 1HG LYS 78 -0.627 11.164 -1.003
652 1HD LYS 78 2HD LYS 78 -0.457 13.704 -1.361
653 2HD LYS 78 1HD LYS 78 -0.149 13.304 -3.052
654 1HE LYS 78 2HE LYS 78 -2.409 13.474 -3.168
655 2HE LYS 78 1HE LYS 78 -2.311 11.790 -2.658
656 1HZ LYS 78 1HZ LYS 78 -3.902 12.901 -1.300
657 2HZ LYS 78 2HZ LYS 78 -2.822 14.151 -0.933
658 3HZ LYS 78 3HZ LYS 78 -2.544 12.593 -0.339
659 H GLY 79 H GLY 79 4.440 13.045 -0.710
660 1HA GLY 79 2HA GLY 79 5.495 15.078 -0.508
661 2HA GLY 79 1HA GLY 79 4.772 15.528 -2.044
662 H GLN 80 H GLN 80 2.751 14.512 0.587
663 HA GLN 80 HA GLN 80 2.038 17.313 1.131
664 1HB GLN 80 2HB GLN 80 0.423 15.384 -0.167
665 2HB GLN 80 1HB GLN 80 -0.251 15.603 1.441
666 1HG GLN 80 2HG GLN 80 0.430 17.978 -0.234
667 2HG GLN 80 1HG GLN 80 -1.067 17.090 -0.512
668 1HE2 GLN 80 1HE2 GLN 80 0.649 19.228 1.572
669 2HE2 GLN 80 2HE2 GLN 80 -0.651 19.560 2.660
670 H ARG 81 H ARG 81 3.332 17.168 3.018
671 HA ARG 81 HA ARG 81 3.253 15.244 4.986
672 1HB ARG 81 2HB ARG 81 4.710 17.363 4.792
673 2HB ARG 81 1HB ARG 81 3.414 18.168 5.665
674 1HG ARG 81 2HG ARG 81 3.692 16.665 7.537
675 2HG ARG 81 1HG ARG 81 4.919 15.755 6.655
676 1HD ARG 81 2HD ARG 81 6.322 17.780 6.569
677 2HD ARG 81 1HD ARG 81 5.105 18.641 7.512
678 HE ARG 81 HE ARG 81 5.806 16.365 8.946
679 1HH1 ARG 81 1HH1 ARG 81 7.321 19.305 7.835
680 2HH1 ARG 81 2HH1 ARG 81 8.451 19.366 9.145
681 1HH2 ARG 81 1HH2 ARG 81 7.290 16.444 10.670
682 2HH2 ARG 81 2HH2 ARG 81 8.435 17.742 10.755
683 H THR 82 H THR 82 1.341 14.383 5.607
684 HA THR 82 HA THR 82 -1.067 15.755 5.961
685 HB THR 82 HB THR 82 -1.612 13.748 7.496
686 HG1 THR 82 1HG THR 82 -0.110 12.022 7.214
687 1HG2 THR 82 1HG2 THR 82 -0.975 12.243 5.248
688 2HG2 THR 82 2HG2 THR 82 -1.278 13.872 4.645
689 3HG2 THR 82 3HG2 THR 82 -2.506 13.044 5.602
690 H ASP 83 H ASP 83 -1.648 17.212 7.411
691 HA ASP 83 HA ASP 83 -0.250 17.261 10.005
692 1HB ASP 83 2HB ASP 83 -0.189 19.238 8.180
693 2HB ASP 83 1HB ASP 83 -1.640 19.705 9.064
694 H LYS 84 H LYS 84 -3.359 17.896 8.415
695 HA LYS 84 HA LYS 84 -4.971 18.526 10.517
696 1HB LYS 84 2HB LYS 84 -5.634 18.287 8.095
697 2HB LYS 84 1HB LYS 84 -5.770 16.556 8.373
698 1HG LYS 84 2HG LYS 84 -7.896 16.958 8.886
699 2HG LYS 84 1HG LYS 84 -7.287 17.624 10.402
700 1HD LYS 84 2HD LYS 84 -7.234 19.479 8.121
701 2HD LYS 84 1HD LYS 84 -8.847 18.980 8.637
702 1HE LYS 84 2HE LYS 84 -8.431 20.875 9.921
703 2HE LYS 84 1HE LYS 84 -8.033 19.547 11.010
704 1HZ LYS 84 1HZ LYS 84 -5.914 20.181 11.107
705 2HZ LYS 84 2HZ LYS 84 -6.421 21.647 10.431
706 3HZ LYS 84 3HZ LYS 84 -5.797 20.429 9.437
707 H TYR 85 H TYR 85 -4.156 15.224 9.480
708 HA TYR 85 HA TYR 85 -4.747 14.315 12.211
709 1HB TYR 85 2HB TYR 85 -5.790 13.209 9.627
710 2HB TYR 85 1HB TYR 85 -5.541 12.135 11.000
711 HD1 TYR 85 1HD TYR 85 -7.850 14.228 9.393
712 HD2 TYR 85 2HD TYR 85 -6.601 12.997 13.270
713 HE1 TYR 85 1HE TYR 85 -10.035 14.894 10.302
714 HE2 TYR 85 2HE TYR 85 -8.783 13.659 14.190
715 HH TYR 85 HH TYR 85 -11.447 14.120 12.454
716 H GLY 86 H GLY 86 -2.997 13.814 9.197
717 1HA GLY 86 2HA GLY 86 -0.703 13.192 9.157
718 2HA GLY 86 1HA GLY 86 -0.914 12.425 10.725
719 H ARG 87 H ARG 87 -2.749 12.106 7.701
720 HA ARG 87 HA ARG 87 -1.943 9.279 7.591
721 1HB ARG 87 2HB ARG 87 -4.765 10.175 7.035
722 2HB ARG 87 1HB ARG 87 -4.167 8.534 7.231
723 1HG ARG 87 2HG ARG 87 -4.153 8.660 9.505
724 2HG ARG 87 1HG ARG 87 -3.871 10.402 9.520
725 1HD ARG 87 2HD ARG 87 -6.454 8.990 8.866
726 2HD ARG 87 1HD ARG 87 -6.103 9.940 10.310
727 HE ARG 87 HE ARG 87 -5.692 11.704 8.308
728 1HH1 ARG 87 1HH1 ARG 87 -8.348 9.579 9.087
729 2HH1 ARG 87 2HH1 ARG 87 -9.546 10.621 8.395
730 1HH2 ARG 87 1HH2 ARG 87 -7.266 13.075 7.398
731 2HH2 ARG 87 2HH2 ARG 87 -8.932 12.605 7.436
732 H GLY 88 H GLY 88 -0.661 9.415 5.817
733 1HA GLY 88 2HA GLY 88 -1.521 10.887 3.469
734 2HA GLY 88 1HA GLY 88 -0.009 10.010 3.657
735 H LEU 89 H LEU 89 0.169 8.369 2.293
736 HA LEU 89 HA LEU 89 -2.231 6.769 1.702
737 1HB LEU 89 2HB LEU 89 -0.239 7.972 -0.165
738 2HB LEU 89 1HB LEU 89 -0.950 6.425 -0.581
739 HG LEU 89 HG LEU 89 -2.756 8.685 0.159
740 1HD1 LEU 89 1HD1 LEU 89 -0.890 9.236 -1.659
741 2HD1 LEU 89 2HD1 LEU 89 -2.551 9.812 -1.798
742 3HD1 LEU 89 3HD1 LEU 89 -2.035 8.384 -2.696
743 1HD2 LEU 89 1HD2 LEU 89 -4.360 7.475 -0.915
744 2HD2 LEU 89 2HD2 LEU 89 -3.298 6.158 -0.418
745 3HD2 LEU 89 3HD2 LEU 89 -3.222 6.777 -2.067
746 H ALA 90 H ALA 90 -2.004 4.650 2.050
747 HA ALA 90 HA ALA 90 0.726 3.603 2.419
748 1HB ALA 90 1HB ALA 90 -1.203 1.841 3.542
749 2HB ALA 90 2HB ALA 90 -1.547 3.477 4.097
750 3HB ALA 90 3HB ALA 90 0.048 2.777 4.359
751 H TYR 91 H TYR 91 1.263 1.580 1.599
752 HA TYR 91 HA TYR 91 -0.635 0.331 -0.254
753 1HB TYR 91 2HB TYR 91 2.250 0.874 -0.976
754 2HB TYR 91 1HB TYR 91 1.002 0.195 -2.015
755 HD1 TYR 91 1HD TYR 91 0.087 1.604 -3.584
756 HD2 TYR 91 2HD TYR 91 1.551 3.281 0.045
757 HE1 TYR 91 1HE TYR 91 -0.458 3.855 -4.409
758 HE2 TYR 91 2HE TYR 91 1.015 5.532 -0.771
759 HH TYR 91 HH TYR 91 -0.990 6.131 -3.331
760 H ILE 92 H ILE 92 -0.046 -1.890 -0.825
761 HA ILE 92 HA ILE 92 1.729 -3.127 1.178
762 HB ILE 92 HB ILE 92 0.229 -5.076 1.230
763 1HG1 ILE 92 2HG1 ILE 92 -2.209 -4.133 0.325
764 2HG1 ILE 92 1HG1 ILE 92 -1.086 -3.576 -0.912
765 1HG2 ILE 92 1HG2 ILE 92 -0.340 -3.928 3.068
766 2HG2 ILE 92 2HG2 ILE 92 -1.810 -3.539 2.178
767 3HG2 ILE 92 3HG2 ILE 92 -0.463 -2.400 2.196
768 1HD1 ILE 92 1HD1 ILE 92 -0.536 -6.308 -0.223
769 2HD1 ILE 92 2HD1 ILE 92 -0.962 -5.604 -1.783
770 3HD1 ILE 92 3HD1 ILE 92 -2.231 -6.105 -0.666
771 H TYR 93 H TYR 93 3.452 -3.906 0.163
772 HA TYR 93 HA TYR 93 3.173 -4.980 -2.549
773 1HB TYR 93 2HB TYR 93 5.465 -3.918 -0.944
774 2HB TYR 93 1HB TYR 93 5.794 -5.059 -2.243
775 HD1 TYR 93 1HD TYR 93 6.047 -4.277 -4.418
776 HD2 TYR 93 2HD TYR 93 4.029 -1.845 -1.570
777 HE1 TYR 93 1HE TYR 93 5.964 -2.441 -6.053
778 HE2 TYR 93 2HE TYR 93 3.941 -0.003 -3.197
779 HH TYR 93 HH TYR 93 4.708 -0.433 -6.507
780 H ALA 94 H ALA 94 3.441 -7.097 -3.012
781 HA ALA 94 HA ALA 94 3.768 -8.921 -0.751
782 1HB ALA 94 1HB ALA 94 3.182 -10.569 -2.774
783 2HB ALA 94 2HB ALA 94 2.481 -9.079 -3.407
784 3HB ALA 94 3HB ALA 94 1.953 -9.711 -1.846
785 H ASP 95 H ASP 95 5.789 -9.525 -0.314
786 HA ASP 95 HA ASP 95 7.987 -10.089 -0.570
787 1HB ASP 95 2HB ASP 95 6.436 -11.997 -1.716
788 2HB ASP 95 1HB ASP 95 7.472 -11.571 -3.074
789 H GLY 96 H GLY 96 7.151 -7.630 -1.914
790 1HA GLY 96 2HA GLY 96 8.272 -6.030 -3.148
791 2HA GLY 96 1HA GLY 96 9.522 -7.220 -3.476
792 H LYS 97 H LYS 97 7.677 -5.233 -5.063
793 HA LYS 97 HA LYS 97 6.509 -7.044 -7.005
794 1HB LYS 97 2HB LYS 97 5.469 -4.839 -6.250
795 2HB LYS 97 1HB LYS 97 6.698 -4.045 -7.225
796 1HG LYS 97 2HG LYS 97 5.834 -5.490 -9.152
797 2HG LYS 97 1HG LYS 97 4.437 -5.793 -8.119
798 1HD LYS 97 2HD LYS 97 4.065 -3.364 -7.950
799 2HD LYS 97 1HD LYS 97 5.432 -3.094 -9.032
800 1HE LYS 97 2HE LYS 97 4.089 -4.743 -10.586
801 2HE LYS 97 1HE LYS 97 2.724 -4.185 -9.619
802 1HZ LYS 97 1HZ LYS 97 2.889 -2.076 -10.435
803 2HZ LYS 97 2HZ LYS 97 3.443 -2.936 -11.783
804 3HZ LYS 97 3HZ LYS 97 4.549 -2.186 -10.747
805 H MET 98 H MET 98 7.976 -8.042 -8.257
806 HA MET 98 HA MET 98 10.267 -6.560 -9.285
807 1HB MET 98 2HB MET 98 10.604 -8.832 -8.379
808 2HB MET 98 1HB MET 98 9.525 -9.474 -9.610
809 1HG MET 98 2HG MET 98 11.444 -7.997 -11.000
810 2HG MET 98 1HG MET 98 12.332 -8.880 -9.759
811 1HE MET 98 1HE MET 98 9.933 -11.814 -10.079
812 2HE MET 98 2HE MET 98 11.264 -11.184 -9.109
813 3HE MET 98 3HE MET 98 11.559 -12.469 -10.281
814 H VAL 99 H VAL 99 10.417 -5.799 -11.300
815 HA VAL 99 HA VAL 99 8.137 -6.119 -13.073
816 HB VAL 99 HB VAL 99 10.607 -4.447 -13.530
817 1HG1 VAL 99 1HG1 VAL 99 8.636 -3.158 -14.796
818 2HG1 VAL 99 2HG1 VAL 99 8.021 -4.807 -14.917
819 3HG1 VAL 99 3HG1 VAL 99 9.612 -4.410 -15.566
820 1HG2 VAL 99 1HG2 VAL 99 8.835 -2.613 -12.814
821 2HG2 VAL 99 2HG2 VAL 99 9.857 -3.431 -11.631
822 3HG2 VAL 99 3HG2 VAL 99 8.192 -3.959 -11.872
823 H ASN 100 H ASN 100 8.282 -6.826 -15.229
824 HA ASN 100 HA ASN 100 10.676 -8.434 -15.838
825 1HB ASN 100 2HB ASN 100 9.069 -9.918 -17.137
826 2HB ASN 100 1HB ASN 100 8.946 -9.994 -15.381
827 1HD2 ASN 100 1HD2 ASN 100 6.824 -10.866 -15.800
828 2HD2 ASN 100 2HD2 ASN 100 5.506 -9.792 -16.100
829 H GLU 101 H GLU 101 10.656 -9.017 -18.299
830 HA GLU 101 HA GLU 101 9.870 -6.652 -19.859
831 1HB GLU 101 2HB GLU 101 12.549 -8.044 -19.880
832 2HB GLU 101 1HB GLU 101 12.035 -6.911 -21.122
833 1HG GLU 101 2HG GLU 101 12.348 -5.112 -19.808
834 2HG GLU 101 1HG GLU 101 11.823 -5.951 -18.349
835 H ALA 102 H ALA 102 11.164 -9.961 -20.142
836 HA ALA 102 HA ALA 102 9.083 -10.600 -22.069
837 1HB ALA 102 1HB ALA 102 11.780 -11.399 -22.969
838 2HB ALA 102 2HB ALA 102 11.374 -9.691 -23.125
839 3HB ALA 102 3HB ALA 102 10.368 -10.912 -23.905
840 H LEU 103 H LEU 103 8.228 -12.375 -21.217
841 HA LEU 103 HA LEU 103 10.018 -14.365 -19.996
842 1HB LEU 103 2HB LEU 103 7.206 -13.534 -19.474
843 2HB LEU 103 1HB LEU 103 7.639 -15.207 -19.169
844 HG LEU 103 HG LEU 103 7.788 -13.867 -17.133
845 1HD1 LEU 103 1HD1 LEU 103 9.331 -15.784 -17.540
846 2HD1 LEU 103 2HD1 LEU 103 9.953 -14.576 -16.416
847 3HD1 LEU 103 3HD1 LEU 103 10.546 -14.624 -18.075
848 1HD2 LEU 103 1HD2 LEU 103 10.146 -12.377 -18.145
849 2HD2 LEU 103 2HD2 LEU 103 8.961 -11.930 -16.916
850 3HD2 LEU 103 3HD2 LEU 103 8.547 -11.809 -18.626
851 H VAL 104 H VAL 104 7.539 -13.865 -22.408
852 HA VAL 104 HA VAL 104 7.958 -16.631 -23.338
853 HB VAL 104 HB VAL 104 5.639 -16.377 -24.390
854 1HG1 VAL 104 1HG1 VAL 104 6.240 -17.784 -22.399
855 2HG1 VAL 104 2HG1 VAL 104 4.559 -17.253 -22.459
856 3HG1 VAL 104 3HG1 VAL 104 5.700 -16.450 -21.380
857 1HG2 VAL 104 1HG2 VAL 104 4.123 -14.848 -23.127
858 2HG2 VAL 104 2HG2 VAL 104 5.305 -14.019 -24.140
859 3HG2 VAL 104 3HG2 VAL 104 5.552 -14.118 -22.397
860 H ARG 105 H ARG 105 9.367 -16.395 -24.979
861 HA ARG 105 HA ARG 105 8.482 -14.976 -27.333
862 1HB ARG 105 2HB ARG 105 10.149 -13.619 -25.571
863 2HB ARG 105 1HB ARG 105 11.247 -14.226 -26.801
864 1HG ARG 105 2HG ARG 105 10.638 -12.606 -28.176
865 2HG ARG 105 1HG ARG 105 8.959 -13.144 -28.098
866 1HD ARG 105 2HD ARG 105 10.311 -11.261 -26.168
867 2HD ARG 105 1HD ARG 105 9.176 -10.802 -27.436
868 HE ARG 105 HE ARG 105 8.049 -12.732 -25.678
869 1HH1 ARG 105 1HH1 ARG 105 8.808 -9.338 -25.958
870 2HH1 ARG 105 2HH1 ARG 105 7.566 -8.841 -24.858
871 1HH2 ARG 105 1HH2 ARG 105 6.414 -12.081 -24.232
872 2HH2 ARG 105 2HH2 ARG 105 6.208 -10.398 -23.877
873 H GLN 106 H GLN 106 8.523 -17.517 -27.418
874 HA GLN 106 HA GLN 106 9.310 -19.313 -28.575
875 1HB GLN 106 2HB GLN 106 10.010 -17.518 -30.222
876 2HB GLN 106 1HB GLN 106 11.607 -17.580 -29.485
877 1HG GLN 106 2HG GLN 106 11.656 -18.924 -31.439
878 2HG GLN 106 1HG GLN 106 11.693 -20.005 -30.045
879 1HE2 GLN 106 1HE2 GLN 106 9.718 -18.737 -32.637
880 2HE2 GLN 106 2HE2 GLN 106 8.534 -19.994 -32.612
881 H GLY 107 H GLY 107 12.299 -17.611 -27.614
882 1HA GLY 107 2HA GLY 107 13.709 -19.908 -26.873
883 2HA GLY 107 1HA GLY 107 14.061 -18.283 -26.305
884 H LEU 108 H LEU 108 11.499 -17.905 -25.012
885 HA LEU 108 HA LEU 108 11.817 -19.776 -22.758
886 1HB LEU 108 2HB LEU 108 11.318 -16.818 -22.808
887 2HB LEU 108 1HB LEU 108 10.839 -17.781 -21.423
888 HG LEU 108 HG LEU 108 13.153 -18.471 -21.068
889 1HD1 LEU 108 1HD1 LEU 108 14.866 -17.058 -22.445
890 2HD1 LEU 108 2HD1 LEU 108 13.566 -17.016 -23.636
891 3HD1 LEU 108 3HD1 LEU 108 14.219 -18.563 -23.099
892 1HD2 LEU 108 1HD2 LEU 108 14.093 -16.235 -20.493
893 2HD2 LEU 108 2HD2 LEU 108 12.447 -16.496 -19.912
894 3HD2 LEU 108 3HD2 LEU 108 12.732 -15.500 -21.340
895 H ALA 109 H ALA 109 10.181 -20.817 -24.413
896 HA ALA 109 HA ALA 109 8.075 -21.615 -24.725
897 1HB ALA 109 1HB ALA 109 6.894 -20.177 -22.439
898 2HB ALA 109 2HB ALA 109 8.253 -21.237 -22.065
899 3HB ALA 109 3HB ALA 109 6.823 -21.885 -22.867
900 H LYS 110 H LYS 110 6.198 -21.040 -25.786
901 HA LYS 110 HA LYS 110 5.769 -18.146 -26.156
902 1HB LYS 110 2HB LYS 110 6.734 -19.545 -28.114
903 2HB LYS 110 1HB LYS 110 5.106 -20.191 -28.256
904 1HG LYS 110 2HG LYS 110 5.023 -17.325 -28.091
905 2HG LYS 110 1HG LYS 110 6.118 -17.838 -29.377
906 1HD LYS 110 2HD LYS 110 4.445 -18.672 -30.642
907 2HD LYS 110 1HD LYS 110 3.560 -19.291 -29.246
908 1HE LYS 110 2HE LYS 110 2.880 -16.951 -28.726
909 2HE LYS 110 1HE LYS 110 3.635 -16.445 -30.237
910 1HZ LYS 110 1HZ LYS 110 2.010 -17.406 -31.481
911 2HZ LYS 110 2HZ LYS 110 1.096 -17.031 -30.109
912 3HZ LYS 110 3HZ LYS 110 1.662 -18.607 -30.340
Start of MODEL 3
1 1H ALA 1 1HT ALA 1 19.657 9.274 -18.402
2 2H ALA 1 2HT ALA 1 19.117 10.575 -19.383
3 3H ALA 1 3HT ALA 1 19.982 9.268 -20.085
4 HA ALA 1 HA ALA 1 17.873 8.785 -20.654
5 1HB ALA 1 1HB ALA 1 17.145 6.943 -19.143
6 2HB ALA 1 2HB ALA 1 18.401 7.443 -18.009
7 3HB ALA 1 3HB ALA 1 18.843 6.860 -19.614
8 H THR 2 H THR 2 15.670 9.068 -20.471
9 HA THR 2 HA THR 2 14.827 10.904 -18.342
10 HB THR 2 HB THR 2 14.461 11.869 -20.481
11 HG1 THR 2 1HG THR 2 12.443 12.374 -20.153
12 1HG2 THR 2 1HG2 THR 2 13.644 9.156 -21.270
13 2HG2 THR 2 2HG2 THR 2 14.468 10.413 -22.191
14 3HG2 THR 2 3HG2 THR 2 12.720 10.483 -21.971
15 H SER 3 H SER 3 14.286 9.509 -16.699
16 HA SER 3 HA SER 3 12.298 7.429 -17.278
17 1HB SER 3 2HB SER 3 13.695 7.783 -14.636
18 2HB SER 3 1HB SER 3 12.982 6.322 -15.320
19 HG SER 3 HG SER 3 14.669 6.427 -16.930
20 H THR 4 H THR 4 10.356 7.301 -16.149
21 HA THR 4 HA THR 4 9.230 9.811 -15.374
22 HB THR 4 HB THR 4 7.879 7.200 -14.800
23 HG1 THR 4 1HG THR 4 7.398 6.935 -16.944
24 1HG2 THR 4 1HG2 THR 4 5.910 8.289 -15.215
25 2HG2 THR 4 2HG2 THR 4 6.665 9.493 -16.259
26 3HG2 THR 4 3HG2 THR 4 6.877 9.585 -14.511
27 H LYS 5 H LYS 5 8.316 10.351 -13.335
28 HA LYS 5 HA LYS 5 9.975 9.869 -11.137
29 1HB LYS 5 2HB LYS 5 7.904 11.601 -11.721
30 2HB LYS 5 1HB LYS 5 7.244 10.623 -10.419
31 1HG LYS 5 2HG LYS 5 8.726 11.418 -8.881
32 2HG LYS 5 1HG LYS 5 9.979 11.725 -10.085
33 1HD LYS 5 2HD LYS 5 8.784 13.667 -10.890
34 2HD LYS 5 1HD LYS 5 7.438 13.327 -9.800
35 1HE LYS 5 2HE LYS 5 8.847 13.722 -7.876
36 2HE LYS 5 1HE LYS 5 10.256 13.937 -8.915
37 1HZ LYS 5 1HZ LYS 5 8.077 15.773 -8.338
38 2HZ LYS 5 2HZ LYS 5 8.626 15.761 -9.937
39 3HZ LYS 5 3HZ LYS 5 9.703 16.093 -8.677
40 H LYS 6 H LYS 6 10.168 8.136 -9.889
41 HA LYS 6 HA LYS 6 7.853 6.332 -9.627
42 1HB LYS 6 2HB LYS 6 10.417 5.762 -10.577
43 2HB LYS 6 1HB LYS 6 10.392 5.107 -8.945
44 1HG LYS 6 2HG LYS 6 9.728 3.461 -10.640
45 2HG LYS 6 1HG LYS 6 8.448 3.775 -9.465
46 1HD LYS 6 2HD LYS 6 7.080 4.695 -11.009
47 2HD LYS 6 1HD LYS 6 8.408 5.473 -11.872
48 1HE LYS 6 2HE LYS 6 8.256 2.518 -12.004
49 2HE LYS 6 1HE LYS 6 7.025 3.423 -12.883
50 1HZ LYS 6 1HZ LYS 6 8.854 3.020 -14.334
51 2HZ LYS 6 2HZ LYS 6 9.967 3.629 -13.216
52 3HZ LYS 6 3HZ LYS 6 8.857 4.669 -13.956
53 H LEU 7 H LEU 7 7.475 5.347 -7.604
54 HA LEU 7 HA LEU 7 8.017 7.043 -5.373
55 1HB LEU 7 2HB LEU 7 6.753 5.363 -4.082
56 2HB LEU 7 1HB LEU 7 5.901 5.909 -5.514
57 HG LEU 7 HG LEU 7 7.147 3.701 -6.489
58 1HD1 LEU 7 1HD1 LEU 7 6.404 2.041 -4.527
59 2HD1 LEU 7 2HD1 LEU 7 6.945 3.409 -3.556
60 3HD1 LEU 7 3HD1 LEU 7 8.049 2.649 -4.703
61 1HD2 LEU 7 1HD2 LEU 7 4.463 3.993 -5.164
62 2HD2 LEU 7 2HD2 LEU 7 4.939 2.557 -6.069
63 3HD2 LEU 7 3HD2 LEU 7 4.850 4.120 -6.879
64 H HIS 8 H HIS 8 9.014 6.372 -3.368
65 HA HIS 8 HA HIS 8 11.505 5.002 -3.829
66 1HB HIS 8 2HB HIS 8 10.311 6.589 -1.606
67 2HB HIS 8 1HB HIS 8 11.611 5.471 -1.208
68 HD1 HIS 8 1HD HIS 8 11.341 8.837 -1.644
69 HD2 HIS 8 2HD HIS 8 13.714 6.012 -3.555
70 HE1 HIS 8 1HE HIS 8 13.275 10.124 -2.606
71 HE2 HIS 8 2HE HIS 8 14.746 8.380 -3.674
72 H LYS 9 H LYS 9 11.893 2.914 -3.490
73 HA LYS 9 HA LYS 9 9.891 1.344 -2.032
74 1HB LYS 9 2HB LYS 9 11.152 -0.610 -3.109
75 2HB LYS 9 1HB LYS 9 10.198 0.419 -4.167
76 1HG LYS 9 2HG LYS 9 12.032 1.299 -5.200
77 2HG LYS 9 1HG LYS 9 13.068 1.079 -3.789
78 1HD LYS 9 2HD LYS 9 13.843 -0.503 -5.332
79 2HD LYS 9 1HD LYS 9 12.823 -1.430 -4.231
80 1HE LYS 9 2HE LYS 9 11.294 -1.883 -5.821
81 2HE LYS 9 1HE LYS 9 11.429 -0.283 -6.550
82 1HZ LYS 9 1HZ LYS 9 12.962 -2.716 -7.108
83 2HZ LYS 9 2HZ LYS 9 13.742 -1.227 -7.289
84 3HZ LYS 9 3HZ LYS 9 12.344 -1.561 -8.178
85 H GLU 10 H GLU 10 10.357 1.168 0.060
86 HA GLU 10 HA GLU 10 12.859 -0.044 0.845
87 1HB GLU 10 2HB GLU 10 13.088 2.557 0.809
88 2HB GLU 10 1HB GLU 10 12.134 2.484 2.284
89 1HG GLU 10 2HG GLU 10 14.091 2.284 3.321
90 2HG GLU 10 1HG GLU 10 14.055 0.611 2.764
91 HA PRO 11 HA PRO 11 9.705 -1.706 3.572
92 1HB PRO 11 2HB PRO 11 11.120 -3.769 4.540
93 2HB PRO 11 1HB PRO 11 10.505 -3.766 2.884
94 1HG PRO 11 2HG PRO 11 13.261 -3.164 3.881
95 2HG PRO 11 1HG PRO 11 12.764 -4.109 2.465
96 1HD PRO 11 2HD PRO 11 13.601 -1.498 2.349
97 2HD PRO 11 1HD PRO 11 12.520 -2.246 1.159
98 H ALA 12 H ALA 12 9.245 -1.570 5.745
99 HA ALA 12 HA ALA 12 11.421 -0.666 7.507
100 1HB ALA 12 1HB ALA 12 9.115 0.542 8.486
101 2HB ALA 12 2HB ALA 12 9.031 0.757 6.739
102 3HB ALA 12 3HB ALA 12 10.442 1.325 7.631
103 H THR 13 H THR 13 8.012 -1.043 8.333
104 HA THR 13 HA THR 13 7.862 -3.608 9.251
105 HB THR 13 HB THR 13 8.252 -2.804 11.843
106 HG1 THR 13 1HG THR 13 10.330 -1.830 11.841
107 1HG2 THR 13 1HG2 THR 13 9.558 -4.579 10.007
108 2HG2 THR 13 2HG2 THR 13 9.342 -4.720 11.752
109 3HG2 THR 13 3HG2 THR 13 10.727 -3.841 11.102
110 H LEU 14 H LEU 14 5.736 -3.823 9.482
111 HA LEU 14 HA LEU 14 4.106 -1.537 10.219
112 1HB LEU 14 2HB LEU 14 3.585 -3.265 8.376
113 2HB LEU 14 1HB LEU 14 3.101 -4.317 9.692
114 HG LEU 14 HG LEU 14 1.524 -2.404 10.390
115 1HD1 LEU 14 1HD1 LEU 14 0.787 -1.198 8.194
116 2HD1 LEU 14 2HD1 LEU 14 2.455 -1.500 7.706
117 3HD1 LEU 14 3HD1 LEU 14 2.117 -0.559 9.159
118 1HD2 LEU 14 1HD2 LEU 14 -0.057 -3.116 8.419
119 2HD2 LEU 14 2HD2 LEU 14 0.425 -4.277 9.656
120 3HD2 LEU 14 3HD2 LEU 14 1.233 -4.272 8.089
121 H ILE 15 H ILE 15 2.502 -1.646 11.929
122 HA ILE 15 HA ILE 15 3.254 -3.519 14.076
123 HB ILE 15 HB ILE 15 2.387 -0.664 14.519
124 1HG1 ILE 15 2HG1 ILE 15 5.180 -1.662 14.960
125 2HG1 ILE 15 1HG1 ILE 15 4.685 -1.142 13.352
126 1HG2 ILE 15 1HG2 ILE 15 3.328 -1.118 16.798
127 2HG2 ILE 15 2HG2 ILE 15 3.447 -2.816 16.337
128 3HG2 ILE 15 3HG2 ILE 15 1.870 -2.027 16.400
129 1HD1 ILE 15 1HD1 ILE 15 3.865 0.850 15.183
130 2HD1 ILE 15 2HD1 ILE 15 5.095 0.950 13.923
131 3HD1 ILE 15 3HD1 ILE 15 5.537 0.433 15.551
132 H LYS 16 H LYS 16 0.692 -1.060 13.693
133 HA LYS 16 HA LYS 16 -1.268 -3.195 14.222
134 1HB LYS 16 2HB LYS 16 -0.740 -0.900 15.748
135 2HB LYS 16 1HB LYS 16 -2.248 -0.565 14.910
136 1HG LYS 16 2HG LYS 16 -2.759 -1.543 17.023
137 2HG LYS 16 1HG LYS 16 -3.136 -2.722 15.765
138 1HD LYS 16 2HD LYS 16 -1.962 -4.125 17.082
139 2HD LYS 16 1HD LYS 16 -0.567 -3.374 16.307
140 1HE LYS 16 2HE LYS 16 -0.111 -2.032 18.144
141 2HE LYS 16 1HE LYS 16 -1.752 -2.169 18.775
142 1HZ LYS 16 1HZ LYS 16 0.088 -4.485 18.645
143 2HZ LYS 16 2HZ LYS 16 -1.339 -4.332 19.542
144 3HZ LYS 16 3HZ LYS 16 0.035 -3.450 19.984
145 H ALA 17 H ALA 17 -3.218 -3.154 13.119
146 HA ALA 17 HA ALA 17 -3.420 -1.209 10.919
147 1HB ALA 17 1HB ALA 17 -4.500 -3.913 10.433
148 2HB ALA 17 2HB ALA 17 -2.744 -3.769 10.477
149 3HB ALA 17 3HB ALA 17 -3.678 -2.803 9.336
150 H ILE 18 H ILE 18 -5.001 0.059 11.772
151 HA ILE 18 HA ILE 18 -7.227 -0.879 13.226
152 HB ILE 18 HB ILE 18 -8.166 1.351 12.939
153 1HG1 ILE 18 2HG1 ILE 18 -5.857 2.257 11.288
154 2HG1 ILE 18 1HG1 ILE 18 -7.147 1.386 10.464
155 1HG2 ILE 18 1HG2 ILE 18 -6.682 2.337 14.324
156 2HG2 ILE 18 2HG2 ILE 18 -5.309 2.010 13.266
157 3HG2 ILE 18 3HG2 ILE 18 -5.945 0.735 14.305
158 1HD1 ILE 18 1HD1 ILE 18 -7.670 3.765 12.214
159 2HD1 ILE 18 2HD1 ILE 18 -8.741 3.018 11.029
160 3HD1 ILE 18 3HD1 ILE 18 -7.312 3.900 10.492
161 H ASP 19 H ASP 19 -9.438 0.374 12.042
162 HA ASP 19 HA ASP 19 -10.313 -1.665 10.276
163 1HB ASP 19 2HB ASP 19 -11.562 0.988 11.016
164 2HB ASP 19 1HB ASP 19 -12.374 -0.267 10.084
165 H GLY 20 H GLY 20 -8.318 -1.137 8.826
166 1HA GLY 20 2HA GLY 20 -7.447 -0.256 6.877
167 2HA GLY 20 1HA GLY 20 -9.090 -0.499 6.310
168 H ASP 21 H ASP 21 -7.112 1.852 8.110
169 HA ASP 21 HA ASP 21 -8.248 3.978 6.481
170 1HB ASP 21 2HB ASP 21 -9.124 3.491 9.154
171 2HB ASP 21 1HB ASP 21 -8.217 5.000 9.138
172 H THR 22 H THR 22 -5.947 3.027 8.995
173 HA THR 22 HA THR 22 -3.805 4.354 7.697
174 HB THR 22 HB THR 22 -4.783 6.363 8.611
175 HG1 THR 22 1HG THR 22 -2.610 5.612 10.265
176 1HG2 THR 22 1HG2 THR 22 -6.117 5.461 10.417
177 2HG2 THR 22 2HG2 THR 22 -5.036 6.721 11.012
178 3HG2 THR 22 3HG2 THR 22 -4.655 5.023 11.303
179 H VAL 23 H VAL 23 -2.123 3.093 8.077
180 HA VAL 23 HA VAL 23 -1.933 1.732 10.688
181 HB VAL 23 HB VAL 23 -0.724 -0.081 9.572
182 1HG1 VAL 23 1HG1 VAL 23 -3.122 0.108 7.864
183 2HG1 VAL 23 2HG1 VAL 23 -3.386 0.281 9.599
184 3HG1 VAL 23 3HG1 VAL 23 -2.608 -1.170 8.966
185 1HG2 VAL 23 1HG2 VAL 23 -1.139 1.620 7.135
186 2HG2 VAL 23 2HG2 VAL 23 -0.884 -0.121 7.013
187 3HG2 VAL 23 3HG2 VAL 23 0.353 0.902 7.745
188 H LYS 24 H LYS 24 -0.121 2.043 11.852
189 HA LYS 24 HA LYS 24 1.824 3.940 10.919
190 1HB LYS 24 2HB LYS 24 2.847 3.590 13.174
191 2HB LYS 24 1HB LYS 24 1.158 4.077 13.218
192 1HG LYS 24 2HG LYS 24 1.548 1.182 13.207
193 2HG LYS 24 1HG LYS 24 2.244 1.999 14.608
194 1HD LYS 24 2HD LYS 24 -0.233 3.194 14.318
195 2HD LYS 24 1HD LYS 24 -0.541 1.500 13.933
196 1HE LYS 24 2HE LYS 24 -0.805 2.110 16.353
197 2HE LYS 24 1HE LYS 24 0.310 0.782 16.032
198 1HZ LYS 24 1HZ LYS 24 1.479 3.441 16.123
199 2HZ LYS 24 2HZ LYS 24 2.070 1.978 16.728
200 3HZ LYS 24 3HZ LYS 24 0.903 2.840 17.596
201 H LEU 25 H LEU 25 4.022 3.617 10.618
202 HA LEU 25 HA LEU 25 5.012 0.864 10.564
203 1HB LEU 25 2HB LEU 25 4.089 1.725 8.289
204 2HB LEU 25 1HB LEU 25 5.556 2.683 8.245
205 HG LEU 25 HG LEU 25 6.643 0.284 8.743
206 1HD1 LEU 25 1HD1 LEU 25 5.472 -1.512 8.026
207 2HD1 LEU 25 2HD1 LEU 25 4.575 -0.587 6.822
208 3HD1 LEU 25 3HD1 LEU 25 4.105 -0.513 8.520
209 1HD2 LEU 25 1HD2 LEU 25 5.792 1.207 6.000
210 2HD2 LEU 25 2HD2 LEU 25 7.154 0.151 6.389
211 3HD2 LEU 25 3HD2 LEU 25 7.173 1.839 6.898
212 H MET 26 H MET 26 6.958 0.743 11.488
213 HA MET 26 HA MET 26 8.332 3.103 12.329
214 1HB MET 26 2HB MET 26 9.157 0.195 12.424
215 2HB MET 26 1HB MET 26 10.024 1.508 13.210
216 1HG MET 26 2HG MET 26 8.335 1.857 14.769
217 2HG MET 26 1HG MET 26 7.136 1.004 13.799
218 1HE MET 26 1HE MET 26 7.975 -0.735 17.339
219 2HE MET 26 2HE MET 26 7.621 0.888 16.748
220 3HE MET 26 3HE MET 26 9.286 0.418 17.085
221 H TYR 27 H TYR 27 9.166 4.303 10.694
222 HA TYR 27 HA TYR 27 11.159 2.983 8.974
223 1HB TYR 27 2HB TYR 27 9.207 3.541 7.630
224 2HB TYR 27 1HB TYR 27 9.247 5.201 8.214
225 HD1 TYR 27 1HD TYR 27 10.879 6.780 7.366
226 HD2 TYR 27 2HD TYR 27 10.818 2.758 5.981
227 HE1 TYR 27 1HE TYR 27 12.335 7.412 5.488
228 HE2 TYR 27 2HE TYR 27 12.277 3.378 4.101
229 HH TYR 27 HH TYR 27 13.851 5.085 3.475
230 H LYS 28 H LYS 28 13.143 3.798 9.106
231 HA LYS 28 HA LYS 28 14.896 5.117 9.716
232 1HB LYS 28 2HB LYS 28 13.459 6.557 7.992
233 2HB LYS 28 1HB LYS 28 13.271 7.592 9.402
234 1HG LYS 28 2HG LYS 28 15.149 8.527 8.579
235 2HG LYS 28 1HG LYS 28 15.915 7.227 9.496
236 1HD LYS 28 2HD LYS 28 16.938 7.077 7.414
237 2HD LYS 28 1HD LYS 28 15.668 5.856 7.323
238 1HE LYS 28 2HE LYS 28 15.022 6.853 5.435
239 2HE LYS 28 1HE LYS 28 14.421 8.163 6.450
240 1HZ LYS 28 1HZ LYS 28 15.793 9.378 5.173
241 2HZ LYS 28 2HZ LYS 28 16.769 8.065 4.748
242 3HZ LYS 28 3HZ LYS 28 16.988 8.832 6.239
243 H GLY 29 H GLY 29 13.099 4.236 11.805
244 1HA GLY 29 2HA GLY 29 12.928 4.516 14.081
245 2HA GLY 29 1HA GLY 29 14.096 5.818 13.941
246 H GLN 30 H GLN 30 11.242 6.040 12.023
247 HA GLN 30 HA GLN 30 9.985 7.816 13.991
248 1HB GLN 30 2HB GLN 30 10.970 8.494 11.281
249 2HB GLN 30 1HB GLN 30 9.394 9.140 11.720
250 1HG GLN 30 2HG GLN 30 10.287 10.328 13.557
251 2HG GLN 30 1HG GLN 30 11.830 9.482 13.442
252 1HE2 GLN 30 1HE2 GLN 30 12.993 9.789 11.338
253 2HE2 GLN 30 2HE2 GLN 30 12.972 11.374 10.651
254 HA PRO 31 HA PRO 31 6.550 5.146 12.888
255 1HB PRO 31 2HB PRO 31 4.996 7.206 14.345
256 2HB PRO 31 1HB PRO 31 5.077 5.461 14.610
257 1HG PRO 31 2HG PRO 31 6.272 7.164 16.283
258 2HG PRO 31 1HG PRO 31 7.017 5.609 15.866
259 1HD PRO 31 2HD PRO 31 7.666 8.353 14.865
260 2HD PRO 31 1HD PRO 31 8.759 7.015 15.279
261 H MET 32 H MET 32 5.307 5.145 11.129
262 HA MET 32 HA MET 32 4.296 7.701 10.083
263 1HB MET 32 2HB MET 32 5.615 5.484 8.502
264 2HB MET 32 1HB MET 32 4.808 6.871 7.792
265 1HG MET 32 2HG MET 32 7.212 7.003 9.595
266 2HG MET 32 1HG MET 32 7.253 7.096 7.836
267 1HE MET 32 1HE MET 32 7.996 9.946 7.262
268 2HE MET 32 2HE MET 32 8.754 8.944 8.501
269 3HE MET 32 3HE MET 32 8.248 10.590 8.884
270 H THR 33 H THR 33 2.122 7.520 10.266
271 HA THR 33 HA THR 33 0.913 4.959 9.477
272 HB THR 33 HB THR 33 0.683 5.343 11.867
273 HG1 THR 33 1HG THR 33 -1.580 5.160 11.956
274 1HG2 THR 33 1HG2 THR 33 -0.184 7.184 12.873
275 2HG2 THR 33 2HG2 THR 33 -1.143 7.641 11.465
276 3HG2 THR 33 3HG2 THR 33 0.594 7.945 11.484
277 H PHE 34 H PHE 34 0.631 5.636 7.305
278 HA PHE 34 HA PHE 34 -1.760 7.277 6.973
279 1HB PHE 34 2HB PHE 34 -0.531 8.197 4.822
280 2HB PHE 34 1HB PHE 34 -0.358 8.992 6.381
281 HD1 PHE 34 1HD PHE 34 1.285 6.795 3.933
282 HD2 PHE 34 2HD PHE 34 1.730 9.058 7.510
283 HE1 PHE 34 1HE PHE 34 3.729 6.568 3.769
284 HE2 PHE 34 2HE PHE 34 4.172 8.838 7.350
285 HZ PHE 34 HZ PHE 34 5.177 7.592 5.478
286 H ARG 35 H ARG 35 -3.107 5.776 6.170
287 HA ARG 35 HA ARG 35 -2.297 4.440 3.698
288 1HB ARG 35 2HB ARG 35 -1.933 2.890 5.640
289 2HB ARG 35 1HB ARG 35 -3.663 2.955 5.942
290 1HG ARG 35 2HG ARG 35 -4.177 1.745 4.050
291 2HG ARG 35 1HG ARG 35 -2.667 2.170 3.242
292 1HD ARG 35 2HD ARG 35 -2.119 0.051 3.819
293 2HD ARG 35 1HD ARG 35 -1.672 0.834 5.333
294 HE ARG 35 HE ARG 35 -4.361 0.111 5.500
295 1HH1 ARG 35 1HH1 ARG 35 -1.235 -1.424 5.276
296 2HH1 ARG 35 2HH1 ARG 35 -1.732 -2.844 6.133
297 1HH2 ARG 35 1HH2 ARG 35 -5.018 -1.756 6.627
298 2HH2 ARG 35 2HH2 ARG 35 -3.881 -3.033 6.899
299 H LEU 36 H LEU 36 -3.694 5.601 2.421
300 HA LEU 36 HA LEU 36 -6.518 4.962 2.776
301 1HB LEU 36 2HB LEU 36 -7.171 7.301 2.249
302 2HB LEU 36 1HB LEU 36 -6.409 7.104 3.815
303 HG LEU 36 HG LEU 36 -4.618 7.856 1.582
304 1HD1 LEU 36 1HD1 LEU 36 -5.615 10.289 2.539
305 2HD1 LEU 36 2HD1 LEU 36 -7.030 9.324 2.119
306 3HD1 LEU 36 3HD1 LEU 36 -5.779 9.624 0.914
307 1HD2 LEU 36 1HD2 LEU 36 -4.210 9.539 3.704
308 2HD2 LEU 36 2HD2 LEU 36 -3.370 8.014 3.432
309 3HD2 LEU 36 3HD2 LEU 36 -4.778 8.066 4.491
310 H LEU 37 H LEU 37 -6.304 3.583 1.013
311 HA LEU 37 HA LEU 37 -6.131 4.964 -1.573
312 1HB LEU 37 2HB LEU 37 -4.026 3.882 -1.376
313 2HB LEU 37 1HB LEU 37 -4.756 2.411 -0.763
314 HG LEU 37 HG LEU 37 -5.740 3.086 -3.418
315 1HD1 LEU 37 1HD1 LEU 37 -2.778 2.699 -3.037
316 2HD1 LEU 37 2HD1 LEU 37 -3.594 4.063 -3.799
317 3HD1 LEU 37 3HD1 LEU 37 -3.617 2.478 -4.573
318 1HD2 LEU 37 1HD2 LEU 37 -5.768 0.846 -3.648
319 2HD2 LEU 37 2HD2 LEU 37 -5.562 0.865 -1.897
320 3HD2 LEU 37 3HD2 LEU 37 -4.161 0.647 -2.947
321 H LEU 38 H LEU 38 -8.327 4.958 -1.876
322 HA LEU 38 HA LEU 38 -9.476 2.396 -2.622
323 1HB LEU 38 2HB LEU 38 -11.644 3.280 -1.368
324 2HB LEU 38 1HB LEU 38 -10.464 2.250 -0.586
325 HG LEU 38 HG LEU 38 -11.266 4.162 0.804
326 1HD1 LEU 38 1HD1 LEU 38 -8.408 4.743 0.516
327 2HD1 LEU 38 2HD1 LEU 38 -8.805 3.032 0.679
328 3HD1 LEU 38 3HD1 LEU 38 -9.323 4.181 1.914
329 1HD2 LEU 38 1HD2 LEU 38 -10.009 6.358 0.217
330 2HD2 LEU 38 2HD2 LEU 38 -11.534 5.983 -0.584
331 3HD2 LEU 38 3HD2 LEU 38 -10.009 5.709 -1.421
332 H VAL 39 H VAL 39 -11.857 2.863 -3.438
333 HA VAL 39 HA VAL 39 -11.569 5.010 -5.396
334 HB VAL 39 HB VAL 39 -13.580 3.959 -6.463
335 1HG1 VAL 39 1HG1 VAL 39 -11.581 3.349 -7.463
336 2HG1 VAL 39 2HG1 VAL 39 -12.293 1.790 -7.048
337 3HG1 VAL 39 3HG1 VAL 39 -11.018 2.473 -6.038
338 1HG2 VAL 39 1HG2 VAL 39 -14.426 1.883 -5.720
339 2HG2 VAL 39 2HG2 VAL 39 -14.358 2.914 -4.292
340 3HG2 VAL 39 3HG2 VAL 39 -13.121 1.685 -4.549
341 H ASP 40 H ASP 40 -13.049 6.657 -5.678
342 HA ASP 40 HA ASP 40 -14.850 7.113 -3.401
343 1HB ASP 40 2HB ASP 40 -13.145 8.863 -5.052
344 2HB ASP 40 1HB ASP 40 -14.741 9.514 -4.694
345 H THR 41 H THR 41 -16.983 7.133 -3.690
346 HA THR 41 HA THR 41 -18.000 7.020 -6.444
347 HB THR 41 HB THR 41 -20.126 6.257 -4.993
348 HG1 THR 41 1HG THR 41 -18.782 6.516 -3.049
349 1HG2 THR 41 1HG2 THR 41 -18.008 4.843 -6.354
350 2HG2 THR 41 2HG2 THR 41 -19.740 4.515 -6.304
351 3HG2 THR 41 3HG2 THR 41 -18.689 3.897 -5.030
352 HA PRO 42 HA PRO 42 -19.954 10.950 -5.942
353 1HB PRO 42 2HB PRO 42 -21.984 10.731 -7.717
354 2HB PRO 42 1HB PRO 42 -20.297 10.900 -8.217
355 1HG PRO 42 2HG PRO 42 -21.979 8.430 -8.031
356 2HG PRO 42 1HG PRO 42 -20.852 8.922 -9.309
357 1HD PRO 42 2HD PRO 42 -20.201 7.122 -7.384
358 2HD PRO 42 1HD PRO 42 -19.008 8.204 -8.132
359 H GLU 43 H GLU 43 -21.634 11.936 -4.861
360 HA GLU 43 HA GLU 43 -23.518 10.122 -3.531
361 1HB GLU 43 2HB GLU 43 -21.874 11.793 -2.322
362 2HB GLU 43 1HB GLU 43 -23.135 12.962 -2.685
363 1HG GLU 43 2HG GLU 43 -24.370 10.658 -1.588
364 2HG GLU 43 1HG GLU 43 -23.005 11.092 -0.561
365 H THR 44 H THR 44 -23.934 11.030 -6.240
366 HA THR 44 HA THR 44 -26.235 12.830 -5.913
367 HB THR 44 HB THR 44 -25.854 12.559 -8.630
368 HG1 THR 44 1HG THR 44 -23.295 12.737 -7.427
369 1HG2 THR 44 1HG2 THR 44 -24.872 14.609 -6.688
370 2HG2 THR 44 2HG2 THR 44 -26.216 14.704 -7.827
371 3HG2 THR 44 3HG2 THR 44 -24.552 14.750 -8.416
372 H LYS 45 H LYS 45 -28.109 11.812 -5.737
373 HA LYS 45 HA LYS 45 -29.870 10.439 -6.177
374 1HB LYS 45 2HB LYS 45 -29.036 10.933 -8.603
375 2HB LYS 45 1HB LYS 45 -28.454 9.274 -8.549
376 1HG LYS 45 2HG LYS 45 -30.496 8.440 -8.845
377 2HG LYS 45 1HG LYS 45 -31.201 9.516 -7.638
378 1HD LYS 45 2HD LYS 45 -30.406 10.828 -10.142
379 2HD LYS 45 1HD LYS 45 -31.701 9.641 -10.310
380 1HE LYS 45 2HE LYS 45 -33.136 11.162 -9.565
381 2HE LYS 45 1HE LYS 45 -32.301 11.144 -8.011
382 1HZ LYS 45 1HZ LYS 45 -31.998 13.306 -8.487
383 2HZ LYS 45 2HZ LYS 45 -32.182 13.096 -10.155
384 3HZ LYS 45 3HZ LYS 45 -30.702 12.741 -9.418
385 H HIS 46 H HIS 46 -27.073 8.542 -7.328
386 HA HIS 46 HA HIS 46 -27.985 6.249 -5.820
387 1HB HIS 46 2HB HIS 46 -25.557 6.648 -7.578
388 2HB HIS 46 1HB HIS 46 -26.016 5.117 -6.841
389 HD1 HIS 46 1HD HIS 46 -29.030 5.130 -7.444
390 HD2 HIS 46 2HD HIS 46 -26.095 6.159 -10.201
391 HE1 HIS 46 1HE HIS 46 -30.073 4.766 -9.703
392 HE2 HIS 46 2HE HIS 46 -28.250 5.311 -11.355
393 HA PRO 47 HA PRO 47 -25.450 7.040 -2.273
394 1HB PRO 47 2HB PRO 47 -25.434 4.588 -1.160
395 2HB PRO 47 1HB PRO 47 -26.887 5.595 -1.187
396 1HG PRO 47 2HG PRO 47 -26.126 3.317 -2.974
397 2HG PRO 47 1HG PRO 47 -27.696 3.681 -2.232
398 1HD PRO 47 2HD PRO 47 -27.089 4.281 -4.822
399 2HD PRO 47 1HD PRO 47 -28.243 5.216 -3.850
400 H LYS 48 H LYS 48 -23.373 6.630 -1.403
401 HA LYS 48 HA LYS 48 -21.396 5.935 -3.301
402 1HB LYS 48 2HB LYS 48 -21.243 6.369 -0.315
403 2HB LYS 48 1HB LYS 48 -19.832 6.103 -1.331
404 1HG LYS 48 2HG LYS 48 -19.759 8.255 -1.823
405 2HG LYS 48 1HG LYS 48 -21.386 8.175 -2.498
406 1HD LYS 48 2HD LYS 48 -22.316 9.125 -0.685
407 2HD LYS 48 1HD LYS 48 -21.295 8.217 0.431
408 1HE LYS 48 2HE LYS 48 -19.420 9.806 -0.454
409 2HE LYS 48 1HE LYS 48 -20.778 10.829 -0.922
410 1HZ LYS 48 1HZ LYS 48 -21.245 11.328 1.207
411 2HZ LYS 48 2HZ LYS 48 -19.628 10.909 1.475
412 3HZ LYS 48 3HZ LYS 48 -20.853 9.786 1.789
413 H LYS 49 H LYS 49 -19.891 4.201 -3.266
414 HA LYS 49 HA LYS 49 -20.378 1.933 -1.545
415 1HB LYS 49 2HB LYS 49 -20.648 0.394 -3.557
416 2HB LYS 49 1HB LYS 49 -22.041 1.372 -3.120
417 1HG LYS 49 2HG LYS 49 -22.083 1.810 -5.321
418 2HG LYS 49 1HG LYS 49 -20.860 3.010 -4.898
419 1HD LYS 49 2HD LYS 49 -20.024 1.803 -6.765
420 2HD LYS 49 1HD LYS 49 -19.126 1.243 -5.355
421 1HE LYS 49 2HE LYS 49 -20.963 -0.597 -5.252
422 2HE LYS 49 1HE LYS 49 -21.243 -0.158 -6.936
423 1HZ LYS 49 1HZ LYS 49 -19.701 -1.869 -7.047
424 2HZ LYS 49 2HZ LYS 49 -18.818 -1.314 -5.715
425 3HZ LYS 49 3HZ LYS 49 -18.736 -0.485 -7.187
426 H GLY 50 H GLY 50 -18.186 3.772 -2.196
427 1HA GLY 50 2HA GLY 50 -16.262 1.920 -3.438
428 2HA GLY 50 1HA GLY 50 -16.044 3.657 -3.290
429 H VAL 51 H VAL 51 -16.443 4.219 -0.718
430 HA VAL 51 HA VAL 51 -14.298 2.719 0.610
431 HB VAL 51 HB VAL 51 -15.444 5.375 1.463
432 1HG1 VAL 51 1HG1 VAL 51 -13.197 3.651 2.342
433 2HG1 VAL 51 2HG1 VAL 51 -14.270 4.686 3.285
434 3HG1 VAL 51 3HG1 VAL 51 -12.944 5.396 2.364
435 1HG2 VAL 51 1HG2 VAL 51 -13.428 6.364 0.385
436 2HG2 VAL 51 2HG2 VAL 51 -14.589 5.686 -0.756
437 3HG2 VAL 51 3HG2 VAL 51 -13.117 4.797 -0.363
438 H GLU 52 H GLU 52 -15.600 0.964 1.295
439 HA GLU 52 HA GLU 52 -17.612 1.621 3.339
440 1HB GLU 52 2HB GLU 52 -17.554 -0.296 1.204
441 2HB GLU 52 1HB GLU 52 -17.685 -1.146 2.738
442 1HG GLU 52 2HG GLU 52 -19.474 1.047 2.809
443 2HG GLU 52 1HG GLU 52 -19.699 0.207 1.274
444 H LYS 53 H LYS 53 -17.607 0.495 5.326
445 HA LYS 53 HA LYS 53 -15.029 0.061 6.419
446 1HB LYS 53 2HB LYS 53 -17.754 0.215 7.378
447 2HB LYS 53 1HB LYS 53 -16.893 -1.102 8.163
448 1HG LYS 53 2HG LYS 53 -16.587 0.780 9.533
449 2HG LYS 53 1HG LYS 53 -15.064 0.563 8.669
450 1HD LYS 53 2HD LYS 53 -15.291 2.495 7.520
451 2HD LYS 53 1HD LYS 53 -17.038 2.304 7.346
452 1HE LYS 53 2HE LYS 53 -15.636 3.135 9.885
453 2HE LYS 53 1HE LYS 53 -16.393 4.246 8.746
454 1HZ LYS 53 1HZ LYS 53 -18.401 2.567 9.193
455 2HZ LYS 53 2HZ LYS 53 -18.143 3.966 10.108
456 3HZ LYS 53 3HZ LYS 53 -17.615 2.467 10.688
457 H TYR 54 H TYR 54 -13.954 -1.590 5.394
458 HA TYR 54 HA TYR 54 -14.982 -4.066 4.655
459 1HB TYR 54 2HB TYR 54 -12.271 -2.977 5.175
460 2HB TYR 54 1HB TYR 54 -12.427 -4.730 5.166
461 HD1 TYR 54 1HD TYR 54 -14.059 -2.085 3.094
462 HD2 TYR 54 2HD TYR 54 -11.544 -5.514 3.177
463 HE1 TYR 54 1HE TYR 54 -13.971 -2.072 0.637
464 HE2 TYR 54 2HE TYR 54 -11.447 -5.510 0.719
465 HH TYR 54 HH TYR 54 -12.746 -4.683 -1.172
466 H GLY 55 H GLY 55 -13.783 -2.944 7.757
467 1HA GLY 55 2HA GLY 55 -14.037 -3.838 9.861
468 2HA GLY 55 1HA GLY 55 -15.143 -5.010 9.159
469 HA PRO 56 HA PRO 56 -11.668 -7.543 10.800
470 1HB PRO 56 2HB PRO 56 -13.725 -9.599 10.161
471 2HB PRO 56 1HB PRO 56 -12.731 -9.412 11.610
472 1HG PRO 56 2HG PRO 56 -15.306 -8.745 11.642
473 2HG PRO 56 1HG PRO 56 -14.102 -7.761 12.496
474 1HD PRO 56 2HD PRO 56 -15.481 -7.238 9.898
475 2HD PRO 56 1HD PRO 56 -15.024 -6.100 11.182
476 H GLU 57 H GLU 57 -13.494 -7.674 7.838
477 HA GLU 57 HA GLU 57 -12.258 -9.749 6.483
478 1HB GLU 57 2HB GLU 57 -13.502 -7.171 5.599
479 2HB GLU 57 1HB GLU 57 -12.700 -8.201 4.419
480 1HG GLU 57 2HG GLU 57 -14.177 -10.049 5.036
481 2HG GLU 57 1HG GLU 57 -14.987 -9.006 6.204
482 H ALA 58 H ALA 58 -11.326 -6.305 6.438
483 HA ALA 58 HA ALA 58 -9.030 -6.604 4.873
484 1HB ALA 58 1HB ALA 58 -8.435 -4.408 5.544
485 2HB ALA 58 2HB ALA 58 -9.376 -4.534 7.030
486 3HB ALA 58 3HB ALA 58 -10.197 -4.454 5.470
487 H SER 59 H SER 59 -9.315 -6.426 8.421
488 HA SER 59 HA SER 59 -6.589 -6.831 8.966
489 1HB SER 59 2HB SER 59 -9.114 -7.069 10.549
490 2HB SER 59 1HB SER 59 -7.625 -7.727 11.228
491 HG SER 59 HG SER 59 -6.685 -5.647 10.921
492 H ALA 60 H ALA 60 -9.192 -9.057 8.289
493 HA ALA 60 HA ALA 60 -7.988 -11.414 9.261
494 1HB ALA 60 1HB ALA 60 -10.176 -10.818 7.326
495 2HB ALA 60 2HB ALA 60 -10.233 -11.685 8.860
496 3HB ALA 60 3HB ALA 60 -9.544 -12.461 7.435
497 H PHE 61 H PHE 61 -7.612 -9.624 6.286
498 HA PHE 61 HA PHE 61 -6.298 -11.692 4.831
499 1HB PHE 61 2HB PHE 61 -7.449 -9.646 3.855
500 2HB PHE 61 1HB PHE 61 -6.032 -8.724 4.348
501 HD1 PHE 61 1HD PHE 61 -3.922 -8.981 3.212
502 HD2 PHE 61 2HD PHE 61 -7.323 -11.260 2.052
503 HE1 PHE 61 1HE PHE 61 -2.789 -9.599 1.116
504 HE2 PHE 61 2HE PHE 61 -6.198 -11.883 -0.045
505 HZ PHE 61 HZ PHE 61 -3.926 -11.051 -0.516
506 H THR 62 H THR 62 -5.190 -8.951 6.771
507 HA THR 62 HA THR 62 -2.414 -9.451 6.269
508 HB THR 62 HB THR 62 -2.024 -7.744 8.003
509 HG1 THR 62 1HG THR 62 -4.840 -7.686 8.294
510 1HG2 THR 62 1HG2 THR 62 -2.355 -6.269 6.395
511 2HG2 THR 62 2HG2 THR 62 -4.048 -6.173 6.882
512 3HG2 THR 62 3HG2 THR 62 -3.552 -7.309 5.627
513 H LYS 63 H LYS 63 -4.568 -9.947 9.049
514 HA LYS 63 HA LYS 63 -2.757 -11.022 10.837
515 1HB LYS 63 2HB LYS 63 -5.346 -10.473 10.998
516 2HB LYS 63 1HB LYS 63 -5.490 -12.202 10.712
517 1HG LYS 63 2HG LYS 63 -3.516 -11.590 12.748
518 2HG LYS 63 1HG LYS 63 -5.115 -10.960 13.148
519 1HD LYS 63 2HD LYS 63 -5.415 -13.046 13.972
520 2HD LYS 63 1HD LYS 63 -5.793 -13.417 12.289
521 1HE LYS 63 2HE LYS 63 -3.983 -14.711 12.067
522 2HE LYS 63 1HE LYS 63 -2.940 -13.524 12.848
523 1HZ LYS 63 1HZ LYS 63 -4.758 -15.334 14.337
524 2HZ LYS 63 2HZ LYS 63 -3.540 -14.349 14.976
525 3HZ LYS 63 3HZ LYS 63 -3.132 -15.690 14.029
526 H LYS 64 H LYS 64 -4.005 -12.414 7.944
527 HA LYS 64 HA LYS 64 -3.346 -15.129 8.726
528 1HB LYS 64 2HB LYS 64 -5.196 -14.078 6.992
529 2HB LYS 64 1HB LYS 64 -3.939 -14.634 5.896
530 1HG LYS 64 2HG LYS 64 -5.214 -16.346 8.017
531 2HG LYS 64 1HG LYS 64 -5.722 -16.303 6.327
532 1HD LYS 64 2HD LYS 64 -2.865 -16.850 7.029
533 2HD LYS 64 1HD LYS 64 -4.064 -18.141 7.121
534 1HE LYS 64 2HE LYS 64 -4.646 -17.127 4.695
535 2HE LYS 64 1HE LYS 64 -2.922 -16.766 4.771
536 1HZ LYS 64 1HZ LYS 64 -2.551 -19.136 5.323
537 2HZ LYS 64 2HZ LYS 64 -3.216 -18.904 3.785
538 3HZ LYS 64 3HZ LYS 64 -4.196 -19.432 5.058
539 H MET 65 H MET 65 -2.400 -13.013 6.009
540 HA MET 65 HA MET 65 0.019 -14.578 5.642
541 1HB MET 65 2HB MET 65 -1.302 -12.384 4.071
542 2HB MET 65 1HB MET 65 0.333 -12.917 3.703
543 1HG MET 65 2HG MET 65 -0.932 -15.288 3.761
544 2HG MET 65 1HG MET 65 -2.250 -14.245 3.230
545 1HE MET 65 1HE MET 65 -0.397 -12.074 0.978
546 2HE MET 65 2HE MET 65 -1.996 -12.506 1.585
547 3HE MET 65 3HE MET 65 -1.514 -12.978 -0.044
548 H TRP 66 H TRP 66 -0.781 -11.137 6.175
549 HA TRP 66 HA TRP 66 1.853 -10.244 6.394
550 1HB TRP 66 2HB TRP 66 0.152 -8.620 6.075
551 2HB TRP 66 1HB TRP 66 -0.721 -9.149 7.507
552 HD1 TRP 66 HD TRP 66 2.326 -7.074 6.460
553 HE1 TRP 66 1HE TRP 66 3.034 -5.600 8.450
554 HE3 TRP 66 3HE TRP 66 -0.785 -8.994 10.032
555 HZ2 TRP 66 2HZ TRP 66 2.356 -5.296 11.180
556 HZ3 TRP 66 3HZ TRP 66 -0.695 -8.057 12.305
557 HH2 TRP 66 HH TRP 66 0.845 -6.247 12.866
558 H GLU 67 H GLU 67 -0.245 -11.710 8.791
559 HA GLU 67 HA GLU 67 1.403 -11.032 11.025
560 1HB GLU 67 2HB GLU 67 -1.150 -11.996 10.715
561 2HB GLU 67 1HB GLU 67 -0.294 -13.395 11.346
562 1HG GLU 67 2HG GLU 67 0.460 -11.088 12.842
563 2HG GLU 67 1HG GLU 67 -1.299 -11.172 12.754
564 H ASN 68 H ASN 68 0.891 -14.054 9.204
565 HA ASN 68 HA ASN 68 2.984 -15.401 10.653
566 1HB ASN 68 2HB ASN 68 0.791 -16.234 9.203
567 2HB ASN 68 1HB ASN 68 2.135 -16.646 8.144
568 1HD2 ASN 68 1HD2 ASN 68 2.475 -18.737 8.363
569 2HD2 ASN 68 2HD2 ASN 68 2.630 -19.588 9.858
570 H ALA 69 H ALA 69 2.714 -13.649 7.658
571 HA ALA 69 HA ALA 69 5.473 -14.396 6.959
572 1HB ALA 69 1HB ALA 69 3.670 -14.825 5.272
573 2HB ALA 69 2HB ALA 69 4.993 -13.809 4.701
574 3HB ALA 69 3HB ALA 69 3.455 -13.079 5.155
575 H LYS 70 H LYS 70 6.987 -12.791 6.435
576 HA LYS 70 HA LYS 70 6.349 -10.148 7.550
577 1HB LYS 70 2HB LYS 70 9.082 -11.318 7.005
578 2HB LYS 70 1HB LYS 70 8.715 -9.860 7.919
579 1HG LYS 70 2HG LYS 70 7.679 -12.536 8.778
580 2HG LYS 70 1HG LYS 70 9.300 -11.990 9.211
581 1HD LYS 70 2HD LYS 70 7.262 -9.968 9.705
582 2HD LYS 70 1HD LYS 70 6.974 -11.460 10.602
583 1HE LYS 70 2HE LYS 70 9.714 -10.278 10.569
584 2HE LYS 70 1HE LYS 70 8.479 -9.567 11.608
585 1HZ LYS 70 1HZ LYS 70 8.189 -12.138 12.199
586 2HZ LYS 70 2HZ LYS 70 9.237 -11.110 13.038
587 3HZ LYS 70 3HZ LYS 70 9.839 -12.124 11.825
588 H LYS 71 H LYS 71 5.432 -9.150 5.770
589 HA LYS 71 HA LYS 71 7.313 -8.465 3.630
590 1HB LYS 71 2HB LYS 71 5.465 -8.707 1.969
591 2HB LYS 71 1HB LYS 71 6.000 -10.230 2.668
592 1HG LYS 71 2HG LYS 71 3.778 -8.922 4.075
593 2HG LYS 71 1HG LYS 71 3.414 -9.482 2.444
594 1HD LYS 71 2HD LYS 71 4.920 -11.433 3.990
595 2HD LYS 71 1HD LYS 71 3.379 -11.013 4.741
596 1HE LYS 71 2HE LYS 71 3.754 -11.920 1.889
597 2HE LYS 71 1HE LYS 71 3.172 -12.926 3.214
598 1HZ LYS 71 1HZ LYS 71 1.270 -12.196 2.086
599 2HZ LYS 71 2HZ LYS 71 1.831 -10.604 1.963
600 3HZ LYS 71 3HZ LYS 71 1.350 -11.217 3.464
601 H ILE 72 H ILE 72 7.541 -6.344 4.253
602 HA ILE 72 HA ILE 72 5.141 -4.695 3.972
603 HB ILE 72 HB ILE 72 6.105 -3.254 5.894
604 1HG1 ILE 72 2HG1 ILE 72 8.174 -4.759 6.036
605 2HG1 ILE 72 1HG1 ILE 72 7.387 -4.343 7.555
606 1HG2 ILE 72 1HG2 ILE 72 4.303 -5.530 5.830
607 2HG2 ILE 72 2HG2 ILE 72 4.104 -3.946 6.582
608 3HG2 ILE 72 3HG2 ILE 72 4.957 -5.230 7.443
609 1HD1 ILE 72 1HD1 ILE 72 7.088 -6.479 8.040
610 2HD1 ILE 72 2HD1 ILE 72 8.046 -6.883 6.615
611 3HD1 ILE 72 3HD1 ILE 72 6.290 -6.774 6.496
612 H GLU 73 H GLU 73 5.429 -2.932 2.806
613 HA GLU 73 HA GLU 73 7.888 -1.488 2.679
614 1HB GLU 73 2HB GLU 73 7.637 -3.675 0.912
615 2HB GLU 73 1HB GLU 73 7.401 -2.228 -0.059
616 1HG GLU 73 2HG GLU 73 9.577 -1.623 1.538
617 2HG GLU 73 1HG GLU 73 9.817 -3.312 1.099
618 H VAL 74 H VAL 74 7.723 0.102 0.652
619 HA VAL 74 HA VAL 74 5.045 1.290 0.836
620 HB VAL 74 HB VAL 74 7.557 2.599 -0.205
621 1HG1 VAL 74 1HG1 VAL 74 6.185 4.660 0.513
622 2HG1 VAL 74 2HG1 VAL 74 4.806 3.563 0.483
623 3HG1 VAL 74 3HG1 VAL 74 5.748 3.836 -0.983
624 1HG2 VAL 74 1HG2 VAL 74 7.765 1.849 2.170
625 2HG2 VAL 74 2HG2 VAL 74 6.386 2.877 2.557
626 3HG2 VAL 74 3HG2 VAL 74 7.876 3.594 1.945
627 H GLU 75 H GLU 75 3.777 1.607 -0.934
628 HA GLU 75 HA GLU 75 4.924 0.941 -3.558
629 1HB GLU 75 2HB GLU 75 3.172 -0.684 -2.174
630 2HB GLU 75 1HB GLU 75 2.119 0.187 -3.280
631 1HG GLU 75 2HG GLU 75 4.592 -1.301 -4.122
632 2HG GLU 75 1HG GLU 75 2.964 -1.977 -4.152
633 H PHE 76 H PHE 76 3.281 3.248 -1.754
634 HA PHE 76 HA PHE 76 1.719 4.233 -4.001
635 1HB PHE 76 2HB PHE 76 0.675 5.704 -2.485
636 2HB PHE 76 1HB PHE 76 0.892 4.208 -1.601
637 HD1 PHE 76 1HD PHE 76 1.788 4.267 0.515
638 HD2 PHE 76 2HD PHE 76 2.581 7.489 -2.149
639 HE1 PHE 76 1HE PHE 76 2.929 5.481 2.326
640 HE2 PHE 76 2HE PHE 76 3.722 8.707 -0.343
641 HZ PHE 76 HZ PHE 76 3.897 7.704 1.898
642 H ASP 77 H ASP 77 2.138 6.015 -5.176
643 HA ASP 77 HA ASP 77 4.741 7.311 -4.740
644 1HB ASP 77 2HB ASP 77 4.572 7.997 -7.118
645 2HB ASP 77 1HB ASP 77 4.525 6.248 -6.920
646 H LYS 78 H LYS 78 4.138 8.867 -3.237
647 HA LYS 78 HA LYS 78 1.862 10.563 -3.674
648 1HB LYS 78 2HB LYS 78 2.637 9.972 -1.408
649 2HB LYS 78 1HB LYS 78 4.133 10.847 -1.699
650 1HG LYS 78 2HG LYS 78 3.128 12.606 -0.792
651 2HG LYS 78 1HG LYS 78 2.180 12.708 -2.278
652 1HD LYS 78 2HD LYS 78 0.420 11.388 -1.306
653 2HD LYS 78 1HD LYS 78 1.390 11.078 0.135
654 1HE LYS 78 2HE LYS 78 0.206 12.804 0.974
655 2HE LYS 78 1HE LYS 78 1.411 13.770 0.123
656 1HZ LYS 78 1HZ LYS 78 -1.246 12.995 -0.958
657 2HZ LYS 78 2HZ LYS 78 -0.094 13.948 -1.750
658 3HZ LYS 78 3HZ LYS 78 -0.843 14.520 -0.344
659 H GLY 79 H GLY 79 5.258 11.522 -3.161
660 1HA GLY 79 2HA GLY 79 6.558 12.835 -4.644
661 2HA GLY 79 1HA GLY 79 5.090 13.255 -5.517
662 H GLN 80 H GLN 80 3.685 13.864 -2.965
663 HA GLN 80 HA GLN 80 4.475 16.624 -2.796
664 1HB GLN 80 2HB GLN 80 2.123 15.125 -2.298
665 2HB GLN 80 1HB GLN 80 2.562 15.901 -0.782
666 1HG GLN 80 2HG GLN 80 1.545 17.716 -1.531
667 2HG GLN 80 1HG GLN 80 2.874 17.897 -2.674
668 1HE2 GLN 80 1HE2 GLN 80 2.620 16.991 -4.790
669 2HE2 GLN 80 2HE2 GLN 80 1.043 16.809 -5.473
670 H ARG 81 H ARG 81 3.912 17.189 -0.101
671 HA ARG 81 HA ARG 81 6.180 15.876 1.246
672 1HB ARG 81 2HB ARG 81 5.550 18.703 0.833
673 2HB ARG 81 1HB ARG 81 5.894 18.310 2.512
674 1HG ARG 81 2HG ARG 81 8.041 17.404 1.913
675 2HG ARG 81 1HG ARG 81 7.692 17.625 0.197
676 1HD ARG 81 2HD ARG 81 8.275 19.782 0.253
677 2HD ARG 81 1HD ARG 81 7.363 20.073 1.733
678 HE ARG 81 HE ARG 81 9.786 18.639 2.214
679 1HH1 ARG 81 1HH1 ARG 81 8.462 21.823 1.680
680 2HH1 ARG 81 2HH1 ARG 81 9.742 22.632 2.520
681 1HH2 ARG 81 1HH2 ARG 81 11.470 19.701 3.319
682 2HH2 ARG 81 2HH2 ARG 81 11.449 21.428 3.449
683 H THR 82 H THR 82 3.126 15.452 1.278
684 HA THR 82 HA THR 82 2.742 15.792 4.178
685 HB THR 82 HB THR 82 0.292 15.336 3.579
686 HG1 THR 82 1HG THR 82 1.227 16.011 0.991
687 1HG2 THR 82 1HG2 THR 82 0.251 17.711 2.292
688 2HG2 THR 82 2HG2 THR 82 1.822 17.784 3.093
689 3HG2 THR 82 3HG2 THR 82 0.359 17.520 4.043
690 H ASP 83 H ASP 83 2.957 14.048 5.379
691 HA ASP 83 HA ASP 83 2.436 11.407 4.182
692 1HB ASP 83 2HB ASP 83 4.255 11.840 6.544
693 2HB ASP 83 1HB ASP 83 4.178 10.458 5.455
694 H LYS 84 H LYS 84 2.526 13.193 7.229
695 HA LYS 84 HA LYS 84 0.266 11.582 8.215
696 1HB LYS 84 2HB LYS 84 2.445 13.057 9.704
697 2HB LYS 84 1HB LYS 84 1.009 12.414 10.489
698 1HG LYS 84 2HG LYS 84 1.638 10.205 10.108
699 2HG LYS 84 1HG LYS 84 2.784 10.653 8.842
700 1HD LYS 84 2HD LYS 84 4.398 10.616 10.373
701 2HD LYS 84 1HD LYS 84 3.630 12.001 11.152
702 1HE LYS 84 2HE LYS 84 2.099 9.968 12.087
703 2HE LYS 84 1HE LYS 84 3.659 9.163 11.927
704 1HZ LYS 84 1HZ LYS 84 4.653 10.644 13.411
705 2HZ LYS 84 2HZ LYS 84 3.158 10.298 14.121
706 3HZ LYS 84 3HZ LYS 84 3.388 11.763 13.308
707 H TYR 85 H TYR 85 1.553 14.767 7.667
708 HA TYR 85 HA TYR 85 -0.760 16.118 8.772
709 1HB TYR 85 2HB TYR 85 1.827 17.040 7.542
710 2HB TYR 85 1HB TYR 85 0.505 18.166 7.829
711 HD1 TYR 85 1HD TYR 85 0.149 19.083 9.965
712 HD2 TYR 85 2HD TYR 85 2.777 15.766 9.519
713 HE1 TYR 85 1HE TYR 85 0.886 19.361 12.294
714 HE2 TYR 85 2HE TYR 85 3.520 16.035 11.847
715 HH TYR 85 HH TYR 85 3.572 18.172 13.529
716 H GLY 86 H GLY 86 -1.580 14.447 6.769
717 1HA GLY 86 2HA GLY 86 -3.352 15.399 5.228
718 2HA GLY 86 1HA GLY 86 -2.001 16.218 4.456
719 H ARG 87 H ARG 87 -2.221 12.951 5.747
720 HA ARG 87 HA ARG 87 -0.874 11.706 3.653
721 1HB ARG 87 2HB ARG 87 -1.830 9.604 4.543
722 2HB ARG 87 1HB ARG 87 -1.171 10.625 5.810
723 1HG ARG 87 2HG ARG 87 -4.011 11.071 5.296
724 2HG ARG 87 1HG ARG 87 -3.621 9.443 5.855
725 1HD ARG 87 2HD ARG 87 -2.324 11.680 7.286
726 2HD ARG 87 1HD ARG 87 -4.065 11.509 7.511
727 HE ARG 87 HE ARG 87 -2.716 9.025 7.848
728 1HH1 ARG 87 1HH1 ARG 87 -3.432 12.043 9.448
729 2HH1 ARG 87 2HH1 ARG 87 -3.306 11.374 11.038
730 1HH2 ARG 87 1HH2 ARG 87 -2.550 8.141 9.941
731 2HH2 ARG 87 2HH2 ARG 87 -2.805 9.157 11.320
732 H GLY 88 H GLY 88 -1.465 10.980 1.726
733 1HA GLY 88 2HA GLY 88 -4.338 11.014 1.038
734 2HA GLY 88 1HA GLY 88 -3.139 11.730 -0.023
735 H LEU 89 H LEU 89 -1.165 9.646 0.313
736 HA LEU 89 HA LEU 89 -2.463 7.600 -1.342
737 1HB LEU 89 2HB LEU 89 0.181 8.873 -1.313
738 2HB LEU 89 1HB LEU 89 0.210 7.147 -1.592
739 HG LEU 89 HG LEU 89 -1.697 7.807 -3.351
740 1HD1 LEU 89 1HD1 LEU 89 -1.790 9.947 -3.934
741 2HD1 LEU 89 2HD1 LEU 89 -0.035 10.056 -4.069
742 3HD1 LEU 89 3HD1 LEU 89 -0.816 10.307 -2.507
743 1HD2 LEU 89 1HD2 LEU 89 0.062 6.569 -4.168
744 2HD2 LEU 89 2HD2 LEU 89 1.276 7.706 -3.586
745 3HD2 LEU 89 3HD2 LEU 89 0.302 8.104 -4.999
746 H ALA 90 H ALA 90 -2.110 5.386 -1.004
747 HA ALA 90 HA ALA 90 -1.152 4.697 1.702
748 1HB ALA 90 1HB ALA 90 -3.674 4.294 0.545
749 2HB ALA 90 2HB ALA 90 -3.085 3.699 2.094
750 3HB ALA 90 3HB ALA 90 -2.909 2.710 0.646
751 H TYR 91 H TYR 91 0.003 2.811 2.006
752 HA TYR 91 HA TYR 91 1.032 1.529 -0.441
753 1HB TYR 91 2HB TYR 91 3.093 1.037 0.884
754 2HB TYR 91 1HB TYR 91 2.821 2.752 0.613
755 HD1 TYR 91 1HD TYR 91 1.632 4.042 2.539
756 HD2 TYR 91 2HD TYR 91 3.504 0.255 3.027
757 HE1 TYR 91 1HE TYR 91 1.801 4.446 4.958
758 HE2 TYR 91 2HE TYR 91 3.677 0.645 5.448
759 HH TYR 91 HH TYR 91 2.181 2.271 7.163
760 H ILE 92 H ILE 92 1.260 -0.693 -0.477
761 HA ILE 92 HA ILE 92 0.547 -2.254 1.866
762 HB ILE 92 HB ILE 92 -1.635 -1.795 0.834
763 1HG1 ILE 92 2HG1 ILE 92 -1.397 -4.611 0.080
764 2HG1 ILE 92 1HG1 ILE 92 -0.629 -4.250 1.621
765 1HG2 ILE 92 1HG2 ILE 92 -2.197 -2.377 -1.365
766 2HG2 ILE 92 2HG2 ILE 92 -0.739 -3.347 -1.574
767 3HG2 ILE 92 3HG2 ILE 92 -0.625 -1.589 -1.499
768 1HD1 ILE 92 1HD1 ILE 92 -2.584 -4.101 2.650
769 2HD1 ILE 92 2HD1 ILE 92 -3.305 -4.768 1.184
770 3HD1 ILE 92 3HD1 ILE 92 -3.236 -3.021 1.417
771 H TYR 93 H TYR 93 2.144 -3.693 1.966
772 HA TYR 93 HA TYR 93 3.214 -4.787 -0.548
773 1HB TYR 93 2HB TYR 93 4.676 -3.539 1.220
774 2HB TYR 93 1HB TYR 93 4.602 -5.063 2.096
775 HD1 TYR 93 1HD TYR 93 6.278 -6.601 1.713
776 HD2 TYR 93 2HD TYR 93 5.338 -3.794 -1.343
777 HE1 TYR 93 1HE TYR 93 8.133 -7.471 0.352
778 HE2 TYR 93 2HE TYR 93 7.189 -4.656 -2.713
779 HH TYR 93 HH TYR 93 9.646 -6.399 -1.595
780 H ALA 94 H ALA 94 2.772 -6.805 -1.042
781 HA ALA 94 HA ALA 94 2.234 -8.739 1.099
782 1HB ALA 94 1HB ALA 94 0.233 -9.432 0.253
783 2HB ALA 94 2HB ALA 94 0.636 -8.953 -1.396
784 3HB ALA 94 3HB ALA 94 0.171 -7.732 -0.211
785 H ASP 95 H ASP 95 4.245 -9.696 0.821
786 HA ASP 95 HA ASP 95 5.867 -11.000 -0.096
787 1HB ASP 95 2HB ASP 95 4.020 -12.614 0.070
788 2HB ASP 95 1HB ASP 95 3.487 -12.172 -1.550
789 H GLY 96 H GLY 96 6.209 -8.720 -1.252
790 1HA GLY 96 2HA GLY 96 7.346 -7.890 -3.096
791 2HA GLY 96 1HA GLY 96 7.022 -9.400 -3.935
792 H LYS 97 H LYS 97 4.505 -9.664 -4.332
793 HA LYS 97 HA LYS 97 3.626 -7.151 -5.590
794 1HB LYS 97 2HB LYS 97 3.199 -10.026 -6.394
795 2HB LYS 97 1HB LYS 97 2.279 -8.700 -7.092
796 1HG LYS 97 2HG LYS 97 4.639 -7.705 -7.591
797 2HG LYS 97 1HG LYS 97 5.160 -9.382 -7.414
798 1HD LYS 97 2HD LYS 97 4.618 -9.605 -9.575
799 2HD LYS 97 1HD LYS 97 2.942 -9.602 -9.022
800 1HE LYS 97 2HE LYS 97 4.443 -7.085 -9.706
801 2HE LYS 97 1HE LYS 97 3.515 -7.996 -10.897
802 1HZ LYS 97 1HZ LYS 97 2.259 -7.142 -8.371
803 2HZ LYS 97 2HZ LYS 97 1.530 -7.497 -9.855
804 3HZ LYS 97 3HZ LYS 97 2.396 -6.057 -9.662
805 H MET 98 H MET 98 1.887 -6.222 -4.759
806 HA MET 98 HA MET 98 0.342 -7.475 -2.713
807 1HB MET 98 2HB MET 98 -1.067 -5.367 -2.936
808 2HB MET 98 1HB MET 98 0.622 -5.139 -2.503
809 1HG MET 98 2HG MET 98 1.180 -4.309 -4.601
810 2HG MET 98 1HG MET 98 -0.263 -4.981 -5.356
811 1HE MET 98 1HE MET 98 -2.166 -2.135 -5.949
812 2HE MET 98 2HE MET 98 -1.102 -3.415 -6.532
813 3HE MET 98 3HE MET 98 -0.473 -1.783 -6.298
814 H VAL 99 H VAL 99 -1.070 -9.035 -3.160
815 HA VAL 99 HA VAL 99 -2.913 -8.631 -5.424
816 HB VAL 99 HB VAL 99 -2.977 -11.085 -5.738
817 1HG1 VAL 99 1HG1 VAL 99 -1.303 -9.371 -6.849
818 2HG1 VAL 99 2HG1 VAL 99 -1.205 -11.101 -7.179
819 3HG1 VAL 99 3HG1 VAL 99 -0.107 -10.363 -6.015
820 1HG2 VAL 99 1HG2 VAL 99 -2.319 -12.051 -3.736
821 2HG2 VAL 99 2HG2 VAL 99 -0.925 -10.987 -3.562
822 3HG2 VAL 99 3HG2 VAL 99 -0.898 -12.287 -4.754
823 H ASN 100 H ASN 100 -4.997 -8.675 -4.898
824 HA ASN 100 HA ASN 100 -5.747 -9.414 -2.183
825 1HB ASN 100 2HB ASN 100 -6.514 -7.327 -3.717
826 2HB ASN 100 1HB ASN 100 -7.814 -8.459 -4.077
827 1HD2 ASN 100 1HD2 ASN 100 -5.957 -7.592 -1.176
828 2HD2 ASN 100 2HD2 ASN 100 -7.336 -7.315 -0.173
829 H GLU 101 H GLU 101 -6.807 -10.147 -5.503
830 HA GLU 101 HA GLU 101 -7.969 -12.656 -4.482
831 1HB GLU 101 2HB GLU 101 -9.633 -11.121 -5.444
832 2HB GLU 101 1HB GLU 101 -8.732 -11.091 -6.953
833 1HG GLU 101 2HG GLU 101 -10.099 -12.722 -7.597
834 2HG GLU 101 1HG GLU 101 -9.115 -13.766 -6.572
835 H ALA 102 H ALA 102 -6.681 -14.323 -4.888
836 HA ALA 102 HA ALA 102 -4.695 -14.284 -6.945
837 1HB ALA 102 1HB ALA 102 -4.874 -15.587 -4.606
838 2HB ALA 102 2HB ALA 102 -3.830 -16.108 -5.928
839 3HB ALA 102 3HB ALA 102 -5.407 -16.865 -5.700
840 H LEU 103 H LEU 103 -4.825 -14.982 -8.980
841 HA LEU 103 HA LEU 103 -7.108 -16.683 -9.735
842 1HB LEU 103 2HB LEU 103 -6.146 -14.131 -10.930
843 2HB LEU 103 1HB LEU 103 -6.750 -15.366 -12.019
844 HG LEU 103 HG LEU 103 -8.779 -15.334 -10.266
845 1HD1 LEU 103 1HD1 LEU 103 -9.205 -13.269 -9.307
846 2HD1 LEU 103 2HD1 LEU 103 -8.049 -12.436 -10.346
847 3HD1 LEU 103 3HD1 LEU 103 -7.473 -13.471 -9.041
848 1HD2 LEU 103 1HD2 LEU 103 -8.788 -13.132 -12.258
849 2HD2 LEU 103 2HD2 LEU 103 -9.991 -14.382 -11.945
850 3HD2 LEU 103 3HD2 LEU 103 -8.524 -14.776 -12.841
851 H VAL 104 H VAL 104 -6.756 -17.812 -11.845
852 HA VAL 104 HA VAL 104 -5.574 -19.271 -13.131
853 HB VAL 104 HB VAL 104 -3.190 -17.485 -12.644
854 1HG1 VAL 104 1HG1 VAL 104 -3.618 -18.821 -15.233
855 2HG1 VAL 104 2HG1 VAL 104 -3.246 -19.883 -13.875
856 3HG1 VAL 104 3HG1 VAL 104 -2.136 -18.583 -14.308
857 1HG2 VAL 104 1HG2 VAL 104 -5.306 -16.315 -13.449
858 2HG2 VAL 104 2HG2 VAL 104 -5.113 -17.236 -14.940
859 3HG2 VAL 104 3HG2 VAL 104 -3.856 -16.109 -14.429
860 H ARG 105 H ARG 105 -5.594 -21.074 -11.845
861 HA ARG 105 HA ARG 105 -3.118 -21.602 -10.360
862 1HB ARG 105 2HB ARG 105 -4.850 -20.987 -8.728
863 2HB ARG 105 1HB ARG 105 -5.904 -22.239 -9.367
864 1HG ARG 105 2HG ARG 105 -4.579 -23.958 -8.511
865 2HG ARG 105 1HG ARG 105 -3.192 -22.892 -8.274
866 1HD ARG 105 2HD ARG 105 -4.300 -21.761 -6.469
867 2HD ARG 105 1HD ARG 105 -5.795 -22.642 -6.776
868 HE ARG 105 HE ARG 105 -3.722 -24.471 -6.250
869 1HH1 ARG 105 1HH1 ARG 105 -5.691 -22.091 -4.625
870 2HH1 ARG 105 2HH1 ARG 105 -5.595 -22.880 -3.086
871 1HH2 ARG 105 1HH2 ARG 105 -3.595 -25.509 -4.227
872 2HH2 ARG 105 2HH2 ARG 105 -4.406 -24.820 -2.860
873 H GLN 106 H GLN 106 -6.169 -23.284 -11.147
874 HA GLN 106 HA GLN 106 -4.624 -25.642 -11.909
875 1HB GLN 106 2HB GLN 106 -6.708 -25.660 -10.380
876 2HB GLN 106 1HB GLN 106 -7.624 -25.465 -11.868
877 1HG GLN 106 2HG GLN 106 -5.671 -27.700 -11.386
878 2HG GLN 106 1HG GLN 106 -7.401 -27.814 -11.065
879 1HE2 GLN 106 1HE2 GLN 106 -8.766 -27.069 -13.004
880 2HE2 GLN 106 2HE2 GLN 106 -8.290 -27.707 -14.537
881 H GLY 107 H GLY 107 -6.771 -23.224 -13.274
882 1HA GLY 107 2HA GLY 107 -6.339 -22.622 -15.615
883 2HA GLY 107 1HA GLY 107 -6.191 -24.341 -15.948
884 H LEU 108 H LEU 108 -8.653 -22.843 -13.922
885 HA LEU 108 HA LEU 108 -10.720 -24.092 -15.518
886 1HB LEU 108 2HB LEU 108 -10.743 -24.051 -13.015
887 2HB LEU 108 1HB LEU 108 -11.017 -22.320 -13.094
888 HG LEU 108 HG LEU 108 -13.075 -23.050 -14.585
889 1HD1 LEU 108 1HD1 LEU 108 -13.946 -25.178 -13.259
890 2HD1 LEU 108 2HD1 LEU 108 -12.219 -25.529 -13.207
891 3HD1 LEU 108 3HD1 LEU 108 -13.029 -25.313 -14.760
892 1HD2 LEU 108 1HD2 LEU 108 -13.109 -21.810 -12.434
893 2HD2 LEU 108 2HD2 LEU 108 -13.110 -23.356 -11.586
894 3HD2 LEU 108 3HD2 LEU 108 -14.464 -22.920 -12.630
895 H ALA 109 H ALA 109 -9.407 -20.905 -14.980
896 HA ALA 109 HA ALA 109 -9.766 -18.901 -15.997
897 1HB ALA 109 1HB ALA 109 -9.501 -20.294 -18.039
898 2HB ALA 109 2HB ALA 109 -10.535 -18.885 -18.270
899 3HB ALA 109 3HB ALA 109 -11.254 -20.484 -18.086
900 H LYS 110 H LYS 110 -11.449 -17.305 -16.565
901 HA LYS 110 HA LYS 110 -13.833 -17.781 -14.954
902 1HB LYS 110 2HB LYS 110 -12.165 -15.619 -15.159
903 2HB LYS 110 1HB LYS 110 -13.501 -15.137 -16.196
904 1HG LYS 110 2HG LYS 110 -14.698 -14.579 -14.424
905 2HG LYS 110 1HG LYS 110 -14.582 -16.227 -13.805
906 1HD LYS 110 2HD LYS 110 -12.237 -14.435 -13.449
907 2HD LYS 110 1HD LYS 110 -13.658 -14.148 -12.443
908 1HE LYS 110 2HE LYS 110 -12.827 -16.958 -12.638
909 2HE LYS 110 1HE LYS 110 -11.663 -15.896 -11.848
910 1HZ LYS 110 1HZ LYS 110 -13.013 -15.575 -10.093
911 2HZ LYS 110 2HZ LYS 110 -13.685 -17.049 -10.577
912 3HZ LYS 110 3HZ LYS 110 -14.430 -15.596 -11.017
Start of MODEL 4
1 1H ALA 1 1HT ALA 1 1.214 17.332 -20.038
2 2H ALA 1 2HT ALA 1 0.961 15.921 -20.983
3 3H ALA 1 3HT ALA 1 2.556 16.409 -20.576
4 HA ALA 1 HA ALA 1 0.568 15.782 -18.527
5 1HB ALA 1 1HB ALA 1 2.428 13.833 -19.882
6 2HB ALA 1 2HB ALA 1 0.670 13.856 -20.024
7 3HB ALA 1 3HB ALA 1 1.424 13.497 -18.471
8 H THR 2 H THR 2 1.434 15.816 -16.512
9 HA THR 2 HA THR 2 4.241 16.657 -16.319
10 HB THR 2 HB THR 2 3.350 17.221 -13.881
11 HG1 THR 2 1HG THR 2 1.004 17.456 -15.451
12 1HG2 THR 2 1HG2 THR 2 2.552 18.957 -16.201
13 2HG2 THR 2 2HG2 THR 2 4.184 18.868 -15.534
14 3HG2 THR 2 3HG2 THR 2 2.855 19.459 -14.537
15 H SER 3 H SER 3 5.440 14.847 -16.113
16 HA SER 3 HA SER 3 4.622 12.509 -14.754
17 1HB SER 3 2HB SER 3 6.388 12.559 -16.505
18 2HB SER 3 1HB SER 3 7.446 13.409 -15.378
19 HG SER 3 HG SER 3 7.879 11.577 -14.454
20 H THR 4 H THR 4 4.665 11.974 -12.665
21 HA THR 4 HA THR 4 5.702 13.919 -10.759
22 HB THR 4 HB THR 4 4.485 12.616 -9.076
23 HG1 THR 4 1HG THR 4 4.715 10.552 -9.955
24 1HG2 THR 4 1HG2 THR 4 2.166 12.585 -10.388
25 2HG2 THR 4 2HG2 THR 4 3.104 13.596 -11.488
26 3HG2 THR 4 3HG2 THR 4 2.921 14.066 -9.799
27 H LYS 5 H LYS 5 7.244 13.475 -9.205
28 HA LYS 5 HA LYS 5 9.309 11.701 -9.921
29 1HB LYS 5 2HB LYS 5 8.786 13.094 -7.289
30 2HB LYS 5 1HB LYS 5 10.291 12.295 -7.723
31 1HG LYS 5 2HG LYS 5 9.317 14.345 -9.608
32 2HG LYS 5 1HG LYS 5 9.863 14.921 -8.032
33 1HD LYS 5 2HD LYS 5 12.024 14.016 -8.340
34 2HD LYS 5 1HD LYS 5 11.502 13.050 -9.723
35 1HE LYS 5 2HE LYS 5 11.244 14.999 -11.075
36 2HE LYS 5 1HE LYS 5 11.487 16.061 -9.689
37 1HZ LYS 5 1HZ LYS 5 13.752 14.739 -9.605
38 2HZ LYS 5 2HZ LYS 5 13.558 16.115 -10.569
39 3HZ LYS 5 3HZ LYS 5 13.448 14.575 -11.261
40 H LYS 6 H LYS 6 9.745 9.647 -9.375
41 HA LYS 6 HA LYS 6 7.747 8.210 -7.809
42 1HB LYS 6 2HB LYS 6 8.661 7.475 -10.114
43 2HB LYS 6 1HB LYS 6 10.081 6.951 -9.221
44 1HG LYS 6 2HG LYS 6 9.040 5.022 -8.896
45 2HG LYS 6 1HG LYS 6 7.954 5.880 -7.802
46 1HD LYS 6 2HD LYS 6 7.290 6.137 -10.652
47 2HD LYS 6 1HD LYS 6 7.161 4.499 -10.009
48 1HE LYS 6 2HE LYS 6 5.158 5.066 -9.223
49 2HE LYS 6 1HE LYS 6 5.988 6.108 -8.068
50 1HZ LYS 6 1HZ LYS 6 4.568 6.809 -10.516
51 2HZ LYS 6 2HZ LYS 6 5.948 7.715 -10.154
52 3HZ LYS 6 3HZ LYS 6 4.672 7.643 -9.047
53 H LEU 7 H LEU 7 8.063 7.693 -5.754
54 HA LEU 7 HA LEU 7 10.485 8.308 -4.398
55 1HB LEU 7 2HB LEU 7 9.396 7.542 -2.424
56 2HB LEU 7 1HB LEU 7 8.207 8.401 -3.385
57 HG LEU 7 HG LEU 7 8.200 5.555 -3.974
58 1HD1 LEU 7 1HD1 LEU 7 7.030 5.934 -1.327
59 2HD1 LEU 7 2HD1 LEU 7 8.791 6.011 -1.347
60 3HD1 LEU 7 3HD1 LEU 7 7.965 4.588 -1.977
61 1HD2 LEU 7 1HD2 LEU 7 6.348 6.733 -4.694
62 2HD2 LEU 7 2HD2 LEU 7 6.240 7.680 -3.210
63 3HD2 LEU 7 3HD2 LEU 7 5.757 5.983 -3.213
64 H HIS 8 H HIS 8 11.803 6.813 -3.171
65 HA HIS 8 HA HIS 8 12.477 4.480 -4.718
66 1HB HIS 8 2HB HIS 8 14.286 4.210 -2.994
67 2HB HIS 8 1HB HIS 8 14.303 5.757 -3.835
68 HD1 HIS 8 1HD HIS 8 11.672 5.744 -1.354
69 HD2 HIS 8 2HD HIS 8 15.763 6.469 -1.367
70 HE1 HIS 8 1HE HIS 8 12.139 6.990 0.778
71 HE2 HIS 8 2HE HIS 8 14.607 7.488 0.710
72 H LYS 9 H LYS 9 12.640 2.330 -3.854
73 HA LYS 9 HA LYS 9 10.338 1.614 -2.299
74 1HB LYS 9 2HB LYS 9 11.136 -0.709 -2.635
75 2HB LYS 9 1HB LYS 9 10.999 0.194 -4.137
76 1HG LYS 9 2HG LYS 9 13.600 0.652 -3.411
77 2HG LYS 9 1HG LYS 9 13.335 -1.008 -2.877
78 1HD LYS 9 2HD LYS 9 12.366 -0.262 -5.581
79 2HD LYS 9 1HD LYS 9 14.108 -0.419 -5.352
80 1HE LYS 9 2HE LYS 9 13.755 -2.595 -5.765
81 2HE LYS 9 1HE LYS 9 13.193 -2.652 -4.095
82 1HZ LYS 9 1HZ LYS 9 11.369 -3.515 -5.054
83 2HZ LYS 9 2HZ LYS 9 11.682 -2.825 -6.566
84 3HZ LYS 9 3HZ LYS 9 10.969 -1.897 -5.344
85 H GLU 10 H GLU 10 10.207 1.114 -0.196
86 HA GLU 10 HA GLU 10 12.544 0.361 1.326
87 1HB GLU 10 2HB GLU 10 12.497 2.905 1.247
88 2HB GLU 10 1HB GLU 10 11.022 2.814 2.199
89 1HG GLU 10 2HG GLU 10 12.572 1.295 3.732
90 2HG GLU 10 1HG GLU 10 13.826 2.280 2.977
91 HA PRO 11 HA PRO 11 9.049 -1.778 3.164
92 1HB PRO 11 2HB PRO 11 10.438 -3.623 4.525
93 2HB PRO 11 1HB PRO 11 10.295 -3.684 2.764
94 1HG PRO 11 2HG PRO 11 12.570 -2.723 4.447
95 2HG PRO 11 1HG PRO 11 12.605 -3.683 2.959
96 1HD PRO 11 2HD PRO 11 13.049 -0.966 3.071
97 2HD PRO 11 1HD PRO 11 12.495 -1.832 1.626
98 H ALA 12 H ALA 12 8.405 -2.431 5.406
99 HA ALA 12 HA ALA 12 9.651 -0.792 7.500
100 1HB ALA 12 1HB ALA 12 6.852 -0.747 7.942
101 2HB ALA 12 2HB ALA 12 7.141 -0.252 6.274
102 3HB ALA 12 3HB ALA 12 7.929 0.605 7.597
103 H THR 13 H THR 13 6.629 -2.634 7.486
104 HA THR 13 HA THR 13 6.143 -4.731 8.331
105 HB THR 13 HB THR 13 8.794 -4.804 9.758
106 HG1 THR 13 1HG THR 13 9.745 -5.100 7.931
107 1HG2 THR 13 1HG2 THR 13 8.134 -6.801 10.414
108 2HG2 THR 13 2HG2 THR 13 8.031 -7.305 8.728
109 3HG2 THR 13 3HG2 THR 13 6.618 -6.621 9.532
110 H LEU 14 H LEU 14 8.236 -3.215 10.795
111 HA LEU 14 HA LEU 14 6.672 -3.790 12.991
112 1HB LEU 14 2HB LEU 14 9.024 -2.620 12.721
113 2HB LEU 14 1HB LEU 14 8.070 -1.157 12.884
114 HG LEU 14 HG LEU 14 8.925 -1.718 15.042
115 1HD1 LEU 14 1HD1 LEU 14 6.470 -1.023 14.745
116 2HD1 LEU 14 2HD1 LEU 14 6.966 -1.686 16.302
117 3HD1 LEU 14 3HD1 LEU 14 6.094 -2.698 15.151
118 1HD2 LEU 14 1HD2 LEU 14 9.526 -3.947 14.996
119 2HD2 LEU 14 2HD2 LEU 14 7.966 -4.464 14.354
120 3HD2 LEU 14 3HD2 LEU 14 8.106 -3.972 16.041
121 H ILE 15 H ILE 15 4.474 -3.532 12.452
122 HA ILE 15 HA ILE 15 3.565 -0.733 12.486
123 HB ILE 15 HB ILE 15 1.641 -1.369 11.111
124 1HG1 ILE 15 2HG1 ILE 15 2.007 -3.652 9.857
125 2HG1 ILE 15 1HG1 ILE 15 2.917 -4.071 11.306
126 1HG2 ILE 15 1HG2 ILE 15 3.316 -2.242 9.109
127 2HG2 ILE 15 2HG2 ILE 15 4.408 -1.414 10.219
128 3HG2 ILE 15 3HG2 ILE 15 3.015 -0.562 9.553
129 1HD1 ILE 15 1HD1 ILE 15 0.161 -2.970 11.565
130 2HD1 ILE 15 2HD1 ILE 15 1.051 -4.043 12.646
131 3HD1 ILE 15 3HD1 ILE 15 0.398 -4.662 11.128
132 H LYS 16 H LYS 16 1.021 -0.821 12.914
133 HA LYS 16 HA LYS 16 0.504 -2.638 15.164
134 1HB LYS 16 2HB LYS 16 -0.209 0.297 15.207
135 2HB LYS 16 1HB LYS 16 -0.350 -0.860 16.524
136 1HG LYS 16 2HG LYS 16 1.876 -0.788 17.016
137 2HG LYS 16 1HG LYS 16 2.341 -0.391 15.360
138 1HD LYS 16 2HD LYS 16 2.742 1.585 16.531
139 2HD LYS 16 1HD LYS 16 1.161 1.856 15.795
140 1HE LYS 16 2HE LYS 16 0.138 1.071 17.951
141 2HE LYS 16 1HE LYS 16 1.758 1.090 18.647
142 1HZ LYS 16 1HZ LYS 16 1.639 3.532 17.600
143 2HZ LYS 16 2HZ LYS 16 1.176 3.178 19.188
144 3HZ LYS 16 3HZ LYS 16 0.004 3.302 17.975
145 H ALA 17 H ALA 17 -1.916 -2.400 15.826
146 HA ALA 17 HA ALA 17 -3.451 -2.671 13.358
147 1HB ALA 17 1HB ALA 17 -4.754 -4.163 14.436
148 2HB ALA 17 2HB ALA 17 -4.761 -3.236 15.937
149 3HB ALA 17 3HB ALA 17 -3.377 -4.252 15.536
150 H ILE 18 H ILE 18 -4.950 -1.267 12.707
151 HA ILE 18 HA ILE 18 -6.064 0.654 14.617
152 HB ILE 18 HB ILE 18 -5.009 1.522 11.928
153 1HG1 ILE 18 2HG1 ILE 18 -3.458 2.810 13.771
154 2HG1 ILE 18 1HG1 ILE 18 -3.664 1.238 14.536
155 1HG2 ILE 18 1HG2 ILE 18 -6.709 2.989 12.552
156 2HG2 ILE 18 2HG2 ILE 18 -5.239 3.793 13.106
157 3HG2 ILE 18 3HG2 ILE 18 -6.262 2.933 14.258
158 1HD1 ILE 18 1HD1 ILE 18 -3.054 0.600 11.931
159 2HD1 ILE 18 2HD1 ILE 18 -1.943 0.582 13.299
160 3HD1 ILE 18 3HD1 ILE 18 -2.042 2.005 12.263
161 H ASP 19 H ASP 19 -8.015 1.710 13.841
162 HA ASP 19 HA ASP 19 -9.513 -0.048 12.039
163 1HB ASP 19 2HB ASP 19 -10.144 1.243 14.480
164 2HB ASP 19 1HB ASP 19 -11.151 1.984 13.241
165 H GLY 20 H GLY 20 -10.683 0.723 10.277
166 1HA GLY 20 2HA GLY 20 -11.452 2.371 8.776
167 2HA GLY 20 1HA GLY 20 -10.414 3.547 9.568
168 H ASP 21 H ASP 21 -9.051 4.312 8.093
169 HA ASP 21 HA ASP 21 -7.593 2.369 6.428
170 1HB ASP 21 2HB ASP 21 -9.014 4.864 5.661
171 2HB ASP 21 1HB ASP 21 -7.473 4.552 4.869
172 H THR 22 H THR 22 -5.840 2.335 7.859
173 HA THR 22 HA THR 22 -3.855 4.280 7.409
174 HB THR 22 HB THR 22 -5.361 5.543 8.981
175 HG1 THR 22 1HG THR 22 -3.273 6.212 8.914
176 1HG2 THR 22 1HG2 THR 22 -4.459 3.441 10.928
177 2HG2 THR 22 2HG2 THR 22 -6.113 3.875 10.496
178 3HG2 THR 22 3HG2 THR 22 -5.111 5.009 11.399
179 H VAL 23 H VAL 23 -1.876 3.460 7.860
180 HA VAL 23 HA VAL 23 -1.642 1.248 9.762
181 HB VAL 23 HB VAL 23 -0.188 0.024 8.074
182 1HG1 VAL 23 1HG1 VAL 23 -2.107 -1.135 8.440
183 2HG1 VAL 23 2HG1 VAL 23 -2.392 -0.688 6.758
184 3HG1 VAL 23 3HG1 VAL 23 -3.144 0.239 8.058
185 1HG2 VAL 23 1HG2 VAL 23 -0.446 2.247 6.562
186 2HG2 VAL 23 2HG2 VAL 23 -1.717 1.239 5.869
187 3HG2 VAL 23 3HG2 VAL 23 -0.054 0.655 5.912
188 H LYS 24 H LYS 24 -0.043 1.746 11.102
189 HA LYS 24 HA LYS 24 1.925 3.723 10.416
190 1HB LYS 24 2HB LYS 24 0.939 3.573 12.677
191 2HB LYS 24 1HB LYS 24 1.705 2.005 12.891
192 1HG LYS 24 2HG LYS 24 3.751 3.759 12.126
193 2HG LYS 24 1HG LYS 24 2.777 4.630 13.313
194 1HD LYS 24 2HD LYS 24 2.926 2.504 14.727
195 2HD LYS 24 1HD LYS 24 4.210 2.007 13.623
196 1HE LYS 24 2HE LYS 24 5.505 3.063 15.152
197 2HE LYS 24 1HE LYS 24 5.067 4.474 14.192
198 1HZ LYS 24 1HZ LYS 24 4.454 5.272 16.187
199 2HZ LYS 24 2HZ LYS 24 4.262 3.741 16.881
200 3HZ LYS 24 3HZ LYS 24 3.037 4.390 15.910
201 H LEU 25 H LEU 25 3.333 2.977 8.891
202 HA LEU 25 HA LEU 25 4.714 0.445 9.349
203 1HB LEU 25 2HB LEU 25 4.322 2.240 6.996
204 2HB LEU 25 1HB LEU 25 5.730 1.199 7.031
205 HG LEU 25 HG LEU 25 3.607 -0.492 7.674
206 1HD1 LEU 25 1HD1 LEU 25 2.634 0.531 5.153
207 2HD1 LEU 25 2HD1 LEU 25 2.477 1.722 6.443
208 3HD1 LEU 25 3HD1 LEU 25 1.752 0.125 6.625
209 1HD2 LEU 25 1HD2 LEU 25 4.007 -1.088 5.118
210 2HD2 LEU 25 2HD2 LEU 25 5.194 -1.460 6.368
211 3HD2 LEU 25 3HD2 LEU 25 5.397 -0.030 5.358
212 H MET 26 H MET 26 6.956 0.318 9.574
213 HA MET 26 HA MET 26 8.180 2.576 10.818
214 1HB MET 26 2HB MET 26 8.675 0.269 11.513
215 2HB MET 26 1HB MET 26 9.391 -0.053 9.941
216 1HG MET 26 2HG MET 26 11.269 1.180 10.384
217 2HG MET 26 1HG MET 26 10.453 2.196 11.571
218 1HE MET 26 1HE MET 26 13.114 1.321 11.705
219 2HE MET 26 2HE MET 26 13.548 -0.260 12.355
220 3HE MET 26 3HE MET 26 13.202 1.077 13.451
221 H TYR 27 H TYR 27 8.513 4.274 9.475
222 HA TYR 27 HA TYR 27 9.984 3.794 6.976
223 1HB TYR 27 2HB TYR 27 7.778 5.047 6.938
224 2HB TYR 27 1HB TYR 27 8.593 6.343 7.805
225 HD1 TYR 27 1HD TYR 27 9.950 7.906 6.662
226 HD2 TYR 27 2HD TYR 27 8.585 4.422 4.640
227 HE1 TYR 27 1HE TYR 27 10.736 8.844 4.530
228 HE2 TYR 27 2HE TYR 27 9.368 5.350 2.500
229 HH TYR 27 HH TYR 27 10.120 8.528 2.041
230 H LYS 28 H LYS 28 12.086 3.680 7.679
231 HA LYS 28 HA LYS 28 14.116 4.377 8.441
232 1HB LYS 28 2HB LYS 28 13.376 6.176 6.688
233 2HB LYS 28 1HB LYS 28 13.234 7.218 8.097
234 1HG LYS 28 2HG LYS 28 15.593 6.709 8.654
235 2HG LYS 28 1HG LYS 28 15.709 5.794 7.149
236 1HD LYS 28 2HD LYS 28 15.014 7.878 5.937
237 2HD LYS 28 1HD LYS 28 15.168 8.742 7.469
238 1HE LYS 28 2HE LYS 28 17.519 8.104 7.600
239 2HE LYS 28 1HE LYS 28 17.370 7.214 6.087
240 1HZ LYS 28 1HZ LYS 28 17.395 9.097 4.871
241 2HZ LYS 28 2HZ LYS 28 18.221 9.714 6.212
242 3HZ LYS 28 3HZ LYS 28 16.564 10.009 6.029
243 H GLY 29 H GLY 29 11.949 4.090 10.390
244 1HA GLY 29 2HA GLY 29 11.956 4.246 12.709
245 2HA GLY 29 1HA GLY 29 13.272 5.404 12.600
246 H GLN 30 H GLN 30 10.456 5.955 10.679
247 HA GLN 30 HA GLN 30 9.541 7.987 12.601
248 1HB GLN 30 2HB GLN 30 9.757 8.218 9.597
249 2HB GLN 30 1HB GLN 30 8.917 9.381 10.614
250 1HG GLN 30 2HG GLN 30 10.830 10.288 11.400
251 2HG GLN 30 1HG GLN 30 11.709 8.761 11.348
252 1HE2 GLN 30 1HE2 GLN 30 13.363 8.884 10.026
253 2HE2 GLN 30 2HE2 GLN 30 13.395 9.691 8.498
254 HA PRO 31 HA PRO 31 5.747 5.623 12.299
255 1HB PRO 31 2HB PRO 31 4.577 8.063 13.508
256 2HB PRO 31 1HB PRO 31 4.512 6.388 14.067
257 1HG PRO 31 2HG PRO 31 6.051 8.189 15.297
258 2HG PRO 31 1HG PRO 31 6.586 6.510 15.090
259 1HD PRO 31 2HD PRO 31 7.391 8.959 13.571
260 2HD PRO 31 1HD PRO 31 8.381 7.585 14.105
261 H MET 32 H MET 32 4.487 5.457 10.569
262 HA MET 32 HA MET 32 3.365 7.875 9.347
263 1HB MET 32 2HB MET 32 3.850 6.801 7.082
264 2HB MET 32 1HB MET 32 5.221 7.501 7.929
265 1HG MET 32 2HG MET 32 6.244 5.524 8.177
266 2HG MET 32 1HG MET 32 4.736 4.673 8.505
267 1HE MET 32 1HE MET 32 3.116 3.811 6.766
268 2HE MET 32 2HE MET 32 3.365 3.813 5.021
269 3HE MET 32 3HE MET 32 2.964 5.314 5.855
270 H THR 33 H THR 33 1.235 7.562 9.578
271 HA THR 33 HA THR 33 0.148 4.886 9.017
272 HB THR 33 HB THR 33 -1.655 6.676 10.438
273 HG1 THR 33 1HG THR 33 0.097 7.509 11.458
274 1HG2 THR 33 1HG2 THR 33 -0.622 4.272 11.767
275 2HG2 THR 33 2HG2 THR 33 -1.421 4.007 10.219
276 3HG2 THR 33 3HG2 THR 33 -2.280 4.822 11.526
277 H PHE 34 H PHE 34 -0.246 5.097 6.843
278 HA PHE 34 HA PHE 34 -2.488 6.830 6.158
279 1HB PHE 34 2HB PHE 34 -0.256 6.673 4.173
280 2HB PHE 34 1HB PHE 34 -1.492 7.898 4.368
281 HD1 PHE 34 1HD PHE 34 -1.354 9.283 6.585
282 HD2 PHE 34 2HD PHE 34 1.887 7.107 4.892
283 HE1 PHE 34 1HE PHE 34 0.239 10.682 7.838
284 HE2 PHE 34 2HE PHE 34 3.484 8.504 6.139
285 HZ PHE 34 HZ PHE 34 2.658 10.293 7.617
286 H ARG 35 H ARG 35 -3.828 6.005 4.587
287 HA ARG 35 HA ARG 35 -3.164 3.470 3.329
288 1HB ARG 35 2HB ARG 35 -4.582 3.481 5.672
289 2HB ARG 35 1HB ARG 35 -5.863 3.459 4.467
290 1HG ARG 35 2HG ARG 35 -4.630 1.511 3.408
291 2HG ARG 35 1HG ARG 35 -3.661 1.460 4.882
292 1HD ARG 35 2HD ARG 35 -5.717 1.183 6.201
293 2HD ARG 35 1HD ARG 35 -6.662 1.194 4.712
294 HE ARG 35 HE ARG 35 -4.594 -0.810 4.785
295 1HH1 ARG 35 1HH1 ARG 35 -7.912 -0.075 5.581
296 2HH1 ARG 35 2HH1 ARG 35 -8.413 -1.733 5.570
297 1HH2 ARG 35 1HH2 ARG 35 -5.249 -2.988 4.770
298 2HH2 ARG 35 2HH2 ARG 35 -6.900 -3.388 5.110
299 H LEU 36 H LEU 36 -3.332 4.274 1.230
300 HA LEU 36 HA LEU 36 -6.053 4.933 0.403
301 1HB LEU 36 2HB LEU 36 -4.369 6.975 0.813
302 2HB LEU 36 1HB LEU 36 -3.940 6.586 -0.843
303 HG LEU 36 HG LEU 36 -6.749 6.653 -0.789
304 1HD1 LEU 36 1HD1 LEU 36 -5.978 9.308 0.205
305 2HD1 LEU 36 2HD1 LEU 36 -6.012 8.026 1.417
306 3HD1 LEU 36 3HD1 LEU 36 -7.454 8.378 0.465
307 1HD2 LEU 36 1HD2 LEU 36 -4.554 8.334 -1.899
308 2HD2 LEU 36 2HD2 LEU 36 -6.217 8.909 -2.016
309 3HD2 LEU 36 3HD2 LEU 36 -5.764 7.365 -2.737
310 H LEU 37 H LEU 37 -6.119 2.907 -0.589
311 HA LEU 37 HA LEU 37 -4.486 2.714 -3.032
312 1HB LEU 37 2HB LEU 37 -4.632 0.226 -2.770
313 2HB LEU 37 1HB LEU 37 -3.632 1.043 -1.583
314 HG LEU 37 HG LEU 37 -6.120 0.930 -0.362
315 1HD1 LEU 37 1HD1 LEU 37 -5.837 -1.268 -2.274
316 2HD1 LEU 37 2HD1 LEU 37 -7.269 -0.658 -1.447
317 3HD1 LEU 37 3HD1 LEU 37 -6.185 -1.779 -0.624
318 1HD2 LEU 37 1HD2 LEU 37 -5.011 -0.259 1.255
319 2HD2 LEU 37 2HD2 LEU 37 -3.650 0.438 0.379
320 3HD2 LEU 37 3HD2 LEU 37 -4.123 -1.235 0.086
321 H LEU 38 H LEU 38 -6.199 3.734 -4.163
322 HA LEU 38 HA LEU 38 -8.422 1.908 -4.756
323 1HB LEU 38 2HB LEU 38 -8.654 4.379 -3.441
324 2HB LEU 38 1HB LEU 38 -9.210 4.664 -5.078
325 HG LEU 38 HG LEU 38 -10.605 2.451 -4.603
326 1HD1 LEU 38 1HD1 LEU 38 -11.417 2.964 -2.109
327 2HD1 LEU 38 2HD1 LEU 38 -9.717 3.404 -1.951
328 3HD1 LEU 38 3HD1 LEU 38 -10.162 1.783 -2.488
329 1HD2 LEU 38 1HD2 LEU 38 -11.522 4.623 -5.242
330 2HD2 LEU 38 2HD2 LEU 38 -11.364 5.186 -3.578
331 3HD2 LEU 38 3HD2 LEU 38 -12.480 3.876 -3.965
332 H VAL 39 H VAL 39 -8.498 1.419 -6.843
333 HA VAL 39 HA VAL 39 -7.694 3.429 -8.819
334 HB VAL 39 HB VAL 39 -5.736 1.993 -8.475
335 1HG1 VAL 39 1HG1 VAL 39 -7.077 -0.014 -7.770
336 2HG1 VAL 39 2HG1 VAL 39 -5.747 -0.345 -8.878
337 3HG1 VAL 39 3HG1 VAL 39 -7.405 -0.301 -9.478
338 1HG2 VAL 39 1HG2 VAL 39 -6.468 2.910 -10.755
339 2HG2 VAL 39 2HG2 VAL 39 -6.920 1.248 -11.128
340 3HG2 VAL 39 3HG2 VAL 39 -5.248 1.638 -10.732
341 H ASP 40 H ASP 40 -8.811 3.364 -10.732
342 HA ASP 40 HA ASP 40 -11.107 1.542 -10.787
343 1HB ASP 40 2HB ASP 40 -10.694 4.322 -11.512
344 2HB ASP 40 1HB ASP 40 -11.424 3.418 -12.835
345 H THR 41 H THR 41 -11.269 -0.033 -12.247
346 HA THR 41 HA THR 41 -9.246 -0.156 -14.371
347 HB THR 41 HB THR 41 -10.972 -2.349 -13.209
348 HG1 THR 41 1HG THR 41 -9.268 -2.870 -12.014
349 1HG2 THR 41 1HG2 THR 41 -10.204 -3.787 -14.714
350 2HG2 THR 41 2HG2 THR 41 -8.564 -3.144 -14.619
351 3HG2 THR 41 3HG2 THR 41 -9.755 -2.372 -15.667
352 HA PRO 42 HA PRO 42 -12.968 0.850 -16.834
353 1HB PRO 42 2HB PRO 42 -11.618 1.971 -18.895
354 2HB PRO 42 1HB PRO 42 -11.987 2.854 -17.408
355 1HG PRO 42 2HG PRO 42 -9.442 1.504 -18.229
356 2HG PRO 42 1HG PRO 42 -9.672 3.090 -17.466
357 1HD PRO 42 2HD PRO 42 -8.939 0.886 -16.067
358 2HD PRO 42 1HD PRO 42 -9.927 2.183 -15.365
359 H GLU 43 H GLU 43 -13.733 0.044 -18.853
360 HA GLU 43 HA GLU 43 -12.238 -1.506 -20.641
361 1HB GLU 43 2HB GLU 43 -12.768 -2.863 -18.233
362 2HB GLU 43 1HB GLU 43 -13.880 -3.536 -19.417
363 1HG GLU 43 2HG GLU 43 -12.239 -4.522 -20.602
364 2HG GLU 43 1HG GLU 43 -11.093 -3.215 -20.309
365 H THR 44 H THR 44 -13.360 -1.492 -22.468
366 HA THR 44 HA THR 44 -16.162 -0.781 -22.425
367 HB THR 44 HB THR 44 -14.780 -1.468 -24.969
368 HG1 THR 44 1HG THR 44 -13.344 0.065 -24.829
369 1HG2 THR 44 1HG2 THR 44 -16.358 -0.208 -25.859
370 2HG2 THR 44 2HG2 THR 44 -15.902 1.156 -24.837
371 3HG2 THR 44 3HG2 THR 44 -17.070 -0.031 -24.257
372 H LYS 45 H LYS 45 -17.743 -2.218 -22.367
373 HA LYS 45 HA LYS 45 -19.007 -4.061 -22.833
374 1HB LYS 45 2HB LYS 45 -17.534 -3.881 -25.071
375 2HB LYS 45 1HB LYS 45 -16.925 -5.412 -24.458
376 1HG LYS 45 2HG LYS 45 -19.656 -5.667 -24.198
377 2HG LYS 45 1HG LYS 45 -19.467 -4.780 -25.712
378 1HD LYS 45 2HD LYS 45 -17.525 -6.858 -25.658
379 2HD LYS 45 1HD LYS 45 -19.087 -7.554 -25.220
380 1HE LYS 45 2HE LYS 45 -19.980 -7.182 -27.267
381 2HE LYS 45 1HE LYS 45 -19.086 -5.681 -27.503
382 1HZ LYS 45 1HZ LYS 45 -18.013 -8.436 -27.793
383 2HZ LYS 45 2HZ LYS 45 -17.087 -7.026 -27.918
384 3HZ LYS 45 3HZ LYS 45 -18.313 -7.333 -29.042
385 H HIS 46 H HIS 46 -16.244 -3.984 -21.117
386 HA HIS 46 HA HIS 46 -16.528 -6.787 -20.264
387 1HB HIS 46 2HB HIS 46 -14.245 -5.623 -21.297
388 2HB HIS 46 1HB HIS 46 -13.985 -5.524 -19.560
389 HD1 HIS 46 1HD HIS 46 -15.790 -8.398 -21.187
390 HD2 HIS 46 2HD HIS 46 -12.114 -7.555 -19.440
391 HE1 HIS 46 1HE HIS 46 -14.642 -10.620 -20.933
392 HE2 HIS 46 2HE HIS 46 -12.383 -10.075 -19.957
393 HA PRO 47 HA PRO 47 -17.602 -5.184 -16.288
394 1HB PRO 47 2HB PRO 47 -16.894 -7.276 -14.717
395 2HB PRO 47 1HB PRO 47 -18.315 -7.308 -15.767
396 1HG PRO 47 2HG PRO 47 -15.592 -8.465 -16.229
397 2HG PRO 47 1HG PRO 47 -17.181 -9.183 -16.550
398 1HD PRO 47 2HD PRO 47 -15.677 -8.054 -18.495
399 2HD PRO 47 1HD PRO 47 -17.452 -8.014 -18.519
400 H LYS 48 H LYS 48 -16.568 -3.746 -15.061
401 HA LYS 48 HA LYS 48 -13.795 -3.401 -15.045
402 1HB LYS 48 2HB LYS 48 -14.171 -1.770 -13.264
403 2HB LYS 48 1HB LYS 48 -15.376 -1.597 -14.532
404 1HG LYS 48 2HG LYS 48 -17.064 -2.553 -13.207
405 2HG LYS 48 1HG LYS 48 -15.900 -3.183 -12.039
406 1HD LYS 48 2HD LYS 48 -15.308 -0.839 -11.455
407 2HD LYS 48 1HD LYS 48 -16.600 -0.290 -12.523
408 1HE LYS 48 2HE LYS 48 -17.041 -2.175 -10.217
409 2HE LYS 48 1HE LYS 48 -17.186 -0.423 -10.075
410 1HZ LYS 48 1HZ LYS 48 -18.880 -2.307 -11.579
411 2HZ LYS 48 2HZ LYS 48 -18.797 -0.685 -12.051
412 3HZ LYS 48 3HZ LYS 48 -19.336 -1.086 -10.499
413 H LYS 49 H LYS 49 -12.189 -3.881 -13.571
414 HA LYS 49 HA LYS 49 -12.915 -5.791 -11.448
415 1HB LYS 49 2HB LYS 49 -10.791 -5.946 -13.539
416 2HB LYS 49 1HB LYS 49 -10.454 -6.630 -11.955
417 1HG LYS 49 2HG LYS 49 -12.053 -8.273 -12.172
418 2HG LYS 49 1HG LYS 49 -12.978 -7.362 -13.368
419 1HD LYS 49 2HD LYS 49 -10.698 -7.672 -14.735
420 2HD LYS 49 1HD LYS 49 -10.609 -9.108 -13.716
421 1HE LYS 49 2HE LYS 49 -12.592 -9.990 -14.584
422 2HE LYS 49 1HE LYS 49 -13.106 -8.435 -15.234
423 1HZ LYS 49 1HZ LYS 49 -11.295 -10.410 -16.363
424 2HZ LYS 49 2HZ LYS 49 -10.852 -8.793 -16.583
425 3HZ LYS 49 3HZ LYS 49 -12.353 -9.340 -17.138
426 H GLY 50 H GLY 50 -12.791 -3.110 -10.912
427 1HA GLY 50 2HA GLY 50 -10.288 -2.104 -10.143
428 2HA GLY 50 1HA GLY 50 -11.834 -1.597 -9.479
429 H VAL 51 H VAL 51 -10.581 -1.356 -7.487
430 HA VAL 51 HA VAL 51 -9.588 -3.718 -6.180
431 HB VAL 51 HB VAL 51 -8.565 -1.522 -5.761
432 1HG1 VAL 51 1HG1 VAL 51 -11.044 -0.503 -5.729
433 2HG1 VAL 51 2HG1 VAL 51 -9.659 0.301 -4.991
434 3HG1 VAL 51 3HG1 VAL 51 -10.763 -0.647 -3.995
435 1HG2 VAL 51 1HG2 VAL 51 -8.349 -3.276 -4.082
436 2HG2 VAL 51 2HG2 VAL 51 -9.844 -2.739 -3.314
437 3HG2 VAL 51 3HG2 VAL 51 -8.429 -1.686 -3.322
438 H GLU 52 H GLU 52 -10.836 -5.175 -5.220
439 HA GLU 52 HA GLU 52 -13.460 -4.332 -4.191
440 1HB GLU 52 2HB GLU 52 -12.446 -6.879 -5.377
441 2HB GLU 52 1HB GLU 52 -13.758 -6.957 -4.210
442 1HG GLU 52 2HG GLU 52 -15.259 -6.151 -5.656
443 2HG GLU 52 1HG GLU 52 -14.140 -4.952 -6.304
444 H LYS 53 H LYS 53 -14.235 -5.718 -2.302
445 HA LYS 53 HA LYS 53 -12.227 -5.545 -0.223
446 1HB LYS 53 2HB LYS 53 -15.172 -6.213 -0.152
447 2HB LYS 53 1HB LYS 53 -14.149 -6.148 1.277
448 1HG LYS 53 2HG LYS 53 -13.630 -3.733 0.174
449 2HG LYS 53 1HG LYS 53 -15.305 -3.978 -0.326
450 1HD LYS 53 2HD LYS 53 -15.003 -4.748 2.418
451 2HD LYS 53 1HD LYS 53 -14.345 -3.127 2.187
452 1HE LYS 53 2HE LYS 53 -16.905 -3.592 0.841
453 2HE LYS 53 1HE LYS 53 -16.980 -3.713 2.598
454 1HZ LYS 53 1HZ LYS 53 -15.528 -1.435 1.515
455 2HZ LYS 53 2HZ LYS 53 -16.555 -1.528 2.855
456 3HZ LYS 53 3HZ LYS 53 -17.206 -1.422 1.298
457 H TYR 54 H TYR 54 -10.808 -7.233 -0.551
458 HA TYR 54 HA TYR 54 -11.741 -9.932 -0.914
459 1HB TYR 54 2HB TYR 54 -9.100 -8.573 -0.776
460 2HB TYR 54 1HB TYR 54 -9.143 -10.285 -0.375
461 HD1 TYR 54 1HD TYR 54 -9.618 -7.807 -3.035
462 HD2 TYR 54 2HD TYR 54 -9.622 -11.949 -2.066
463 HE1 TYR 54 1HE TYR 54 -9.579 -8.362 -5.431
464 HE2 TYR 54 2HE TYR 54 -9.582 -12.515 -4.458
465 HH TYR 54 HH TYR 54 -8.648 -10.830 -6.734
466 H GLY 55 H GLY 55 -10.578 -7.953 1.740
467 1HA GLY 55 2HA GLY 55 -10.033 -9.934 3.631
468 2HA GLY 55 1HA GLY 55 -10.572 -8.303 4.007
469 HA PRO 56 HA PRO 56 -13.753 -12.124 4.498
470 1HB PRO 56 2HB PRO 56 -13.114 -11.351 7.320
471 2HB PRO 56 1HB PRO 56 -13.616 -12.917 6.672
472 1HG PRO 56 2HG PRO 56 -11.033 -12.330 7.251
473 2HG PRO 56 1HG PRO 56 -11.504 -13.457 5.970
474 1HD PRO 56 2HD PRO 56 -10.282 -10.821 5.733
475 2HD PRO 56 1HD PRO 56 -10.496 -12.066 4.498
476 H GLU 57 H GLU 57 -13.468 -9.308 6.857
477 HA GLU 57 HA GLU 57 -16.248 -8.753 6.035
478 1HB GLU 57 2HB GLU 57 -14.975 -8.701 8.559
479 2HB GLU 57 1HB GLU 57 -15.382 -7.037 8.165
480 1HG GLU 57 2HG GLU 57 -17.536 -7.373 8.559
481 2HG GLU 57 1HG GLU 57 -17.566 -8.833 7.570
482 H ALA 58 H ALA 58 -13.730 -6.495 7.244
483 HA ALA 58 HA ALA 58 -14.291 -4.830 4.883
484 1HB ALA 58 1HB ALA 58 -12.857 -3.224 6.574
485 2HB ALA 58 2HB ALA 58 -13.807 -4.214 7.681
486 3HB ALA 58 3HB ALA 58 -14.613 -3.271 6.429
487 H SER 59 H SER 59 -11.558 -4.974 7.049
488 HA SER 59 HA SER 59 -9.638 -4.862 4.854
489 1HB SER 59 2HB SER 59 -8.049 -4.084 6.553
490 2HB SER 59 1HB SER 59 -9.510 -3.095 6.530
491 HG SER 59 HG SER 59 -8.459 -4.475 8.561
492 H ALA 60 H ALA 60 -10.806 -7.087 7.122
493 HA ALA 60 HA ALA 60 -8.851 -8.524 8.148
494 1HB ALA 60 1HB ALA 60 -11.027 -9.255 8.513
495 2HB ALA 60 2HB ALA 60 -10.231 -10.598 7.693
496 3HB ALA 60 3HB ALA 60 -11.319 -9.537 6.797
497 H PHE 61 H PHE 61 -9.033 -8.155 4.729
498 HA PHE 61 HA PHE 61 -7.944 -10.510 3.778
499 1HB PHE 61 2HB PHE 61 -8.685 -8.460 2.444
500 2HB PHE 61 1HB PHE 61 -7.092 -7.798 2.773
501 HD1 PHE 61 1HD PHE 61 -6.090 -7.751 0.675
502 HD2 PHE 61 2HD PHE 61 -8.002 -11.315 2.001
503 HE1 PHE 61 1HE PHE 61 -5.180 -8.959 -1.266
504 HE2 PHE 61 2HE PHE 61 -7.094 -12.528 0.063
505 HZ PHE 61 HZ PHE 61 -5.682 -11.350 -1.573
506 H THR 62 H THR 62 -6.283 -7.722 5.195
507 HA THR 62 HA THR 62 -3.684 -8.913 4.837
508 HB THR 62 HB THR 62 -2.818 -6.920 5.887
509 HG1 THR 62 1HG THR 62 -4.319 -6.674 7.549
510 1HG2 THR 62 1HG2 THR 62 -4.746 -5.323 4.598
511 2HG2 THR 62 2HG2 THR 62 -4.560 -6.798 3.649
512 3HG2 THR 62 3HG2 THR 62 -3.152 -5.802 4.017
513 H LYS 63 H LYS 63 -5.856 -8.290 7.571
514 HA LYS 63 HA LYS 63 -4.172 -9.087 9.631
515 1HB LYS 63 2HB LYS 63 -6.030 -9.079 11.005
516 2HB LYS 63 1HB LYS 63 -6.557 -8.044 9.688
517 1HG LYS 63 2HG LYS 63 -8.398 -9.351 9.879
518 2HG LYS 63 1HG LYS 63 -7.479 -10.344 8.747
519 1HD LYS 63 2HD LYS 63 -7.869 -11.986 10.236
520 2HD LYS 63 1HD LYS 63 -6.531 -11.252 11.120
521 1HE LYS 63 2HE LYS 63 -8.260 -9.811 12.275
522 2HE LYS 63 1HE LYS 63 -9.483 -10.858 11.558
523 1HZ LYS 63 1HZ LYS 63 -8.443 -11.311 13.935
524 2HZ LYS 63 2HZ LYS 63 -7.311 -12.160 13.006
525 3HZ LYS 63 3HZ LYS 63 -8.951 -12.567 12.919
526 H LYS 64 H LYS 64 -5.646 -11.005 7.194
527 HA LYS 64 HA LYS 64 -5.460 -13.472 8.703
528 1HB LYS 64 2HB LYS 64 -6.207 -12.927 5.827
529 2HB LYS 64 1HB LYS 64 -6.227 -14.520 6.572
530 1HG LYS 64 2HG LYS 64 -7.762 -12.357 7.898
531 2HG LYS 64 1HG LYS 64 -8.395 -13.022 6.391
532 1HD LYS 64 2HD LYS 64 -8.142 -15.306 7.413
533 2HD LYS 64 1HD LYS 64 -7.779 -14.503 8.942
534 1HE LYS 64 2HE LYS 64 -9.973 -13.304 8.717
535 2HE LYS 64 1HE LYS 64 -10.327 -14.348 7.341
536 1HZ LYS 64 1HZ LYS 64 -9.700 -16.179 9.126
537 2HZ LYS 64 2HZ LYS 64 -11.271 -15.574 8.971
538 3HZ LYS 64 3HZ LYS 64 -10.254 -14.982 10.187
539 H MET 65 H MET 65 -4.127 -12.428 5.557
540 HA MET 65 HA MET 65 -1.958 -14.340 5.856
541 1HB MET 65 2HB MET 65 -3.380 -13.444 3.680
542 2HB MET 65 1HB MET 65 -1.872 -12.553 3.533
543 1HG MET 65 2HG MET 65 -0.624 -14.653 3.624
544 2HG MET 65 1HG MET 65 -2.139 -15.543 3.760
545 1HE MET 65 1HE MET 65 -0.511 -13.377 0.065
546 2HE MET 65 2HE MET 65 0.510 -14.287 1.178
547 3HE MET 65 3HE MET 65 -0.334 -12.843 1.737
548 H TRP 66 H TRP 66 -2.235 -10.851 5.169
549 HA TRP 66 HA TRP 66 0.425 -10.162 5.307
550 1HB TRP 66 2HB TRP 66 -1.769 -8.760 4.847
551 2HB TRP 66 1HB TRP 66 -1.570 -8.318 6.540
552 HD1 TRP 66 HD TRP 66 1.215 -8.692 3.869
553 HE1 TRP 66 1HE TRP 66 2.468 -6.449 3.716
554 HE3 TRP 66 3HE TRP 66 -1.627 -5.943 7.114
555 HZ2 TRP 66 2HZ TRP 66 2.278 -3.860 4.819
556 HZ3 TRP 66 3HZ TRP 66 -1.023 -3.591 7.509
557 HH2 TRP 66 HH TRP 66 0.891 -2.573 6.385
558 H GLU 67 H GLU 67 -1.714 -10.998 7.916
559 HA GLU 67 HA GLU 67 0.162 -10.011 9.920
560 1HB GLU 67 2HB GLU 67 -2.610 -10.248 9.851
561 2HB GLU 67 1HB GLU 67 -2.097 -11.514 10.957
562 1HG GLU 67 2HG GLU 67 -1.747 -10.039 12.564
563 2HG GLU 67 1HG GLU 67 -0.667 -9.104 11.531
564 H ASN 68 H ASN 68 -1.107 -13.048 8.663
565 HA ASN 68 HA ASN 68 0.270 -14.645 10.624
566 1HB ASN 68 2HB ASN 68 -1.900 -15.266 9.435
567 2HB ASN 68 1HB ASN 68 -0.903 -15.634 8.029
568 1HD2 ASN 68 1HD2 ASN 68 -1.146 -16.337 11.492
569 2HD2 ASN 68 2HD2 ASN 68 -0.657 -17.989 11.367
570 H ALA 69 H ALA 69 0.937 -13.437 7.432
571 HA ALA 69 HA ALA 69 3.397 -15.046 7.323
572 1HB ALA 69 1HB ALA 69 2.239 -15.471 5.354
573 2HB ALA 69 2HB ALA 69 3.387 -14.219 4.880
574 3HB ALA 69 3HB ALA 69 1.703 -13.800 5.192
575 H LYS 70 H LYS 70 5.379 -14.041 6.791
576 HA LYS 70 HA LYS 70 5.556 -11.297 7.745
577 1HB LYS 70 2HB LYS 70 7.164 -13.538 8.051
578 2HB LYS 70 1HB LYS 70 8.063 -12.536 6.923
579 1HG LYS 70 2HG LYS 70 8.781 -11.289 8.600
580 2HG LYS 70 1HG LYS 70 7.118 -10.855 8.997
581 1HD LYS 70 2HD LYS 70 7.916 -11.796 10.972
582 2HD LYS 70 1HD LYS 70 7.042 -13.126 10.210
583 1HE LYS 70 2HE LYS 70 9.298 -13.787 9.202
584 2HE LYS 70 1HE LYS 70 10.008 -12.683 10.379
585 1HZ LYS 70 1HZ LYS 70 10.041 -14.780 11.384
586 2HZ LYS 70 2HZ LYS 70 8.466 -15.155 10.892
587 3HZ LYS 70 3HZ LYS 70 8.721 -13.996 12.096
588 H LYS 71 H LYS 71 4.805 -10.046 6.052
589 HA LYS 71 HA LYS 71 6.690 -9.548 3.944
590 1HB LYS 71 2HB LYS 71 5.100 -9.904 2.098
591 2HB LYS 71 1HB LYS 71 5.473 -11.398 2.941
592 1HG LYS 71 2HG LYS 71 3.160 -10.116 4.092
593 2HG LYS 71 1HG LYS 71 2.950 -10.378 2.360
594 1HD LYS 71 2HD LYS 71 4.099 -12.633 3.873
595 2HD LYS 71 1HD LYS 71 2.420 -12.237 4.240
596 1HE LYS 71 2HE LYS 71 1.789 -13.317 2.407
597 2HE LYS 71 1HE LYS 71 2.689 -12.157 1.432
598 1HZ LYS 71 1HZ LYS 71 4.249 -14.275 2.671
599 2HZ LYS 71 2HZ LYS 71 4.382 -13.591 1.131
600 3HZ LYS 71 3HZ LYS 71 3.197 -14.758 1.438
601 H ILE 72 H ILE 72 6.819 -7.430 4.543
602 HA ILE 72 HA ILE 72 4.392 -5.830 4.124
603 HB ILE 72 HB ILE 72 6.310 -5.142 6.333
604 1HG1 ILE 72 2HG1 ILE 72 4.371 -6.066 7.811
605 2HG1 ILE 72 1HG1 ILE 72 3.961 -7.015 6.386
606 1HG2 ILE 72 1HG2 ILE 72 4.982 -3.390 6.674
607 2HG2 ILE 72 2HG2 ILE 72 3.527 -4.382 6.617
608 3HG2 ILE 72 3HG2 ILE 72 4.236 -3.768 5.122
609 1HD1 ILE 72 1HD1 ILE 72 6.782 -7.106 7.202
610 2HD1 ILE 72 2HD1 ILE 72 5.714 -8.391 6.644
611 3HD1 ILE 72 3HD1 ILE 72 5.630 -7.842 8.316
612 H GLU 73 H GLU 73 4.686 -4.107 2.876
613 HA GLU 73 HA GLU 73 7.267 -2.795 2.700
614 1HB GLU 73 2HB GLU 73 7.119 -4.765 1.005
615 2HB GLU 73 1HB GLU 73 6.030 -3.707 0.119
616 1HG GLU 73 2HG GLU 73 7.693 -2.165 -0.345
617 2HG GLU 73 1HG GLU 73 8.723 -2.731 0.971
618 H VAL 74 H VAL 74 7.162 -0.754 1.545
619 HA VAL 74 HA VAL 74 4.441 0.235 1.054
620 HB VAL 74 HB VAL 74 5.318 2.454 2.119
621 1HG1 VAL 74 1HG1 VAL 74 4.561 1.506 4.419
622 2HG1 VAL 74 2HG1 VAL 74 4.216 0.044 3.494
623 3HG1 VAL 74 3HG1 VAL 74 3.421 1.562 3.075
624 1HG2 VAL 74 1HG2 VAL 74 6.740 1.960 4.132
625 2HG2 VAL 74 2HG2 VAL 74 7.572 1.850 2.581
626 3HG2 VAL 74 3HG2 VAL 74 7.074 0.380 3.420
627 H GLU 75 H GLU 75 4.308 2.063 -0.322
628 HA GLU 75 HA GLU 75 6.635 3.183 -1.549
629 1HB GLU 75 2HB GLU 75 5.479 0.811 -2.703
630 2HB GLU 75 1HB GLU 75 5.290 2.162 -3.809
631 1HG GLU 75 2HG GLU 75 7.794 2.585 -3.364
632 2HG GLU 75 1HG GLU 75 7.798 0.933 -2.746
633 H PHE 76 H PHE 76 5.414 4.996 -0.675
634 HA PHE 76 HA PHE 76 3.486 5.996 -2.634
635 1HB PHE 76 2HB PHE 76 1.973 6.787 -0.883
636 2HB PHE 76 1HB PHE 76 2.141 5.033 -0.816
637 HD1 PHE 76 1HD PHE 76 2.390 8.092 0.985
638 HD2 PHE 76 2HD PHE 76 3.778 4.072 0.892
639 HE1 PHE 76 1HE PHE 76 3.034 8.267 3.353
640 HE2 PHE 76 2HE PHE 76 4.424 4.236 3.262
641 HZ PHE 76 HZ PHE 76 4.051 6.339 4.494
642 H ASP 77 H ASP 77 3.156 8.306 -2.522
643 HA ASP 77 HA ASP 77 5.529 9.767 -2.279
644 1HB ASP 77 2HB ASP 77 2.705 10.352 -2.852
645 2HB ASP 77 1HB ASP 77 3.580 11.690 -2.112
646 H LYS 78 H LYS 78 5.872 11.659 -0.849
647 HA LYS 78 HA LYS 78 6.050 10.970 1.808
648 1HB LYS 78 2HB LYS 78 5.910 13.703 0.534
649 2HB LYS 78 1HB LYS 78 6.290 13.454 2.232
650 1HG LYS 78 2HG LYS 78 8.142 11.880 1.320
651 2HG LYS 78 1HG LYS 78 7.899 12.769 -0.185
652 1HD LYS 78 2HD LYS 78 8.191 14.884 1.193
653 2HD LYS 78 1HD LYS 78 8.771 13.836 2.489
654 1HE LYS 78 2HE LYS 78 10.581 13.054 1.131
655 2HE LYS 78 1HE LYS 78 9.940 13.881 -0.287
656 1HZ LYS 78 1HZ LYS 78 11.320 15.001 2.051
657 2HZ LYS 78 2HZ LYS 78 10.209 15.966 1.217
658 3HZ LYS 78 3HZ LYS 78 11.552 15.331 0.408
659 H GLY 79 H GLY 79 3.317 12.285 0.106
660 1HA GLY 79 2HA GLY 79 1.119 12.466 0.770
661 2HA GLY 79 1HA GLY 79 1.568 11.696 2.283
662 H GLN 80 H GLN 80 2.808 14.716 0.907
663 HA GLN 80 HA GLN 80 2.136 16.067 3.398
664 1HB GLN 80 2HB GLN 80 3.880 16.752 1.050
665 2HB GLN 80 1HB GLN 80 3.413 17.984 2.211
666 1HG GLN 80 2HG GLN 80 4.447 16.733 4.005
667 2HG GLN 80 1HG GLN 80 4.850 15.429 2.889
668 1HE2 GLN 80 1HE2 GLN 80 6.273 16.008 1.072
669 2HE2 GLN 80 2HE2 GLN 80 7.519 17.173 1.346
670 H ARG 81 H ARG 81 -0.160 15.475 2.185
671 HA ARG 81 HA ARG 81 -1.032 18.030 1.005
672 1HB ARG 81 2HB ARG 81 -1.056 15.658 -0.312
673 2HB ARG 81 1HB ARG 81 -2.652 15.628 0.428
674 1HG ARG 81 2HG ARG 81 -3.192 17.760 -0.610
675 2HG ARG 81 1HG ARG 81 -1.578 17.836 -1.319
676 1HD ARG 81 2HD ARG 81 -2.665 15.328 -2.020
677 2HD ARG 81 1HD ARG 81 -3.926 16.528 -2.303
678 HE ARG 81 HE ARG 81 -1.373 17.303 -3.354
679 1HH1 ARG 81 1HH1 ARG 81 -4.274 15.466 -3.991
680 2HH1 ARG 81 2HH1 ARG 81 -4.101 15.557 -5.712
681 1HH2 ARG 81 1HH2 ARG 81 -1.148 17.422 -5.618
682 2HH2 ARG 81 2HH2 ARG 81 -2.327 16.664 -6.635
683 H THR 82 H THR 82 -1.901 15.290 3.064
684 HA THR 82 HA THR 82 -4.453 16.145 3.824
685 HB THR 82 HB THR 82 -3.472 14.869 6.071
686 HG1 THR 82 1HG THR 82 -1.517 14.356 5.270
687 1HG2 THR 82 1HG2 THR 82 -5.394 14.355 4.252
688 2HG2 THR 82 2HG2 THR 82 -4.904 13.241 5.529
689 3HG2 THR 82 3HG2 THR 82 -4.248 13.059 3.901
690 H ASP 83 H ASP 83 -5.109 17.837 4.931
691 HA ASP 83 HA ASP 83 -3.207 19.167 6.744
692 1HB ASP 83 2HB ASP 83 -3.800 20.530 4.774
693 2HB ASP 83 1HB ASP 83 -5.503 20.402 5.206
694 H LYS 84 H LYS 84 -6.651 18.489 6.211
695 HA LYS 84 HA LYS 84 -7.581 19.353 8.707
696 1HB LYS 84 2HB LYS 84 -8.795 18.491 6.478
697 2HB LYS 84 1HB LYS 84 -8.920 17.024 7.441
698 1HG LYS 84 2HG LYS 84 -9.990 18.358 9.237
699 2HG LYS 84 1HG LYS 84 -9.970 19.752 8.156
700 1HD LYS 84 2HD LYS 84 -11.250 17.145 7.382
701 2HD LYS 84 1HD LYS 84 -12.127 18.396 8.266
702 1HE LYS 84 2HE LYS 84 -12.665 18.950 6.106
703 2HE LYS 84 1HE LYS 84 -11.227 19.940 6.348
704 1HZ LYS 84 1HZ LYS 84 -11.554 18.324 4.272
705 2HZ LYS 84 2HZ LYS 84 -10.775 17.257 5.328
706 3HZ LYS 84 3HZ LYS 84 -10.033 18.717 4.903
707 H TYR 85 H TYR 85 -7.043 15.981 7.652
708 HA TYR 85 HA TYR 85 -7.119 15.050 10.379
709 1HB TYR 85 2HB TYR 85 -6.985 13.814 7.689
710 2HB TYR 85 1HB TYR 85 -6.273 12.889 9.007
711 HD1 TYR 85 1HD TYR 85 -9.393 14.803 8.244
712 HD2 TYR 85 2HD TYR 85 -7.641 11.432 10.155
713 HE1 TYR 85 1HE TYR 85 -11.632 14.011 8.884
714 HE2 TYR 85 2HE TYR 85 -9.874 10.628 10.801
715 HH TYR 85 HH TYR 85 -12.247 10.914 9.961
716 H GLY 86 H GLY 86 -4.666 15.662 7.931
717 1HA GLY 86 2HA GLY 86 -2.410 16.085 8.277
718 2HA GLY 86 1HA GLY 86 -2.624 15.687 9.976
719 H ARG 87 H ARG 87 -3.738 13.509 7.517
720 HA ARG 87 HA ARG 87 -1.377 11.806 7.924
721 1HB ARG 87 2HB ARG 87 -4.210 10.759 7.895
722 2HB ARG 87 1HB ARG 87 -2.742 9.838 8.194
723 1HG ARG 87 2HG ARG 87 -2.682 10.410 10.355
724 2HG ARG 87 1HG ARG 87 -3.120 12.088 10.024
725 1HD ARG 87 2HD ARG 87 -4.942 11.309 11.229
726 2HD ARG 87 1HD ARG 87 -5.476 11.138 9.559
727 HE ARG 87 HE ARG 87 -5.508 8.864 9.833
728 1HH1 ARG 87 1HH1 ARG 87 -3.731 10.299 12.470
729 2HH1 ARG 87 2HH1 ARG 87 -3.625 8.822 13.368
730 1HH2 ARG 87 1HH2 ARG 87 -5.372 6.924 11.011
731 2HH2 ARG 87 2HH2 ARG 87 -4.556 6.904 12.538
732 H GLY 88 H GLY 88 -0.469 11.774 5.988
733 1HA GLY 88 2HA GLY 88 -1.659 12.227 3.528
734 2HA GLY 88 1HA GLY 88 -0.157 11.348 3.756
735 H LEU 89 H LEU 89 -0.614 9.939 2.058
736 HA LEU 89 HA LEU 89 -2.690 7.936 2.671
737 1HB LEU 89 2HB LEU 89 -2.607 7.706 0.030
738 2HB LEU 89 1HB LEU 89 -3.678 8.839 0.831
739 HG LEU 89 HG LEU 89 -1.835 10.579 0.487
740 1HD1 LEU 89 1HD1 LEU 89 0.098 9.563 -0.123
741 2HD1 LEU 89 2HD1 LEU 89 -0.571 9.830 -1.734
742 3HD1 LEU 89 3HD1 LEU 89 -0.726 8.250 -0.964
743 1HD2 LEU 89 1HD2 LEU 89 -2.977 9.530 -2.081
744 2HD2 LEU 89 2HD2 LEU 89 -2.710 11.203 -1.586
745 3HD2 LEU 89 3HD2 LEU 89 -3.999 10.258 -0.842
746 H ALA 90 H ALA 90 -2.018 5.821 2.645
747 HA ALA 90 HA ALA 90 0.544 5.291 1.362
748 1HB ALA 90 1HB ALA 90 0.255 3.522 3.590
749 2HB ALA 90 2HB ALA 90 0.189 5.199 4.117
750 3HB ALA 90 3HB ALA 90 1.572 4.625 3.196
751 H TYR 91 H TYR 91 0.948 3.112 0.675
752 HA TYR 91 HA TYR 91 -1.545 1.607 0.223
753 1HB TYR 91 2HB TYR 91 0.785 1.317 -1.624
754 2HB TYR 91 1HB TYR 91 -0.935 1.152 -1.959
755 HD1 TYR 91 1HD TYR 91 1.453 2.841 -3.295
756 HD2 TYR 91 2HD TYR 91 -1.888 3.762 -0.829
757 HE1 TYR 91 1HE TYR 91 1.419 5.128 -4.203
758 HE2 TYR 91 2HE TYR 91 -1.931 6.048 -1.725
759 HH TYR 91 HH TYR 91 -1.169 7.216 -3.826
760 H ILE 92 H ILE 92 -1.611 -0.402 0.985
761 HA ILE 92 HA ILE 92 0.689 -1.500 2.326
762 HB ILE 92 HB ILE 92 -0.863 -3.433 2.803
763 1HG1 ILE 92 2HG1 ILE 92 -3.071 -1.649 1.818
764 2HG1 ILE 92 1HG1 ILE 92 -2.297 -2.789 0.723
765 1HG2 ILE 92 1HG2 ILE 92 -2.489 -1.731 4.109
766 2HG2 ILE 92 2HG2 ILE 92 -1.169 -0.639 3.686
767 3HG2 ILE 92 3HG2 ILE 92 -0.842 -2.100 4.620
768 1HD1 ILE 92 1HD1 ILE 92 -3.811 -3.413 3.240
769 2HD1 ILE 92 2HD1 ILE 92 -2.868 -4.601 2.339
770 3HD1 ILE 92 3HD1 ILE 92 -4.254 -3.816 1.581
771 H TYR 93 H TYR 93 2.057 -3.009 1.602
772 HA TYR 93 HA TYR 93 1.420 -4.329 -0.955
773 1HB TYR 93 2HB TYR 93 3.817 -2.902 -0.036
774 2HB TYR 93 1HB TYR 93 4.153 -4.466 -0.770
775 HD1 TYR 93 1HD TYR 93 5.095 -3.919 -2.834
776 HD2 TYR 93 2HD TYR 93 1.481 -2.020 -1.634
777 HE1 TYR 93 1HE TYR 93 4.886 -2.915 -5.069
778 HE2 TYR 93 2HE TYR 93 1.263 -1.014 -3.866
779 HH TYR 93 HH TYR 93 3.800 -1.022 -6.143
780 H ALA 94 H ALA 94 1.079 -6.428 -0.751
781 HA ALA 94 HA ALA 94 2.169 -7.854 1.559
782 1HB ALA 94 1HB ALA 94 -0.100 -8.344 -0.315
783 2HB ALA 94 2HB ALA 94 -0.073 -8.351 1.448
784 3HB ALA 94 3HB ALA 94 0.617 -9.702 0.550
785 H ASP 95 H ASP 95 4.187 -8.549 1.184
786 HA ASP 95 HA ASP 95 5.908 -9.753 0.308
787 1HB ASP 95 2HB ASP 95 3.748 -11.346 -0.066
788 2HB ASP 95 1HB ASP 95 4.271 -11.136 -1.734
789 H GLY 96 H GLY 96 5.287 -7.195 -0.776
790 1HA GLY 96 2HA GLY 96 5.829 -5.831 -2.543
791 2HA GLY 96 1HA GLY 96 7.021 -7.059 -2.936
792 H LYS 97 H LYS 97 3.968 -5.675 -3.735
793 HA LYS 97 HA LYS 97 3.365 -7.734 -5.705
794 1HB LYS 97 2HB LYS 97 1.902 -5.224 -4.878
795 2HB LYS 97 1HB LYS 97 1.343 -6.305 -6.148
796 1HG LYS 97 2HG LYS 97 1.939 -7.543 -3.536
797 2HG LYS 97 1HG LYS 97 0.533 -6.478 -3.609
798 1HD LYS 97 2HD LYS 97 -0.328 -7.778 -5.513
799 2HD LYS 97 1HD LYS 97 1.063 -8.859 -5.389
800 1HE LYS 97 2HE LYS 97 -0.242 -10.092 -4.054
801 2HE LYS 97 1HE LYS 97 0.094 -8.868 -2.832
802 1HZ LYS 97 1HZ LYS 97 -2.354 -9.553 -3.508
803 2HZ LYS 97 2HZ LYS 97 -2.113 -8.345 -4.668
804 3HZ LYS 97 3HZ LYS 97 -1.964 -7.978 -3.024
805 H MET 98 H MET 98 4.693 -7.608 -7.430
806 HA MET 98 HA MET 98 5.226 -4.986 -8.623
807 1HB MET 98 2HB MET 98 6.932 -6.170 -9.958
808 2HB MET 98 1HB MET 98 7.184 -6.361 -8.229
809 1HG MET 98 2HG MET 98 7.159 -8.558 -8.433
810 2HG MET 98 1HG MET 98 5.548 -8.499 -9.148
811 1HE MET 98 1HE MET 98 7.602 -10.926 -11.401
812 2HE MET 98 2HE MET 98 5.894 -10.578 -11.136
813 3HE MET 98 3HE MET 98 6.979 -10.767 -9.760
814 H VAL 99 H VAL 99 3.933 -4.327 -10.196
815 HA VAL 99 HA VAL 99 2.672 -4.296 -12.093
816 HB VAL 99 HB VAL 99 3.547 -7.144 -12.573
817 1HG1 VAL 99 1HG1 VAL 99 2.678 -6.968 -14.645
818 2HG1 VAL 99 2HG1 VAL 99 3.099 -5.262 -14.793
819 3HG1 VAL 99 3HG1 VAL 99 1.662 -5.741 -13.889
820 1HG2 VAL 99 1HG2 VAL 99 5.604 -6.151 -12.460
821 2HG2 VAL 99 2HG2 VAL 99 4.988 -4.565 -12.923
822 3HG2 VAL 99 3HG2 VAL 99 5.201 -5.819 -14.144
823 H ASN 100 H ASN 100 2.408 -7.699 -11.045
824 HA ASN 100 HA ASN 100 -0.451 -7.233 -10.531
825 1HB ASN 100 2HB ASN 100 -0.931 -9.476 -11.498
826 2HB ASN 100 1HB ASN 100 -0.319 -8.328 -12.687
827 1HD2 ASN 100 1HD2 ASN 100 1.832 -8.540 -13.417
828 2HD2 ASN 100 2HD2 ASN 100 2.663 -10.051 -13.310
829 H GLU 101 H GLU 101 -1.300 -9.505 -9.533
830 HA GLU 101 HA GLU 101 0.503 -10.047 -7.268
831 1HB GLU 101 2HB GLU 101 -1.502 -10.532 -5.950
832 2HB GLU 101 1HB GLU 101 -1.562 -8.906 -6.616
833 1HG GLU 101 2HG GLU 101 -2.799 -10.750 -8.427
834 2HG GLU 101 1HG GLU 101 -3.495 -10.922 -6.816
835 H ALA 102 H ALA 102 0.540 -11.432 -9.824
836 HA ALA 102 HA ALA 102 -0.391 -14.104 -9.013
837 1HB ALA 102 1HB ALA 102 0.454 -13.690 -11.805
838 2HB ALA 102 2HB ALA 102 -0.997 -12.823 -11.303
839 3HB ALA 102 3HB ALA 102 -0.924 -14.578 -11.152
840 H LEU 103 H LEU 103 1.118 -15.668 -10.676
841 HA LEU 103 HA LEU 103 3.119 -16.734 -10.844
842 1HB LEU 103 2HB LEU 103 3.752 -14.522 -11.866
843 2HB LEU 103 1HB LEU 103 4.371 -14.047 -10.297
844 HG LEU 103 HG LEU 103 5.809 -16.224 -10.512
845 1HD1 LEU 103 1HD1 LEU 103 4.483 -16.742 -12.690
846 2HD1 LEU 103 2HD1 LEU 103 6.216 -17.057 -12.619
847 3HD1 LEU 103 3HD1 LEU 103 5.616 -15.607 -13.425
848 1HD2 LEU 103 1HD2 LEU 103 7.589 -14.914 -11.162
849 2HD2 LEU 103 2HD2 LEU 103 6.434 -13.697 -10.619
850 3HD2 LEU 103 3HD2 LEU 103 6.637 -14.016 -12.342
851 H VAL 104 H VAL 104 4.579 -17.808 -9.536
852 HA VAL 104 HA VAL 104 5.492 -18.597 -7.607
853 HB VAL 104 HB VAL 104 5.191 -15.797 -6.517
854 1HG1 VAL 104 1HG1 VAL 104 7.198 -17.947 -5.855
855 2HG1 VAL 104 2HG1 VAL 104 5.752 -17.601 -4.905
856 3HG1 VAL 104 3HG1 VAL 104 7.015 -16.381 -5.065
857 1HG2 VAL 104 1HG2 VAL 104 7.760 -15.910 -7.309
858 2HG2 VAL 104 2HG2 VAL 104 6.463 -15.246 -8.304
859 3HG2 VAL 104 3HG2 VAL 104 7.011 -16.902 -8.561
860 H ARG 105 H ARG 105 3.548 -19.840 -7.308
861 HA ARG 105 HA ARG 105 2.428 -19.539 -4.732
862 1HB ARG 105 2HB ARG 105 1.155 -17.765 -5.963
863 2HB ARG 105 1HB ARG 105 0.491 -19.027 -6.993
864 1HG ARG 105 2HG ARG 105 -1.186 -18.792 -5.458
865 2HG ARG 105 1HG ARG 105 -0.241 -20.088 -4.720
866 1HD ARG 105 2HD ARG 105 0.953 -17.808 -3.743
867 2HD ARG 105 1HD ARG 105 -0.756 -17.375 -3.784
868 HE ARG 105 HE ARG 105 0.490 -19.099 -1.934
869 1HH1 ARG 105 1HH1 ARG 105 -2.432 -18.813 -3.823
870 2HH1 ARG 105 2HH1 ARG 105 -3.392 -19.724 -2.706
871 1HH2 ARG 105 1HH2 ARG 105 -0.771 -20.299 -0.465
872 2HH2 ARG 105 2HH2 ARG 105 -2.448 -20.569 -0.800
873 H GLN 106 H GLN 106 1.878 -20.868 -7.975
874 HA GLN 106 HA GLN 106 1.193 -23.442 -6.719
875 1HB GLN 106 2HB GLN 106 -0.610 -22.392 -8.087
876 2HB GLN 106 1HB GLN 106 0.445 -22.498 -9.489
877 1HG GLN 106 2HG GLN 106 0.374 -25.066 -8.359
878 2HG GLN 106 1HG GLN 106 -1.287 -24.476 -8.366
879 1HE2 GLN 106 1HE2 GLN 106 1.059 -26.006 -10.140
880 2HE2 GLN 106 2HE2 GLN 106 0.383 -25.811 -11.719
881 H GLY 107 H GLY 107 3.880 -22.483 -7.208
882 1HA GLY 107 2HA GLY 107 4.902 -24.801 -8.553
883 2HA GLY 107 1HA GLY 107 5.132 -23.333 -9.493
884 H LEU 108 H LEU 108 6.233 -21.516 -8.345
885 HA LEU 108 HA LEU 108 8.704 -22.391 -7.307
886 1HB LEU 108 2HB LEU 108 8.037 -20.173 -8.507
887 2HB LEU 108 1HB LEU 108 7.681 -19.608 -6.887
888 HG LEU 108 HG LEU 108 10.074 -20.298 -6.296
889 1HD1 LEU 108 1HD1 LEU 108 11.551 -20.917 -7.882
890 2HD1 LEU 108 2HD1 LEU 108 10.802 -19.913 -9.124
891 3HD1 LEU 108 3HD1 LEU 108 10.097 -21.476 -8.710
892 1HD2 LEU 108 1HD2 LEU 108 10.699 -18.147 -6.581
893 2HD2 LEU 108 2HD2 LEU 108 9.008 -17.948 -7.039
894 3HD2 LEU 108 3HD2 LEU 108 10.244 -18.128 -8.285
895 H ALA 109 H ALA 109 5.732 -21.342 -5.792
896 HA ALA 109 HA ALA 109 6.724 -20.882 -3.198
897 1HB ALA 109 1HB ALA 109 4.481 -20.854 -2.482
898 2HB ALA 109 2HB ALA 109 3.964 -21.905 -3.800
899 3HB ALA 109 3HB ALA 109 4.452 -20.244 -4.137
900 H LYS 110 H LYS 110 8.062 -22.452 -2.417
901 HA LYS 110 HA LYS 110 6.933 -25.159 -2.151
902 1HB LYS 110 2HB LYS 110 9.371 -24.377 -3.237
903 2HB LYS 110 1HB LYS 110 9.791 -24.949 -1.627
904 1HG LYS 110 2HG LYS 110 8.003 -26.838 -2.680
905 2HG LYS 110 1HG LYS 110 9.134 -26.448 -3.977
906 1HD LYS 110 2HD LYS 110 10.810 -26.678 -1.842
907 2HD LYS 110 1HD LYS 110 9.574 -27.875 -1.448
908 1HE LYS 110 2HE LYS 110 9.897 -28.964 -3.581
909 2HE LYS 110 1HE LYS 110 11.041 -27.719 -4.078
910 1HZ LYS 110 1HZ LYS 110 12.163 -28.546 -1.814
911 2HZ LYS 110 2HZ LYS 110 12.528 -29.208 -3.326
912 3HZ LYS 110 3HZ LYS 110 11.425 -29.986 -2.308
Start of MODEL 5
1 1H ALA 1 1HT ALA 1 -1.827 16.690 -16.763
2 2H ALA 1 2HT ALA 1 -2.355 16.593 -18.392
3 3H ALA 1 3HT ALA 1 -0.814 17.254 -18.024
4 HA ALA 1 HA ALA 1 -1.692 14.471 -17.656
5 1HB ALA 1 1HB ALA 1 -1.089 15.469 -19.985
6 2HB ALA 1 2HB ALA 1 -0.419 13.913 -19.495
7 3HB ALA 1 3HB ALA 1 0.568 15.373 -19.389
8 H THR 2 H THR 2 -1.083 14.553 -15.429
9 HA THR 2 HA THR 2 1.827 14.733 -14.997
10 HB THR 2 HB THR 2 -0.049 14.864 -12.691
11 HG1 THR 2 1HG THR 2 0.348 16.994 -14.518
12 1HG2 THR 2 1HG2 THR 2 2.682 15.457 -13.170
13 2HG2 THR 2 2HG2 THR 2 1.781 15.528 -11.656
14 3HG2 THR 2 3HG2 THR 2 1.856 16.944 -12.703
15 H SER 3 H SER 3 2.844 12.910 -14.494
16 HA SER 3 HA SER 3 1.229 10.588 -13.693
17 1HB SER 3 2HB SER 3 3.699 10.926 -15.310
18 2HB SER 3 1HB SER 3 3.593 9.475 -14.314
19 HG SER 3 HG SER 3 2.664 9.518 -16.588
20 H THR 4 H THR 4 1.557 9.577 -11.792
21 HA THR 4 HA THR 4 3.052 10.886 -9.761
22 HB THR 4 HB THR 4 1.868 8.105 -9.694
23 HG1 THR 4 1HG THR 4 0.291 9.636 -10.247
24 1HG2 THR 4 1HG2 THR 4 3.434 8.909 -7.814
25 2HG2 THR 4 2HG2 THR 4 1.874 8.203 -7.390
26 3HG2 THR 4 3HG2 THR 4 2.087 9.954 -7.362
27 H LYS 5 H LYS 5 5.147 10.733 -9.352
28 HA LYS 5 HA LYS 5 6.821 8.876 -10.726
29 1HB LYS 5 2HB LYS 5 7.192 11.135 -8.851
30 2HB LYS 5 1HB LYS 5 8.461 9.918 -8.842
31 1HG LYS 5 2HG LYS 5 9.212 10.489 -10.888
32 2HG LYS 5 1HG LYS 5 7.599 10.860 -11.498
33 1HD LYS 5 2HD LYS 5 8.938 12.621 -9.471
34 2HD LYS 5 1HD LYS 5 9.270 12.797 -11.196
35 1HE LYS 5 2HE LYS 5 6.645 13.124 -9.762
36 2HE LYS 5 1HE LYS 5 7.541 14.333 -10.680
37 1HZ LYS 5 1HZ LYS 5 7.174 12.542 -12.573
38 2HZ LYS 5 2HZ LYS 5 6.033 13.745 -12.240
39 3HZ LYS 5 3HZ LYS 5 5.816 12.183 -11.629
40 H LYS 6 H LYS 6 8.028 7.167 -9.904
41 HA LYS 6 HA LYS 6 6.771 5.646 -7.852
42 1HB LYS 6 2HB LYS 6 8.781 4.122 -8.186
43 2HB LYS 6 1HB LYS 6 7.769 4.405 -9.597
44 1HG LYS 6 2HG LYS 6 9.950 6.318 -9.364
45 2HG LYS 6 1HG LYS 6 10.500 4.646 -9.489
46 1HD LYS 6 2HD LYS 6 9.320 4.334 -11.540
47 2HD LYS 6 1HD LYS 6 8.487 5.880 -11.363
48 1HE LYS 6 2HE LYS 6 10.160 6.355 -12.903
49 2HE LYS 6 1HE LYS 6 10.856 6.901 -11.377
50 1HZ LYS 6 1HZ LYS 6 12.127 5.313 -13.081
51 2HZ LYS 6 2HZ LYS 6 11.394 4.141 -12.106
52 3HZ LYS 6 3HZ LYS 6 12.415 5.297 -11.413
53 H LEU 7 H LEU 7 7.597 5.021 -5.827
54 HA LEU 7 HA LEU 7 9.678 6.814 -4.756
55 1HB LEU 7 2HB LEU 7 7.463 5.638 -3.105
56 2HB LEU 7 1HB LEU 7 8.524 6.975 -2.708
57 HG LEU 7 HG LEU 7 6.405 7.059 -4.855
58 1HD1 LEU 7 1HD1 LEU 7 6.367 8.266 -2.093
59 2HD1 LEU 7 2HD1 LEU 7 5.458 6.838 -2.590
60 3HD1 LEU 7 3HD1 LEU 7 5.109 8.404 -3.324
61 1HD2 LEU 7 1HD2 LEU 7 8.598 8.581 -4.763
62 2HD2 LEU 7 2HD2 LEU 7 7.575 9.497 -3.656
63 3HD2 LEU 7 3HD2 LEU 7 7.033 9.189 -5.304
64 H HIS 8 H HIS 8 11.472 5.724 -4.345
65 HA HIS 8 HA HIS 8 11.544 2.894 -4.007
66 1HB HIS 8 2HB HIS 8 13.583 5.093 -3.831
67 2HB HIS 8 1HB HIS 8 13.991 3.463 -3.304
68 HD1 HIS 8 1HD HIS 8 12.954 1.678 -5.405
69 HD2 HIS 8 2HD HIS 8 14.564 5.398 -6.320
70 HE1 HIS 8 1HE HIS 8 13.650 1.534 -7.816
71 HE2 HIS 8 2HE HIS 8 14.562 3.816 -8.367
72 H LYS 9 H LYS 9 10.499 2.158 -2.231
73 HA LYS 9 HA LYS 9 11.355 3.236 0.374
74 1HB LYS 9 2HB LYS 9 8.703 1.992 -0.367
75 2HB LYS 9 1HB LYS 9 9.162 2.501 1.250
76 1HG LYS 9 2HG LYS 9 9.353 4.520 -0.905
77 2HG LYS 9 1HG LYS 9 7.739 4.033 -0.384
78 1HD LYS 9 2HD LYS 9 8.136 4.733 1.834
79 2HD LYS 9 1HD LYS 9 9.875 4.863 1.563
80 1HE LYS 9 2HE LYS 9 9.452 7.050 1.293
81 2HE LYS 9 1HE LYS 9 8.909 6.575 -0.315
82 1HZ LYS 9 1HZ LYS 9 6.658 6.465 0.477
83 2HZ LYS 9 2HZ LYS 9 7.299 7.983 0.863
84 3HZ LYS 9 3HZ LYS 9 7.145 6.799 2.063
85 H GLU 10 H GLU 10 11.394 1.718 2.155
86 HA GLU 10 HA GLU 10 12.248 -0.949 1.267
87 1HB GLU 10 2HB GLU 10 13.345 0.944 3.104
88 2HB GLU 10 1HB GLU 10 12.895 -0.498 4.005
89 1HG GLU 10 2HG GLU 10 14.986 -1.108 3.416
90 2HG GLU 10 1HG GLU 10 14.138 -1.680 1.981
91 HA PRO 11 HA PRO 11 8.929 -2.867 3.425
92 1HB PRO 11 2HB PRO 11 9.978 -5.151 4.357
93 2HB PRO 11 1HB PRO 11 9.812 -4.844 2.624
94 1HG PRO 11 2HG PRO 11 12.234 -4.588 4.365
95 2HG PRO 11 1HG PRO 11 12.094 -5.289 2.742
96 1HD PRO 11 2HD PRO 11 13.011 -2.756 3.227
97 2HD PRO 11 1HD PRO 11 12.214 -3.240 1.717
98 H ALA 12 H ALA 12 8.232 -1.722 5.128
99 HA ALA 12 HA ALA 12 8.989 -2.596 7.765
100 1HB ALA 12 1HB ALA 12 10.483 -0.543 6.856
101 2HB ALA 12 2HB ALA 12 10.065 -0.774 8.554
102 3HB ALA 12 3HB ALA 12 9.129 0.341 7.561
103 H THR 13 H THR 13 7.173 -2.724 8.896
104 HA THR 13 HA THR 13 5.224 -0.760 9.135
105 HB THR 13 HB THR 13 4.397 -3.055 7.363
106 HG1 THR 13 1HG THR 13 5.323 -1.674 6.004
107 1HG2 THR 13 1HG2 THR 13 2.423 -2.606 8.399
108 2HG2 THR 13 2HG2 THR 13 2.368 -1.417 7.098
109 3HG2 THR 13 3HG2 THR 13 2.844 -0.925 8.724
110 H LEU 14 H LEU 14 6.765 -2.849 10.662
111 HA LEU 14 HA LEU 14 4.515 -4.334 11.818
112 1HB LEU 14 2HB LEU 14 6.909 -5.283 11.206
113 2HB LEU 14 1HB LEU 14 7.320 -4.647 12.788
114 HG LEU 14 HG LEU 14 4.892 -6.314 12.720
115 1HD1 LEU 14 1HD1 LEU 14 6.495 -7.411 11.091
116 2HD1 LEU 14 2HD1 LEU 14 5.955 -8.395 12.451
117 3HD1 LEU 14 3HD1 LEU 14 7.562 -7.668 12.470
118 1HD2 LEU 14 1HD2 LEU 14 6.326 -5.281 14.686
119 2HD2 LEU 14 2HD2 LEU 14 7.232 -6.781 14.488
120 3HD2 LEU 14 3HD2 LEU 14 5.507 -6.834 14.853
121 H ILE 15 H ILE 15 3.557 -2.515 12.791
122 HA ILE 15 HA ILE 15 4.899 -1.657 15.266
123 HB ILE 15 HB ILE 15 2.940 0.181 13.978
124 1HG1 ILE 15 2HG1 ILE 15 4.509 -0.447 12.155
125 2HG1 ILE 15 1HG1 ILE 15 4.649 1.246 12.624
126 1HG2 ILE 15 1HG2 ILE 15 5.365 0.484 15.724
127 2HG2 ILE 15 2HG2 ILE 15 3.680 0.804 16.133
128 3HG2 ILE 15 3HG2 ILE 15 4.527 1.854 14.997
129 1HD1 ILE 15 1HD1 ILE 15 6.506 0.017 14.223
130 2HD1 ILE 15 2HD1 ILE 15 6.837 0.859 12.709
131 3HD1 ILE 15 3HD1 ILE 15 6.615 -0.891 12.715
132 H LYS 16 H LYS 16 1.718 -1.219 13.789
133 HA LYS 16 HA LYS 16 0.448 -2.826 15.856
134 1HB LYS 16 2HB LYS 16 -0.422 0.016 15.298
135 2HB LYS 16 1HB LYS 16 -1.141 -1.093 16.456
136 1HG LYS 16 2HG LYS 16 1.371 -1.078 17.375
137 2HG LYS 16 1HG LYS 16 1.314 0.531 16.652
138 1HD LYS 16 2HD LYS 16 -0.922 -0.374 18.414
139 2HD LYS 16 1HD LYS 16 0.590 0.174 19.140
140 1HE LYS 16 2HE LYS 16 0.336 2.331 18.366
141 2HE LYS 16 1HE LYS 16 -0.716 1.841 17.037
142 1HZ LYS 16 1HZ LYS 16 -1.620 3.002 19.230
143 2HZ LYS 16 2HZ LYS 16 -1.725 1.391 19.732
144 3HZ LYS 16 3HZ LYS 16 -2.541 1.896 18.341
145 H ALA 17 H ALA 17 -1.430 -3.784 15.158
146 HA ALA 17 HA ALA 17 -1.863 -3.819 12.327
147 1HB ALA 17 1HB ALA 17 -3.190 -5.245 14.617
148 2HB ALA 17 2HB ALA 17 -2.064 -5.898 13.427
149 3HB ALA 17 3HB ALA 17 -3.698 -5.448 12.940
150 H ILE 18 H ILE 18 -3.408 -2.875 11.152
151 HA ILE 18 HA ILE 18 -5.789 -1.776 12.383
152 HB ILE 18 HB ILE 18 -3.993 0.085 10.832
153 1HG1 ILE 18 2HG1 ILE 18 -4.365 -0.145 13.827
154 2HG1 ILE 18 1HG1 ILE 18 -2.885 -0.476 12.934
155 1HG2 ILE 18 1HG2 ILE 18 -6.582 0.391 12.315
156 2HG2 ILE 18 2HG2 ILE 18 -6.206 0.816 10.646
157 3HG2 ILE 18 3HG2 ILE 18 -5.543 1.773 11.969
158 1HD1 ILE 18 1HD1 ILE 18 -2.627 1.824 12.372
159 2HD1 ILE 18 2HD1 ILE 18 -2.920 1.709 14.109
160 3HD1 ILE 18 3HD1 ILE 18 -4.218 2.214 13.027
161 H ASP 19 H ASP 19 -7.342 -0.995 10.776
162 HA ASP 19 HA ASP 19 -7.472 -2.717 8.530
163 1HB ASP 19 2HB ASP 19 -9.156 -0.579 9.696
164 2HB ASP 19 1HB ASP 19 -9.377 -0.880 7.974
165 H GLY 20 H GLY 20 -8.049 -1.751 6.293
166 1HA GLY 20 2HA GLY 20 -5.727 -0.411 5.337
167 2HA GLY 20 1HA GLY 20 -7.154 -0.811 4.392
168 H ASP 21 H ASP 21 -6.156 1.436 6.966
169 HA ASP 21 HA ASP 21 -7.204 3.663 5.427
170 1HB ASP 21 2HB ASP 21 -8.347 4.498 7.605
171 2HB ASP 21 1HB ASP 21 -9.182 3.302 6.620
172 H THR 22 H THR 22 -5.869 2.699 8.574
173 HA THR 22 HA THR 22 -3.723 4.645 8.220
174 HB THR 22 HB THR 22 -5.146 5.979 9.520
175 HG1 THR 22 1HG THR 22 -4.148 6.000 11.573
176 1HG2 THR 22 1HG2 THR 22 -5.854 3.481 11.006
177 2HG2 THR 22 2HG2 THR 22 -6.916 4.622 10.181
178 3HG2 THR 22 3HG2 THR 22 -6.131 5.080 11.693
179 H VAL 23 H VAL 23 -2.037 3.319 8.206
180 HA VAL 23 HA VAL 23 -1.685 1.482 10.478
181 HB VAL 23 HB VAL 23 -0.794 0.868 7.658
182 1HG1 VAL 23 1HG1 VAL 23 -0.430 -0.404 10.292
183 2HG1 VAL 23 2HG1 VAL 23 0.593 -0.449 8.857
184 3HG1 VAL 23 3HG1 VAL 23 -0.828 -1.488 8.959
185 1HG2 VAL 23 1HG2 VAL 23 -2.624 -0.567 7.384
186 2HG2 VAL 23 2HG2 VAL 23 -3.320 0.896 8.078
187 3HG2 VAL 23 3HG2 VAL 23 -3.036 -0.515 9.097
188 H LYS 24 H LYS 24 0.186 1.787 11.538
189 HA LYS 24 HA LYS 24 2.093 3.665 10.392
190 1HB LYS 24 2HB LYS 24 3.082 3.690 12.668
191 2HB LYS 24 1HB LYS 24 1.389 4.155 12.627
192 1HG LYS 24 2HG LYS 24 1.488 1.360 13.049
193 2HG LYS 24 1HG LYS 24 2.643 2.113 14.150
194 1HD LYS 24 2HD LYS 24 0.047 3.478 13.952
195 2HD LYS 24 1HD LYS 24 -0.017 1.856 14.643
196 1HE LYS 24 2HE LYS 24 0.284 3.569 16.369
197 2HE LYS 24 1HE LYS 24 1.659 2.469 16.292
198 1HZ LYS 24 1HZ LYS 24 1.985 5.054 16.400
199 2HZ LYS 24 2HZ LYS 24 1.780 4.938 14.725
200 3HZ LYS 24 3HZ LYS 24 3.024 4.081 15.486
201 H LEU 25 H LEU 25 4.235 3.281 10.085
202 HA LEU 25 HA LEU 25 5.230 0.550 10.352
203 1HB LEU 25 2HB LEU 25 6.526 1.285 8.140
204 2HB LEU 25 1HB LEU 25 4.979 0.471 8.085
205 HG LEU 25 HG LEU 25 5.216 2.391 6.519
206 1HD1 LEU 25 1HD1 LEU 25 2.994 3.443 7.852
207 2HD1 LEU 25 2HD1 LEU 25 3.047 1.735 8.279
208 3HD1 LEU 25 3HD1 LEU 25 3.011 2.220 6.585
209 1HD2 LEU 25 1HD2 LEU 25 5.715 4.466 7.180
210 2HD2 LEU 25 2HD2 LEU 25 6.267 3.720 8.673
211 3HD2 LEU 25 3HD2 LEU 25 4.637 4.383 8.571
212 H MET 26 H MET 26 7.664 0.496 10.163
213 HA MET 26 HA MET 26 8.754 2.559 11.847
214 1HB MET 26 2HB MET 26 10.190 0.290 10.451
215 2HB MET 26 1HB MET 26 10.807 1.251 11.785
216 1HG MET 26 2HG MET 26 8.882 0.383 13.154
217 2HG MET 26 1HG MET 26 8.560 -0.740 11.833
218 1HE MET 26 1HE MET 26 9.712 -2.033 15.103
219 2HE MET 26 2HE MET 26 9.633 -0.278 14.942
220 3HE MET 26 3HE MET 26 11.173 -1.065 15.288
221 H TYR 27 H TYR 27 8.876 4.490 10.790
222 HA TYR 27 HA TYR 27 10.597 4.566 8.402
223 1HB TYR 27 2HB TYR 27 8.086 4.955 8.008
224 2HB TYR 27 1HB TYR 27 8.320 6.488 8.843
225 HD1 TYR 27 1HD TYR 27 8.339 4.891 5.711
226 HD2 TYR 27 2HD TYR 27 10.289 7.964 7.913
227 HE1 TYR 27 1HE TYR 27 9.083 5.916 3.605
228 HE2 TYR 27 2HE TYR 27 11.039 9.000 5.818
229 HH TYR 27 HH TYR 27 10.760 7.413 2.776
230 H LYS 28 H LYS 28 12.427 5.556 8.913
231 HA LYS 28 HA LYS 28 13.940 6.946 9.904
232 1HB LYS 28 2HB LYS 28 12.247 8.484 8.533
233 2HB LYS 28 1HB LYS 28 11.902 9.104 10.141
234 1HG LYS 28 2HG LYS 28 13.570 10.523 9.564
235 2HG LYS 28 1HG LYS 28 14.548 9.226 10.253
236 1HD LYS 28 2HD LYS 28 15.466 8.712 8.273
237 2HD LYS 28 1HD LYS 28 13.927 8.855 7.420
238 1HE LYS 28 2HE LYS 28 14.228 11.079 6.966
239 2HE LYS 28 1HE LYS 28 15.245 11.342 8.382
240 1HZ LYS 28 1HZ LYS 28 16.336 9.575 6.354
241 2HZ LYS 28 2HZ LYS 28 17.097 10.781 7.264
242 3HZ LYS 28 3HZ LYS 28 16.186 11.198 5.901
243 H GLY 29 H GLY 29 12.130 5.354 11.649
244 1HA GLY 29 2HA GLY 29 11.977 5.032 13.923
245 2HA GLY 29 1HA GLY 29 12.967 6.467 14.140
246 H GLN 30 H GLN 30 10.209 7.000 12.207
247 HA GLN 30 HA GLN 30 8.738 8.035 14.541
248 1HB GLN 30 2HB GLN 30 9.930 9.595 12.622
249 2HB GLN 30 1HB GLN 30 8.287 9.458 12.013
250 1HG GLN 30 2HG GLN 30 7.377 10.455 13.932
251 2HG GLN 30 1HG GLN 30 8.873 10.258 14.843
252 1HE2 GLN 30 1HE2 GLN 30 9.800 12.133 15.196
253 2HE2 GLN 30 2HE2 GLN 30 9.899 13.453 14.084
254 HA PRO 31 HA PRO 31 5.358 5.608 13.013
255 1HB PRO 31 2HB PRO 31 3.299 6.913 14.220
256 2HB PRO 31 1HB PRO 31 4.394 5.828 15.086
257 1HG PRO 31 2HG PRO 31 4.421 8.817 14.929
258 2HG PRO 31 1HG PRO 31 4.675 7.769 16.337
259 1HD PRO 31 2HD PRO 31 6.723 8.920 15.003
260 2HD PRO 31 1HD PRO 31 6.868 7.325 15.768
261 H MET 32 H MET 32 4.177 5.639 11.183
262 HA MET 32 HA MET 32 3.060 8.160 10.229
263 1HB MET 32 2HB MET 32 5.378 6.804 9.081
264 2HB MET 32 1HB MET 32 4.106 7.086 7.906
265 1HG MET 32 2HG MET 32 5.449 9.154 9.626
266 2HG MET 32 1HG MET 32 5.679 8.912 7.895
267 1HE MET 32 1HE MET 32 4.107 10.354 10.665
268 2HE MET 32 2HE MET 32 2.369 10.262 10.382
269 3HE MET 32 3HE MET 32 3.257 11.725 9.953
270 H THR 33 H THR 33 0.979 7.678 10.012
271 HA THR 33 HA THR 33 0.037 5.040 9.433
272 HB THR 33 HB THR 33 -2.198 6.045 9.555
273 HG1 THR 33 1HG THR 33 -2.377 8.274 9.915
274 1HG2 THR 33 1HG2 THR 33 -0.579 7.306 11.736
275 2HG2 THR 33 2HG2 THR 33 -0.858 5.566 11.658
276 3HG2 THR 33 3HG2 THR 33 -2.223 6.673 11.803
277 H PHE 34 H PHE 34 -0.555 4.176 7.574
278 HA PHE 34 HA PHE 34 -0.490 5.798 5.131
279 1HB PHE 34 2HB PHE 34 -0.158 2.807 5.493
280 2HB PHE 34 1HB PHE 34 -0.177 3.629 3.946
281 HD1 PHE 34 1HD PHE 34 1.977 2.434 3.580
282 HD2 PHE 34 2HD PHE 34 1.544 5.419 6.575
283 HE1 PHE 34 1HE PHE 34 4.421 2.696 3.680
284 HE2 PHE 34 2HE PHE 34 3.979 5.681 6.670
285 HZ PHE 34 HZ PHE 34 5.421 4.323 5.220
286 H ARG 35 H ARG 35 -2.074 5.238 3.454
287 HA ARG 35 HA ARG 35 -4.600 4.248 4.588
288 1HB ARG 35 2HB ARG 35 -4.268 6.751 3.770
289 2HB ARG 35 1HB ARG 35 -4.574 6.033 2.195
290 1HG ARG 35 2HG ARG 35 -6.734 6.293 2.627
291 2HG ARG 35 1HG ARG 35 -6.569 4.981 3.793
292 1HD ARG 35 2HD ARG 35 -5.802 6.863 5.410
293 2HD ARG 35 1HD ARG 35 -6.589 7.936 4.256
294 HE ARG 35 HE ARG 35 -8.490 6.088 4.734
295 1HH1 ARG 35 1HH1 ARG 35 -6.516 8.043 6.846
296 2HH1 ARG 35 2HH1 ARG 35 -7.703 8.105 8.102
297 1HH2 ARG 35 1HH2 ARG 35 -10.052 6.169 6.387
298 2HH2 ARG 35 2HH2 ARG 35 -9.711 7.039 7.845
299 H LEU 36 H LEU 36 -5.904 2.910 3.283
300 HA LEU 36 HA LEU 36 -4.418 1.598 1.120
301 1HB LEU 36 2HB LEU 36 -5.786 0.579 3.325
302 2HB LEU 36 1HB LEU 36 -6.811 0.209 1.952
303 HG LEU 36 HG LEU 36 -5.406 -1.673 2.284
304 1HD1 LEU 36 1HD1 LEU 36 -4.872 -1.947 0.134
305 2HD1 LEU 36 2HD1 LEU 36 -3.747 -0.590 0.144
306 3HD1 LEU 36 3HD1 LEU 36 -5.471 -0.304 -0.089
307 1HD2 LEU 36 1HD2 LEU 36 -3.680 -0.910 3.662
308 2HD2 LEU 36 2HD2 LEU 36 -3.208 0.354 2.528
309 3HD2 LEU 36 3HD2 LEU 36 -2.870 -1.337 2.155
310 H LEU 37 H LEU 37 -5.149 1.501 -0.908
311 HA LEU 37 HA LEU 37 -7.910 2.224 -1.510
312 1HB LEU 37 2HB LEU 37 -6.451 4.293 -1.578
313 2HB LEU 37 1HB LEU 37 -5.612 3.558 -2.929
314 HG LEU 37 HG LEU 37 -7.996 3.401 -3.984
315 1HD1 LEU 37 1HD1 LEU 37 -9.631 4.828 -3.219
316 2HD1 LEU 37 2HD1 LEU 37 -8.487 5.838 -2.337
317 3HD1 LEU 37 3HD1 LEU 37 -8.931 4.253 -1.707
318 1HD2 LEU 37 1HD2 LEU 37 -6.870 6.166 -3.789
319 2HD2 LEU 37 2HD2 LEU 37 -7.551 5.334 -5.186
320 3HD2 LEU 37 3HD2 LEU 37 -5.960 4.878 -4.576
321 H LEU 38 H LEU 38 -8.732 1.060 -3.165
322 HA LEU 38 HA LEU 38 -6.920 -0.808 -4.502
323 1HB LEU 38 2HB LEU 38 -9.015 -1.572 -3.307
324 2HB LEU 38 1HB LEU 38 -9.931 -0.793 -4.584
325 HG LEU 38 HG LEU 38 -8.127 -2.424 -5.942
326 1HD1 LEU 38 1HD1 LEU 38 -7.837 -4.385 -4.881
327 2HD1 LEU 38 2HD1 LEU 38 -9.408 -4.311 -4.085
328 3HD1 LEU 38 3HD1 LEU 38 -8.043 -3.404 -3.432
329 1HD2 LEU 38 1HD2 LEU 38 -10.866 -3.397 -5.290
330 2HD2 LEU 38 2HD2 LEU 38 -10.016 -3.370 -6.834
331 3HD2 LEU 38 3HD2 LEU 38 -10.683 -1.879 -6.168
332 H VAL 39 H VAL 39 -6.885 -1.083 -6.748
333 HA VAL 39 HA VAL 39 -7.110 1.301 -8.262
334 HB VAL 39 HB VAL 39 -6.828 -1.507 -9.338
335 1HG1 VAL 39 1HG1 VAL 39 -7.274 0.766 -10.733
336 2HG1 VAL 39 2HG1 VAL 39 -6.364 -0.612 -11.351
337 3HG1 VAL 39 3HG1 VAL 39 -5.512 0.768 -10.659
338 1HG2 VAL 39 1HG2 VAL 39 -5.128 -0.377 -7.540
339 2HG2 VAL 39 2HG2 VAL 39 -4.420 0.150 -9.067
340 3HG2 VAL 39 3HG2 VAL 39 -4.659 -1.568 -8.752
341 H ASP 40 H ASP 40 -8.964 2.179 -8.889
342 HA ASP 40 HA ASP 40 -11.417 0.770 -9.032
343 1HB ASP 40 2HB ASP 40 -10.704 3.474 -10.190
344 2HB ASP 40 1HB ASP 40 -12.333 2.856 -9.941
345 H THR 41 H THR 41 -12.787 0.579 -10.950
346 HA THR 41 HA THR 41 -11.251 -0.456 -13.189
347 HB THR 41 HB THR 41 -14.251 -0.483 -12.941
348 HG1 THR 41 1HG THR 41 -13.393 -1.343 -11.021
349 1HG2 THR 41 1HG2 THR 41 -13.522 -2.889 -13.920
350 2HG2 THR 41 2HG2 THR 41 -12.272 -1.854 -14.610
351 3HG2 THR 41 3HG2 THR 41 -13.974 -1.502 -14.911
352 HA PRO 42 HA PRO 42 -11.973 3.536 -15.207
353 1HB PRO 42 2HB PRO 42 -10.342 3.054 -17.329
354 2HB PRO 42 1HB PRO 42 -9.745 3.585 -15.752
355 1HG PRO 42 2HG PRO 42 -9.833 0.826 -16.913
356 2HG PRO 42 1HG PRO 42 -8.530 1.618 -16.007
357 1HD PRO 42 2HD PRO 42 -10.219 -0.151 -14.860
358 2HD PRO 42 1HD PRO 42 -9.537 1.223 -13.968
359 H GLU 43 H GLU 43 -13.256 4.169 -16.902
360 HA GLU 43 HA GLU 43 -14.235 2.073 -18.718
361 1HB GLU 43 2HB GLU 43 -15.873 4.067 -17.155
362 2HB GLU 43 1HB GLU 43 -16.502 3.201 -18.550
363 1HG GLU 43 2HG GLU 43 -15.266 1.460 -16.566
364 2HG GLU 43 1HG GLU 43 -16.645 2.370 -15.950
365 H THR 44 H THR 44 -15.601 3.165 -20.534
366 HA THR 44 HA THR 44 -13.861 5.071 -21.806
367 HB THR 44 HB THR 44 -15.807 4.920 -23.576
368 HG1 THR 44 1HG THR 44 -17.169 3.796 -22.017
369 1HG2 THR 44 1HG2 THR 44 -14.389 3.626 -24.664
370 2HG2 THR 44 2HG2 THR 44 -14.719 2.275 -23.579
371 3HG2 THR 44 3HG2 THR 44 -13.465 3.447 -23.173
372 H LYS 45 H LYS 45 -13.963 7.073 -20.940
373 HA LYS 45 HA LYS 45 -14.762 9.129 -20.389
374 1HB LYS 45 2HB LYS 45 -15.768 8.587 -22.822
375 2HB LYS 45 1HB LYS 45 -17.271 8.762 -21.928
376 1HG LYS 45 2HG LYS 45 -15.318 10.881 -21.419
377 2HG LYS 45 1HG LYS 45 -15.893 10.797 -23.085
378 1HD LYS 45 2HD LYS 45 -18.244 10.621 -21.973
379 2HD LYS 45 1HD LYS 45 -17.427 11.317 -20.571
380 1HE LYS 45 2HE LYS 45 -16.830 13.269 -21.776
381 2HE LYS 45 1HE LYS 45 -17.284 12.539 -23.316
382 1HZ LYS 45 1HZ LYS 45 -19.474 12.920 -22.959
383 2HZ LYS 45 2HZ LYS 45 -18.864 14.196 -22.034
384 3HZ LYS 45 3HZ LYS 45 -19.361 12.769 -21.278
385 H HIS 46 H HIS 46 -15.720 6.637 -18.929
386 HA HIS 46 HA HIS 46 -18.041 7.886 -17.615
387 1HB HIS 46 2HB HIS 46 -17.859 5.325 -18.807
388 2HB HIS 46 1HB HIS 46 -17.908 5.068 -17.066
389 HD1 HIS 46 1HD HIS 46 -19.764 7.830 -18.846
390 HD2 HIS 46 2HD HIS 46 -20.527 4.234 -16.907
391 HE1 HIS 46 1HE HIS 46 -22.265 7.705 -18.620
392 HE2 HIS 46 2HE HIS 46 -22.696 5.564 -17.363
393 HA PRO 47 HA PRO 47 -15.944 8.051 -13.756
394 1HB PRO 47 2HB PRO 47 -18.197 6.508 -12.572
395 2HB PRO 47 1HB PRO 47 -17.526 8.069 -12.089
396 1HG PRO 47 2HG PRO 47 -19.853 7.933 -13.372
397 2HG PRO 47 1HG PRO 47 -18.693 9.227 -13.723
398 1HD PRO 47 2HD PRO 47 -19.329 6.769 -15.298
399 2HD PRO 47 1HD PRO 47 -18.935 8.406 -15.867
400 H LYS 48 H LYS 48 -14.206 6.830 -13.401
401 HA LYS 48 HA LYS 48 -14.148 4.019 -13.816
402 1HB LYS 48 2HB LYS 48 -11.847 4.180 -12.856
403 2HB LYS 48 1HB LYS 48 -12.144 5.287 -14.188
404 1HG LYS 48 2HG LYS 48 -11.340 6.890 -12.884
405 2HG LYS 48 1HG LYS 48 -12.828 6.755 -11.945
406 1HD LYS 48 2HD LYS 48 -11.777 5.128 -10.474
407 2HD LYS 48 1HD LYS 48 -10.299 5.185 -11.438
408 1HE LYS 48 2HE LYS 48 -9.862 6.578 -9.608
409 2HE LYS 48 1HE LYS 48 -10.265 7.683 -10.922
410 1HZ LYS 48 1HZ LYS 48 -11.344 8.230 -8.782
411 2HZ LYS 48 2HZ LYS 48 -12.200 6.773 -8.863
412 3HZ LYS 48 3HZ LYS 48 -12.449 7.967 -10.036
413 H LYS 49 H LYS 49 -14.945 2.530 -12.504
414 HA LYS 49 HA LYS 49 -14.284 2.343 -9.773
415 1HB LYS 49 2HB LYS 49 -16.697 3.855 -10.418
416 2HB LYS 49 1HB LYS 49 -17.021 2.494 -9.354
417 1HG LYS 49 2HG LYS 49 -14.997 3.412 -8.004
418 2HG LYS 49 1HG LYS 49 -15.334 4.906 -8.879
419 1HD LYS 49 2HD LYS 49 -16.772 5.314 -7.201
420 2HD LYS 49 1HD LYS 49 -17.827 4.186 -8.054
421 1HE LYS 49 2HE LYS 49 -17.603 2.600 -6.479
422 2HE LYS 49 1HE LYS 49 -15.880 2.909 -6.277
423 1HZ LYS 49 1HZ LYS 49 -18.051 4.583 -5.135
424 2HZ LYS 49 2HZ LYS 49 -16.391 4.797 -4.891
425 3HZ LYS 49 3HZ LYS 49 -17.164 3.425 -4.276
426 H GLY 50 H GLY 50 -15.433 0.514 -8.694
427 1HA GLY 50 2HA GLY 50 -16.939 -1.280 -10.389
428 2HA GLY 50 1HA GLY 50 -15.302 -1.824 -10.049
429 H VAL 51 H VAL 51 -16.450 -3.662 -9.067
430 HA VAL 51 HA VAL 51 -18.013 -3.303 -6.715
431 HB VAL 51 HB VAL 51 -17.699 -5.736 -6.379
432 1HG1 VAL 51 1HG1 VAL 51 -18.287 -5.596 -9.260
433 2HG1 VAL 51 2HG1 VAL 51 -19.206 -4.488 -8.241
434 3HG1 VAL 51 3HG1 VAL 51 -19.260 -6.224 -7.930
435 1HG2 VAL 51 1HG2 VAL 51 -15.384 -5.855 -7.232
436 2HG2 VAL 51 2HG2 VAL 51 -15.996 -5.596 -8.865
437 3HG2 VAL 51 3HG2 VAL 51 -16.445 -7.052 -7.976
438 H GLU 52 H GLU 52 -17.451 -3.393 -4.582
439 HA GLU 52 HA GLU 52 -14.567 -3.310 -4.007
440 1HB GLU 52 2HB GLU 52 -16.452 -1.439 -3.409
441 2HB GLU 52 1HB GLU 52 -16.445 -2.387 -1.929
442 1HG GLU 52 2HG GLU 52 -13.790 -1.683 -2.955
443 2HG GLU 52 1HG GLU 52 -14.783 -0.318 -2.447
444 H LYS 53 H LYS 53 -13.747 -5.050 -3.066
445 HA LYS 53 HA LYS 53 -15.231 -7.235 -2.168
446 1HB LYS 53 2HB LYS 53 -12.392 -6.372 -1.924
447 2HB LYS 53 1HB LYS 53 -12.944 -7.662 -0.864
448 1HG LYS 53 2HG LYS 53 -13.256 -9.135 -2.585
449 2HG LYS 53 1HG LYS 53 -13.541 -7.858 -3.770
450 1HD LYS 53 2HD LYS 53 -10.967 -7.356 -3.031
451 2HD LYS 53 1HD LYS 53 -11.033 -9.115 -2.915
452 1HE LYS 53 2HE LYS 53 -11.252 -9.386 -5.145
453 2HE LYS 53 1HE LYS 53 -12.259 -7.950 -5.325
454 1HZ LYS 53 1HZ LYS 53 -10.038 -6.730 -4.818
455 2HZ LYS 53 2HZ LYS 53 -10.346 -7.308 -6.377
456 3HZ LYS 53 3HZ LYS 53 -9.332 -8.178 -5.341
457 H TYR 54 H TYR 54 -16.816 -6.666 -0.708
458 HA TYR 54 HA TYR 54 -16.038 -5.362 1.781
459 1HB TYR 54 2HB TYR 54 -18.411 -5.452 0.212
460 2HB TYR 54 1HB TYR 54 -18.789 -6.137 1.789
461 HD1 TYR 54 1HD TYR 54 -16.735 -3.270 0.532
462 HD2 TYR 54 2HD TYR 54 -19.715 -4.623 3.248
463 HE1 TYR 54 1HE TYR 54 -16.903 -1.002 1.466
464 HE2 TYR 54 2HE TYR 54 -19.893 -2.357 4.190
465 HH TYR 54 HH TYR 54 -18.206 -0.281 4.321
466 H GLY 55 H GLY 55 -15.009 -7.993 1.327
467 1HA GLY 55 2HA GLY 55 -16.568 -9.625 3.215
468 2HA GLY 55 1HA GLY 55 -15.371 -10.244 2.087
469 HA PRO 56 HA PRO 56 -13.569 -9.255 6.420
470 1HB PRO 56 2HB PRO 56 -13.575 -11.737 7.516
471 2HB PRO 56 1HB PRO 56 -14.909 -10.596 7.718
472 1HG PRO 56 2HG PRO 56 -14.657 -12.899 5.821
473 2HG PRO 56 1HG PRO 56 -16.051 -12.402 6.799
474 1HD PRO 56 2HD PRO 56 -15.839 -11.816 4.164
475 2HD PRO 56 1HD PRO 56 -16.658 -10.742 5.317
476 H GLU 57 H GLU 57 -13.108 -11.537 3.882
477 HA GLU 57 HA GLU 57 -10.709 -12.748 4.581
478 1HB GLU 57 2HB GLU 57 -10.335 -13.012 2.146
479 2HB GLU 57 1HB GLU 57 -11.961 -13.464 2.641
480 1HG GLU 57 2HG GLU 57 -11.857 -10.686 1.900
481 2HG GLU 57 1HG GLU 57 -11.235 -11.709 0.606
482 H ALA 58 H ALA 58 -11.341 -9.496 3.527
483 HA ALA 58 HA ALA 58 -8.820 -8.745 2.597
484 1HB ALA 58 1HB ALA 58 -11.071 -7.235 3.862
485 2HB ALA 58 2HB ALA 58 -10.504 -7.201 2.193
486 3HB ALA 58 3HB ALA 58 -9.557 -6.425 3.463
487 H SER 59 H SER 59 -10.139 -8.002 5.830
488 HA SER 59 HA SER 59 -7.666 -7.257 6.936
489 1HB SER 59 2HB SER 59 -10.228 -7.051 7.770
490 2HB SER 59 1HB SER 59 -9.691 -8.399 8.773
491 HG SER 59 HG SER 59 -9.124 -5.768 8.997
492 H ALA 60 H ALA 60 -9.362 -10.345 6.829
493 HA ALA 60 HA ALA 60 -7.678 -11.750 8.598
494 1HB ALA 60 1HB ALA 60 -10.001 -12.346 7.429
495 2HB ALA 60 2HB ALA 60 -8.921 -13.578 8.083
496 3HB ALA 60 3HB ALA 60 -8.919 -13.230 6.354
497 H PHE 61 H PHE 61 -7.434 -10.993 5.192
498 HA PHE 61 HA PHE 61 -5.477 -12.843 4.439
499 1HB PHE 61 2HB PHE 61 -6.237 -11.832 2.557
500 2HB PHE 61 1HB PHE 61 -6.558 -10.314 3.381
501 HD1 PHE 61 1HD PHE 61 -4.018 -12.305 1.628
502 HD2 PHE 61 2HD PHE 61 -4.948 -8.551 3.402
503 HE1 PHE 61 1HE PHE 61 -2.034 -11.314 0.562
504 HE2 PHE 61 2HE PHE 61 -2.968 -7.554 2.338
505 HZ PHE 61 HZ PHE 61 -1.507 -8.934 0.916
506 H THR 62 H THR 62 -5.092 -9.487 5.574
507 HA THR 62 HA THR 62 -2.301 -9.408 5.538
508 HB THR 62 HB THR 62 -2.488 -7.515 7.058
509 HG1 THR 62 1HG THR 62 -3.934 -7.787 8.558
510 1HG2 THR 62 1HG2 THR 62 -4.122 -6.121 5.908
511 2HG2 THR 62 2HG2 THR 62 -4.803 -7.556 5.137
512 3HG2 THR 62 3HG2 THR 62 -3.150 -7.058 4.773
513 H LYS 63 H LYS 63 -4.523 -10.345 8.137
514 HA LYS 63 HA LYS 63 -2.686 -10.765 10.171
515 1HB LYS 63 2HB LYS 63 -5.338 -10.968 10.033
516 2HB LYS 63 1HB LYS 63 -4.951 -12.679 9.909
517 1HG LYS 63 2HG LYS 63 -4.569 -12.819 12.088
518 2HG LYS 63 1HG LYS 63 -3.446 -11.460 12.036
519 1HD LYS 63 2HD LYS 63 -5.335 -9.902 12.167
520 2HD LYS 63 1HD LYS 63 -6.453 -11.267 12.227
521 1HE LYS 63 2HE LYS 63 -4.240 -10.995 14.229
522 2HE LYS 63 1HE LYS 63 -5.760 -10.125 14.437
523 1HZ LYS 63 1HZ LYS 63 -6.338 -12.009 15.494
524 2HZ LYS 63 2HZ LYS 63 -5.198 -12.964 14.688
525 3HZ LYS 63 3HZ LYS 63 -6.660 -12.575 13.932
526 H LYS 64 H LYS 64 -3.140 -12.559 7.278
527 HA LYS 64 HA LYS 64 -1.898 -14.969 8.315
528 1HB LYS 64 2HB LYS 64 -3.750 -15.034 6.633
529 2HB LYS 64 1HB LYS 64 -2.654 -14.308 5.466
530 1HG LYS 64 2HG LYS 64 -2.519 -16.553 4.959
531 2HG LYS 64 1HG LYS 64 -1.121 -16.316 6.009
532 1HD LYS 64 2HD LYS 64 -1.992 -18.170 7.002
533 2HD LYS 64 1HD LYS 64 -2.910 -16.940 7.875
534 1HE LYS 64 2HE LYS 64 -3.833 -18.475 5.448
535 2HE LYS 64 1HE LYS 64 -4.376 -18.723 7.106
536 1HZ LYS 64 1HZ LYS 64 -5.231 -16.433 7.085
537 2HZ LYS 64 2HZ LYS 64 -5.977 -17.410 5.924
538 3HZ LYS 64 3HZ LYS 64 -4.798 -16.292 5.455
539 H MET 65 H MET 65 -1.196 -12.832 5.544
540 HA MET 65 HA MET 65 1.586 -13.652 5.609
541 1HB MET 65 2HB MET 65 0.433 -11.580 3.762
542 2HB MET 65 1HB MET 65 1.807 -12.644 3.498
543 1HG MET 65 2HG MET 65 -0.093 -14.492 3.753
544 2HG MET 65 1HG MET 65 -1.085 -13.156 3.173
545 1HE MET 65 1HE MET 65 -0.949 -13.414 -0.341
546 2HE MET 65 2HE MET 65 -1.802 -13.226 1.191
547 3HE MET 65 3HE MET 65 -1.498 -14.837 0.543
548 H TRP 66 H TRP 66 -0.107 -10.508 5.571
549 HA TRP 66 HA TRP 66 2.045 -8.897 6.124
550 1HB TRP 66 2HB TRP 66 -0.147 -8.014 5.512
551 2HB TRP 66 1HB TRP 66 -0.801 -8.524 7.063
552 HD1 TRP 66 HD TRP 66 1.181 -5.747 5.428
553 HE1 TRP 66 1HE TRP 66 1.573 -3.864 7.140
554 HE3 TRP 66 3HE TRP 66 -0.451 -8.131 9.647
555 HZ2 TRP 66 2HZ TRP 66 1.235 -3.447 9.912
556 HZ3 TRP 66 3HZ TRP 66 -0.384 -6.920 11.787
557 HH2 TRP 66 HH TRP 66 0.443 -4.626 11.915
558 H GLU 67 H GLU 67 0.216 -10.880 8.369
559 HA GLU 67 HA GLU 67 1.617 -9.707 10.644
560 1HB GLU 67 2HB GLU 67 -0.821 -11.308 10.276
561 2HB GLU 67 1HB GLU 67 0.105 -11.691 11.720
562 1HG GLU 67 2HG GLU 67 0.027 -8.930 11.697
563 2HG GLU 67 1HG GLU 67 -1.577 -9.408 11.141
564 H ASN 68 H ASN 68 1.125 -12.980 9.281
565 HA ASN 68 HA ASN 68 3.160 -14.088 10.987
566 1HB ASN 68 2HB ASN 68 1.000 -15.146 9.684
567 2HB ASN 68 1HB ASN 68 2.329 -15.688 8.663
568 1HD2 ASN 68 1HD2 ASN 68 0.628 -16.153 11.557
569 2HD2 ASN 68 2HD2 ASN 68 1.619 -17.403 12.220
570 H ALA 69 H ALA 69 3.008 -12.838 7.750
571 HA ALA 69 HA ALA 69 5.773 -13.719 7.263
572 1HB ALA 69 1HB ALA 69 5.374 -13.482 4.932
573 2HB ALA 69 2HB ALA 69 3.842 -12.652 5.212
574 3HB ALA 69 3HB ALA 69 4.003 -14.364 5.602
575 H LYS 70 H LYS 70 7.310 -12.197 6.474
576 HA LYS 70 HA LYS 70 6.703 -9.456 7.328
577 1HB LYS 70 2HB LYS 70 9.304 -10.947 7.021
578 2HB LYS 70 1HB LYS 70 9.227 -9.214 7.311
579 1HG LYS 70 2HG LYS 70 8.610 -9.462 9.473
580 2HG LYS 70 1HG LYS 70 7.699 -10.942 9.161
581 1HD LYS 70 2HD LYS 70 10.477 -11.410 8.647
582 2HD LYS 70 1HD LYS 70 10.295 -10.684 10.245
583 1HE LYS 70 2HE LYS 70 8.355 -12.455 10.454
584 2HE LYS 70 1HE LYS 70 9.288 -13.289 9.211
585 1HZ LYS 70 1HZ LYS 70 10.315 -14.125 11.022
586 2HZ LYS 70 2HZ LYS 70 9.938 -12.804 12.008
587 3HZ LYS 70 3HZ LYS 70 11.222 -12.701 10.913
588 H LYS 71 H LYS 71 5.823 -8.474 5.561
589 HA LYS 71 HA LYS 71 7.619 -7.620 3.516
590 1HB LYS 71 2HB LYS 71 6.116 -8.494 1.632
591 2HB LYS 71 1HB LYS 71 7.197 -9.652 2.400
592 1HG LYS 71 2HG LYS 71 4.505 -9.420 3.574
593 2HG LYS 71 1HG LYS 71 4.590 -10.115 1.956
594 1HD LYS 71 2HD LYS 71 6.664 -11.231 3.586
595 2HD LYS 71 1HD LYS 71 5.118 -11.377 4.419
596 1HE LYS 71 2HE LYS 71 4.581 -13.094 3.117
597 2HE LYS 71 1HE LYS 71 4.696 -12.054 1.699
598 1HZ LYS 71 1HZ LYS 71 7.264 -12.559 2.135
599 2HZ LYS 71 2HZ LYS 71 6.291 -13.518 1.140
600 3HZ LYS 71 3HZ LYS 71 6.595 -13.993 2.734
601 H ILE 72 H ILE 72 7.036 -5.549 4.048
602 HA ILE 72 HA ILE 72 4.378 -4.722 3.158
603 HB ILE 72 HB ILE 72 5.475 -3.540 5.685
604 1HG1 ILE 72 2HG1 ILE 72 3.637 -5.121 6.733
605 2HG1 ILE 72 1HG1 ILE 72 4.010 -6.125 5.335
606 1HG2 ILE 72 1HG2 ILE 72 2.959 -3.193 6.006
607 2HG2 ILE 72 2HG2 ILE 72 2.814 -3.635 4.306
608 3HG2 ILE 72 3HG2 ILE 72 3.769 -2.229 4.773
609 1HD1 ILE 72 1HD1 ILE 72 6.170 -5.116 7.143
610 2HD1 ILE 72 2HD1 ILE 72 6.198 -6.487 6.034
611 3HD1 ILE 72 3HD1 ILE 72 5.253 -6.575 7.520
612 H GLU 73 H GLU 73 4.987 -3.496 1.435
613 HA GLU 73 HA GLU 73 6.757 -1.227 2.016
614 1HB GLU 73 2HB GLU 73 6.984 -2.997 -0.420
615 2HB GLU 73 1HB GLU 73 7.898 -1.520 -0.147
616 1HG GLU 73 2HG GLU 73 9.208 -2.468 1.489
617 2HG GLU 73 1HG GLU 73 8.019 -3.711 1.873
618 H VAL 74 H VAL 74 6.465 0.624 0.720
619 HA VAL 74 HA VAL 74 3.803 0.767 -0.520
620 HB VAL 74 HB VAL 74 4.258 3.304 -0.339
621 1HG1 VAL 74 1HG1 VAL 74 2.615 2.052 0.989
622 2HG1 VAL 74 2HG1 VAL 74 3.361 3.359 1.905
623 3HG1 VAL 74 3HG1 VAL 74 3.869 1.692 2.172
624 1HG2 VAL 74 1HG2 VAL 74 5.947 2.740 2.006
625 2HG2 VAL 74 2HG2 VAL 74 5.992 4.088 0.869
626 3HG2 VAL 74 3HG2 VAL 74 6.730 2.547 0.438
627 H GLU 75 H GLU 75 3.483 1.953 -2.454
628 HA GLU 75 HA GLU 75 5.825 1.904 -4.227
629 1HB GLU 75 2HB GLU 75 3.363 0.768 -4.568
630 2HB GLU 75 1HB GLU 75 3.163 2.285 -5.432
631 1HG GLU 75 2HG GLU 75 5.412 0.348 -5.918
632 2HG GLU 75 1HG GLU 75 3.912 0.389 -6.846
633 H PHE 76 H PHE 76 2.787 3.774 -4.358
634 HA PHE 76 HA PHE 76 4.318 6.257 -4.208
635 1HB PHE 76 2HB PHE 76 3.179 7.161 -6.217
636 2HB PHE 76 1HB PHE 76 4.247 5.810 -6.589
637 HD1 PHE 76 1HD PHE 76 3.395 3.764 -7.461
638 HD2 PHE 76 2HD PHE 76 0.744 6.866 -6.256
639 HE1 PHE 76 1HE PHE 76 1.540 2.609 -8.588
640 HE2 PHE 76 2HE PHE 76 -1.119 5.715 -7.380
641 HZ PHE 76 HZ PHE 76 -0.722 3.583 -8.547
642 H ASP 77 H ASP 77 3.141 8.041 -3.513
643 HA ASP 77 HA ASP 77 0.990 7.563 -1.795
644 1HB ASP 77 2HB ASP 77 0.753 10.061 -1.763
645 2HB ASP 77 1HB ASP 77 2.386 9.484 -1.445
646 H LYS 78 H LYS 78 -1.204 8.067 -1.915
647 HA LYS 78 HA LYS 78 -2.281 8.056 -4.644
648 1HB LYS 78 2HB LYS 78 -4.457 7.588 -3.103
649 2HB LYS 78 1HB LYS 78 -3.418 6.324 -3.742
650 1HG LYS 78 2HG LYS 78 -2.331 6.022 -1.690
651 2HG LYS 78 1HG LYS 78 -2.930 7.554 -1.050
652 1HD LYS 78 2HD LYS 78 -4.931 5.516 -1.866
653 2HD LYS 78 1HD LYS 78 -4.015 5.223 -0.386
654 1HE LYS 78 2HE LYS 78 -4.714 7.404 0.474
655 2HE LYS 78 1HE LYS 78 -5.626 7.697 -1.005
656 1HZ LYS 78 1HZ LYS 78 -7.033 6.914 0.813
657 2HZ LYS 78 2HZ LYS 78 -6.139 5.480 0.904
658 3HZ LYS 78 3HZ LYS 78 -7.040 5.829 -0.485
659 H GLY 79 H GLY 79 -3.205 9.438 -1.477
660 1HA GLY 79 2HA GLY 79 -3.516 11.781 -1.131
661 2HA GLY 79 1HA GLY 79 -3.793 11.964 -2.856
662 H GLN 80 H GLN 80 -5.280 9.634 -0.631
663 HA GLN 80 HA GLN 80 -7.867 10.958 -1.123
664 1HB GLN 80 2HB GLN 80 -7.582 7.988 -0.744
665 2HB GLN 80 1HB GLN 80 -8.961 8.880 -1.368
666 1HG GLN 80 2HG GLN 80 -6.992 9.534 -3.149
667 2HG GLN 80 1HG GLN 80 -6.600 7.864 -2.744
668 1HE2 GLN 80 1HE2 GLN 80 -7.378 8.597 -5.281
669 2HE2 GLN 80 2HE2 GLN 80 -8.931 7.919 -5.622
670 H ARG 81 H ARG 81 -9.412 10.858 0.553
671 HA ARG 81 HA ARG 81 -10.171 10.842 2.698
672 1HB ARG 81 2HB ARG 81 -8.849 8.457 2.490
673 2HB ARG 81 1HB ARG 81 -8.018 9.205 3.847
674 1HG ARG 81 2HG ARG 81 -9.795 7.877 4.707
675 2HG ARG 81 1HG ARG 81 -10.234 9.574 4.918
676 1HD ARG 81 2HD ARG 81 -11.572 9.423 2.828
677 2HD ARG 81 1HD ARG 81 -11.219 7.697 2.775
678 HE ARG 81 HE ARG 81 -12.287 8.033 5.237
679 1HH1 ARG 81 1HH1 ARG 81 -13.351 8.920 2.034
680 2HH1 ARG 81 2HH1 ARG 81 -15.034 8.798 2.425
681 1HH2 ARG 81 1HH2 ARG 81 -14.499 7.873 5.751
682 2HH2 ARG 81 2HH2 ARG 81 -15.686 8.205 4.535
683 H THR 82 H THR 82 -7.597 12.355 1.668
684 HA THR 82 HA THR 82 -6.731 13.354 4.297
685 HB THR 82 HB THR 82 -4.626 13.139 3.472
686 HG1 THR 82 1HG THR 82 -4.962 15.348 2.866
687 1HG2 THR 82 1HG2 THR 82 -4.132 12.467 1.177
688 2HG2 THR 82 2HG2 THR 82 -5.830 12.668 0.745
689 3HG2 THR 82 3HG2 THR 82 -5.358 11.435 1.914
690 H ASP 83 H ASP 83 -6.687 15.645 4.648
691 HA ASP 83 HA ASP 83 -8.692 17.072 3.096
692 1HB ASP 83 2HB ASP 83 -7.339 17.454 5.706
693 2HB ASP 83 1HB ASP 83 -7.812 18.925 4.862
694 H LYS 84 H LYS 84 -5.316 17.584 4.033
695 HA LYS 84 HA LYS 84 -4.949 19.312 1.669
696 1HB LYS 84 2HB LYS 84 -3.816 19.371 4.425
697 2HB LYS 84 1HB LYS 84 -2.716 19.772 3.113
698 1HG LYS 84 2HG LYS 84 -3.537 21.822 3.017
699 2HG LYS 84 1HG LYS 84 -5.155 21.186 2.718
700 1HD LYS 84 2HD LYS 84 -5.522 20.969 5.121
701 2HD LYS 84 1HD LYS 84 -3.892 21.568 5.433
702 1HE LYS 84 2HE LYS 84 -4.661 23.622 4.044
703 2HE LYS 84 1HE LYS 84 -6.285 23.036 4.397
704 1HZ LYS 84 1HZ LYS 84 -4.394 23.313 6.618
705 2HZ LYS 84 2HZ LYS 84 -6.074 23.500 6.605
706 3HZ LYS 84 3HZ LYS 84 -5.084 24.719 5.977
707 H TYR 85 H TYR 85 -3.299 17.079 3.814
708 HA TYR 85 HA TYR 85 -2.277 15.580 1.516
709 1HB TYR 85 2HB TYR 85 -0.663 16.391 3.954
710 2HB TYR 85 1HB TYR 85 -0.127 15.236 2.739
711 HD1 TYR 85 1HD TYR 85 -0.260 16.199 0.240
712 HD2 TYR 85 2HD TYR 85 0.102 18.555 3.764
713 HE1 TYR 85 1HE TYR 85 0.692 18.035 -1.092
714 HE2 TYR 85 2HE TYR 85 1.052 20.398 2.443
715 HH TYR 85 HH TYR 85 2.420 20.284 -0.155
716 H GLY 86 H GLY 86 -3.064 15.829 4.899
717 1HA GLY 86 2HA GLY 86 -3.670 14.382 6.553
718 2HA GLY 86 1HA GLY 86 -4.684 13.720 5.292
719 H ARG 87 H ARG 87 -2.528 12.591 3.741
720 HA ARG 87 HA ARG 87 -1.194 10.776 5.555
721 1HB ARG 87 2HB ARG 87 -2.525 9.536 3.173
722 2HB ARG 87 1HB ARG 87 -1.999 8.779 4.678
723 1HG ARG 87 2HG ARG 87 -4.233 10.752 4.771
724 2HG ARG 87 1HG ARG 87 -4.543 9.136 4.139
725 1HD ARG 87 2HD ARG 87 -4.643 8.323 6.201
726 2HD ARG 87 1HD ARG 87 -3.007 8.892 6.523
727 HE ARG 87 HE ARG 87 -4.627 11.096 6.803
728 1HH1 ARG 87 1HH1 ARG 87 -4.385 7.943 8.279
729 2HH1 ARG 87 2HH1 ARG 87 -5.001 8.472 9.808
730 1HH2 ARG 87 1HH2 ARG 87 -5.436 11.795 8.816
731 2HH2 ARG 87 2HH2 ARG 87 -5.596 10.660 10.114
732 H GLY 88 H GLY 88 0.709 11.608 5.016
733 1HA GLY 88 2HA GLY 88 1.509 12.098 2.293
734 2HA GLY 88 1HA GLY 88 2.543 12.206 3.712
735 H LEU 89 H LEU 89 0.854 9.288 3.520
736 HA LEU 89 HA LEU 89 3.115 7.908 2.262
737 1HB LEU 89 2HB LEU 89 1.596 6.629 4.482
738 2HB LEU 89 1HB LEU 89 3.248 6.352 3.961
739 HG LEU 89 HG LEU 89 3.386 7.376 6.090
740 1HD1 LEU 89 1HD1 LEU 89 4.423 8.624 3.806
741 2HD1 LEU 89 2HD1 LEU 89 5.022 8.724 5.460
742 3HD1 LEU 89 3HD1 LEU 89 3.869 9.919 4.867
743 1HD2 LEU 89 1HD2 LEU 89 1.789 8.668 6.920
744 2HD2 LEU 89 2HD2 LEU 89 0.955 8.590 5.369
745 3HD2 LEU 89 3HD2 LEU 89 2.094 9.897 5.692
746 H ALA 90 H ALA 90 2.585 5.964 1.146
747 HA ALA 90 HA ALA 90 -0.232 5.870 0.337
748 1HB ALA 90 1HB ALA 90 2.011 5.982 -1.190
749 2HB ALA 90 2HB ALA 90 0.446 5.380 -1.738
750 3HB ALA 90 3HB ALA 90 1.679 4.249 -1.180
751 H TYR 91 H TYR 91 -0.703 3.501 -0.588
752 HA TYR 91 HA TYR 91 -0.959 1.866 1.726
753 1HB TYR 91 2HB TYR 91 -1.731 0.195 -0.259
754 2HB TYR 91 1HB TYR 91 -2.770 1.418 0.454
755 HD1 TYR 91 1HD TYR 91 -0.753 0.527 -2.482
756 HD2 TYR 91 2HD TYR 91 -3.399 3.390 -0.779
757 HE1 TYR 91 1HE TYR 91 -1.054 1.557 -4.695
758 HE2 TYR 91 2HE TYR 91 -3.708 4.428 -2.985
759 HH TYR 91 HH TYR 91 -2.431 4.582 -5.144
760 H ILE 92 H ILE 92 -0.108 -0.123 2.192
761 HA ILE 92 HA ILE 92 2.476 -0.675 0.942
762 HB ILE 92 HB ILE 92 2.690 -2.310 2.905
763 1HG1 ILE 92 2HG1 ILE 92 1.328 -1.835 4.869
764 2HG1 ILE 92 1HG1 ILE 92 0.446 -0.591 3.992
765 1HG2 ILE 92 1HG2 ILE 92 4.016 -0.371 2.899
766 2HG2 ILE 92 2HG2 ILE 92 3.228 -0.388 4.477
767 3HG2 ILE 92 3HG2 ILE 92 2.628 0.674 3.205
768 1HD1 ILE 92 1HD1 ILE 92 -0.607 -2.928 4.329
769 2HD1 ILE 92 2HD1 ILE 92 0.443 -3.400 2.993
770 3HD1 ILE 92 3HD1 ILE 92 -0.755 -2.125 2.765
771 H TYR 93 H TYR 93 3.092 -2.934 0.556
772 HA TYR 93 HA TYR 93 0.789 -4.493 -0.412
773 1HB TYR 93 2HB TYR 93 3.642 -4.397 -1.405
774 2HB TYR 93 1HB TYR 93 2.439 -5.545 -1.981
775 HD1 TYR 93 1HD TYR 93 0.046 -3.798 -2.141
776 HD2 TYR 93 2HD TYR 93 4.081 -3.071 -3.279
777 HE1 TYR 93 1HE TYR 93 -0.724 -2.159 -3.805
778 HE2 TYR 93 2HE TYR 93 3.321 -1.430 -4.945
779 HH TYR 93 HH TYR 93 0.558 0.030 -4.963
780 H ALA 94 H ALA 94 0.334 -6.259 0.702
781 HA ALA 94 HA ALA 94 2.393 -7.445 2.413
782 1HB ALA 94 1HB ALA 94 0.483 -8.671 3.439
783 2HB ALA 94 2HB ALA 94 -0.600 -7.796 2.356
784 3HB ALA 94 3HB ALA 94 0.352 -6.915 3.551
785 H ASP 95 H ASP 95 3.603 -8.668 1.003
786 HA ASP 95 HA ASP 95 4.202 -10.544 -0.135
787 1HB ASP 95 2HB ASP 95 2.701 -11.622 1.630
788 2HB ASP 95 1HB ASP 95 1.448 -11.653 0.393
789 H GLY 96 H GLY 96 3.563 -8.520 -1.715
790 1HA GLY 96 2HA GLY 96 3.374 -8.605 -4.112
791 2HA GLY 96 1HA GLY 96 2.132 -9.833 -3.928
792 H LYS 97 H LYS 97 0.042 -9.172 -3.108
793 HA LYS 97 HA LYS 97 -0.501 -6.308 -3.540
794 1HB LYS 97 2HB LYS 97 -2.721 -7.018 -4.468
795 2HB LYS 97 1HB LYS 97 -1.337 -7.455 -5.463
796 1HG LYS 97 2HG LYS 97 -2.022 -9.556 -5.463
797 2HG LYS 97 1HG LYS 97 -1.805 -9.617 -3.714
798 1HD LYS 97 2HD LYS 97 -4.011 -10.027 -3.659
799 2HD LYS 97 1HD LYS 97 -4.179 -8.291 -3.933
800 1HE LYS 97 2HE LYS 97 -5.515 -9.119 -5.604
801 2HE LYS 97 1HE LYS 97 -3.975 -8.978 -6.451
802 1HZ LYS 97 1HZ LYS 97 -5.440 -11.188 -6.446
803 2HZ LYS 97 2HZ LYS 97 -4.464 -11.506 -5.101
804 3HZ LYS 97 3HZ LYS 97 -3.756 -11.200 -6.607
805 H MET 98 H MET 98 -1.765 -5.302 -2.075
806 HA MET 98 HA MET 98 -2.629 -6.884 0.235
807 1HB MET 98 2HB MET 98 -1.228 -4.530 0.095
808 2HB MET 98 1HB MET 98 -2.863 -3.960 0.400
809 1HG MET 98 2HG MET 98 -1.647 -6.125 2.067
810 2HG MET 98 1HG MET 98 -1.321 -4.426 2.395
811 1HE MET 98 1HE MET 98 -3.116 -3.024 4.127
812 2HE MET 98 2HE MET 98 -2.026 -4.341 4.562
813 3HE MET 98 3HE MET 98 -3.683 -4.332 5.166
814 H VAL 99 H VAL 99 -4.721 -6.955 0.932
815 HA VAL 99 HA VAL 99 -6.748 -6.227 -0.991
816 HB VAL 99 HB VAL 99 -7.150 -7.444 1.742
817 1HG1 VAL 99 1HG1 VAL 99 -8.871 -7.342 -0.731
818 2HG1 VAL 99 2HG1 VAL 99 -9.187 -6.569 0.822
819 3HG1 VAL 99 3HG1 VAL 99 -9.224 -8.327 0.689
820 1HG2 VAL 99 1HG2 VAL 99 -6.102 -8.593 -0.747
821 2HG2 VAL 99 2HG2 VAL 99 -7.423 -9.502 -0.014
822 3HG2 VAL 99 3HG2 VAL 99 -5.962 -9.165 0.916
823 H ASN 100 H ASN 100 -8.647 -4.988 -0.463
824 HA ASN 100 HA ASN 100 -8.007 -2.726 1.274
825 1HB ASN 100 2HB ASN 100 -9.346 -3.018 -1.237
826 2HB ASN 100 1HB ASN 100 -10.476 -2.321 -0.081
827 1HD2 ASN 100 1HD2 ASN 100 -10.544 -0.233 -0.530
828 2HD2 ASN 100 2HD2 ASN 100 -9.176 0.810 -0.681
829 H GLU 101 H GLU 101 -9.905 -1.741 2.469
830 HA GLU 101 HA GLU 101 -12.149 -3.247 3.211
831 1HB GLU 101 2HB GLU 101 -9.898 -4.355 4.307
832 2HB GLU 101 1HB GLU 101 -10.418 -3.269 5.589
833 1HG GLU 101 2HG GLU 101 -12.478 -5.000 4.355
834 2HG GLU 101 1HG GLU 101 -11.276 -5.771 5.389
835 H ALA 102 H ALA 102 -13.417 -2.222 4.856
836 HA ALA 102 HA ALA 102 -12.453 0.446 5.644
837 1HB ALA 102 1HB ALA 102 -15.306 -0.063 4.858
838 2HB ALA 102 2HB ALA 102 -14.084 0.425 3.684
839 3HB ALA 102 3HB ALA 102 -14.470 1.480 5.043
840 H LEU 103 H LEU 103 -12.435 -1.963 7.195
841 HA LEU 103 HA LEU 103 -12.959 -2.710 9.278
842 1HB LEU 103 2HB LEU 103 -12.757 -0.002 9.471
843 2HB LEU 103 1HB LEU 103 -14.375 -0.263 10.094
844 HG LEU 103 HG LEU 103 -12.693 -2.173 11.344
845 1HD1 LEU 103 1HD1 LEU 103 -11.584 0.445 12.099
846 2HD1 LEU 103 2HD1 LEU 103 -11.049 -0.189 10.543
847 3HD1 LEU 103 3HD1 LEU 103 -10.811 -1.137 12.010
848 1HD2 LEU 103 1HD2 LEU 103 -14.598 -1.411 12.466
849 2HD2 LEU 103 2HD2 LEU 103 -14.173 0.284 12.225
850 3HD2 LEU 103 3HD2 LEU 103 -13.253 -0.701 13.361
851 H VAL 104 H VAL 104 -14.916 -2.963 7.082
852 HA VAL 104 HA VAL 104 -16.975 -3.893 6.796
853 HB VAL 104 HB VAL 104 -17.242 -3.876 9.804
854 1HG1 VAL 104 1HG1 VAL 104 -19.176 -4.369 8.022
855 2HG1 VAL 104 2HG1 VAL 104 -19.064 -5.201 9.574
856 3HG1 VAL 104 3HG1 VAL 104 -18.453 -5.975 8.111
857 1HG2 VAL 104 1HG2 VAL 104 -16.480 -6.378 8.474
858 2HG2 VAL 104 2HG2 VAL 104 -15.912 -5.677 9.990
859 3HG2 VAL 104 3HG2 VAL 104 -15.237 -5.127 8.457
860 H ARG 105 H ARG 105 -17.424 -1.895 9.719
861 HA ARG 105 HA ARG 105 -18.790 -0.133 10.163
862 1HB ARG 105 2HB ARG 105 -17.539 0.564 7.896
863 2HB ARG 105 1HB ARG 105 -19.190 0.521 7.293
864 1HG ARG 105 2HG ARG 105 -19.819 2.342 8.477
865 2HG ARG 105 1HG ARG 105 -18.739 1.978 9.824
866 1HD ARG 105 2HD ARG 105 -16.884 2.897 8.736
867 2HD ARG 105 1HD ARG 105 -17.670 2.844 7.159
868 HE ARG 105 HE ARG 105 -17.873 4.922 9.125
869 1HH1 ARG 105 1HH1 ARG 105 -19.492 3.376 6.449
870 2HH1 ARG 105 2HH1 ARG 105 -20.446 4.768 6.059
871 1HH2 ARG 105 1HH2 ARG 105 -19.126 6.753 8.616
872 2HH2 ARG 105 2HH2 ARG 105 -20.238 6.686 7.289
873 H GLN 106 H GLN 106 -19.920 -2.751 9.709
874 HA GLN 106 HA GLN 106 -22.658 -2.081 9.702
875 1HB GLN 106 2HB GLN 106 -21.464 -2.879 7.126
876 2HB GLN 106 1HB GLN 106 -22.933 -3.740 7.564
877 1HG GLN 106 2HG GLN 106 -23.607 -1.149 8.100
878 2HG GLN 106 1HG GLN 106 -22.557 -0.982 6.692
879 1HE2 GLN 106 1HE2 GLN 106 -24.269 -0.339 5.388
880 2HE2 GLN 106 2HE2 GLN 106 -25.470 -1.449 4.832
881 H GLY 107 H GLY 107 -22.279 -3.301 11.656
882 1HA GLY 107 2HA GLY 107 -23.345 -5.752 11.837
883 2HA GLY 107 1HA GLY 107 -21.685 -6.131 11.396
884 H LEU 108 H LEU 108 -20.683 -3.764 12.892
885 HA LEU 108 HA LEU 108 -20.887 -4.934 15.583
886 1HB LEU 108 2HB LEU 108 -18.682 -3.353 14.270
887 2HB LEU 108 1HB LEU 108 -18.700 -3.748 15.978
888 HG LEU 108 HG LEU 108 -18.893 -5.931 13.935
889 1HD1 LEU 108 1HD1 LEU 108 -16.882 -4.252 13.645
890 2HD1 LEU 108 2HD1 LEU 108 -16.653 -5.995 13.516
891 3HD1 LEU 108 3HD1 LEU 108 -16.233 -5.159 15.012
892 1HD2 LEU 108 1HD2 LEU 108 -18.255 -5.664 16.824
893 2HD2 LEU 108 2HD2 LEU 108 -17.456 -6.943 15.910
894 3HD2 LEU 108 3HD2 LEU 108 -19.217 -6.879 15.984
895 H ALA 109 H ALA 109 -20.408 -1.787 13.976
896 HA ALA 109 HA ALA 109 -21.733 -0.506 16.272
897 1HB ALA 109 1HB ALA 109 -20.320 1.189 14.318
898 2HB ALA 109 2HB ALA 109 -19.309 0.097 15.264
899 3HB ALA 109 3HB ALA 109 -20.348 1.264 16.080
900 H LYS 110 H LYS 110 -22.490 1.869 15.216
901 HA LYS 110 HA LYS 110 -24.456 1.089 13.163
902 1HB LYS 110 2HB LYS 110 -25.097 1.848 15.637
903 2HB LYS 110 1HB LYS 110 -24.946 3.444 14.916
904 1HG LYS 110 2HG LYS 110 -26.510 1.606 13.288
905 2HG LYS 110 1HG LYS 110 -27.191 1.868 14.896
906 1HD LYS 110 2HD LYS 110 -26.341 4.109 13.068
907 2HD LYS 110 1HD LYS 110 -27.982 3.459 13.109
908 1HE LYS 110 2HE LYS 110 -28.244 4.097 15.404
909 2HE LYS 110 1HE LYS 110 -26.545 4.553 15.522
910 1HZ LYS 110 1HZ LYS 110 -26.880 6.427 14.206
911 2HZ LYS 110 2HZ LYS 110 -28.244 6.399 15.206
912 3HZ LYS 110 3HZ LYS 110 -28.362 5.874 13.603
Start of MODEL 6
1 1H ALA 1 1HT ALA 1 -1.965 17.585 -18.466
2 2H ALA 1 2HT ALA 1 -1.651 16.234 -19.476
3 3H ALA 1 3HT ALA 1 -1.047 17.783 -19.899
4 HA ALA 1 HA ALA 1 0.595 16.238 -18.971
5 1HB ALA 1 1HB ALA 1 1.225 18.069 -17.130
6 2HB ALA 1 2HB ALA 1 -0.003 18.973 -18.016
7 3HB ALA 1 3HB ALA 1 1.412 18.348 -18.862
8 H THR 2 H THR 2 0.666 14.522 -17.692
9 HA THR 2 HA THR 2 -0.809 14.592 -15.147
10 HB THR 2 HB THR 2 -0.702 12.107 -15.249
11 HG1 THR 2 1HG THR 2 0.314 11.119 -16.814
12 1HG2 THR 2 1HG2 THR 2 -2.119 11.860 -17.390
13 2HG2 THR 2 2HG2 THR 2 -2.026 13.622 -17.451
14 3HG2 THR 2 3HG2 THR 2 -2.738 12.824 -16.049
15 H SER 3 H SER 3 0.578 15.289 -13.626
16 HA SER 3 HA SER 3 3.276 14.125 -13.555
17 1HB SER 3 2HB SER 3 2.774 16.705 -13.528
18 2HB SER 3 1HB SER 3 2.446 16.424 -11.819
19 HG SER 3 HG SER 3 4.585 16.876 -11.927
20 H THR 4 H THR 4 3.287 12.324 -12.364
21 HA THR 4 HA THR 4 1.805 12.319 -9.819
22 HB THR 4 HB THR 4 1.659 9.948 -9.967
23 HG1 THR 4 1HG THR 4 3.406 10.113 -12.195
24 1HG2 THR 4 1HG2 THR 4 0.614 9.506 -12.131
25 2HG2 THR 4 2HG2 THR 4 1.227 11.046 -12.734
26 3HG2 THR 4 3HG2 THR 4 0.052 11.018 -11.419
27 H LYS 5 H LYS 5 2.863 12.023 -7.936
28 HA LYS 5 HA LYS 5 5.635 12.450 -7.794
29 1HB LYS 5 2HB LYS 5 3.560 12.530 -6.009
30 2HB LYS 5 1HB LYS 5 4.440 11.107 -5.469
31 1HG LYS 5 2HG LYS 5 5.232 13.011 -4.260
32 2HG LYS 5 1HG LYS 5 6.499 12.478 -5.366
33 1HD LYS 5 2HD LYS 5 6.601 14.589 -6.080
34 2HD LYS 5 1HD LYS 5 5.039 14.307 -6.853
35 1HE LYS 5 2HE LYS 5 3.929 15.553 -5.345
36 2HE LYS 5 1HE LYS 5 4.894 14.958 -3.995
37 1HZ LYS 5 1HZ LYS 5 6.113 16.808 -5.924
38 2HZ LYS 5 2HZ LYS 5 6.468 16.580 -4.287
39 3HZ LYS 5 3HZ LYS 5 5.073 17.423 -4.739
40 H LYS 6 H LYS 6 7.356 11.094 -7.347
41 HA LYS 6 HA LYS 6 6.829 8.223 -7.752
42 1HB LYS 6 2HB LYS 6 9.054 10.006 -8.681
43 2HB LYS 6 1HB LYS 6 9.343 8.284 -8.469
44 1HG LYS 6 2HG LYS 6 8.133 7.719 -10.281
45 2HG LYS 6 1HG LYS 6 6.947 8.999 -10.024
46 1HD LYS 6 2HD LYS 6 8.054 9.621 -11.992
47 2HD LYS 6 1HD LYS 6 8.808 10.607 -10.739
48 1HE LYS 6 2HE LYS 6 10.497 8.618 -10.602
49 2HE LYS 6 1HE LYS 6 9.900 8.257 -12.221
50 1HZ LYS 6 1HZ LYS 6 10.378 10.861 -12.446
51 2HZ LYS 6 2HZ LYS 6 11.529 9.674 -12.803
52 3HZ LYS 6 3HZ LYS 6 11.560 10.456 -11.303
53 H LEU 7 H LEU 7 7.172 6.993 -6.035
54 HA LEU 7 HA LEU 7 9.017 7.953 -3.955
55 1HB LEU 7 2HB LEU 7 6.387 7.111 -3.760
56 2HB LEU 7 1HB LEU 7 7.299 5.711 -3.227
57 HG LEU 7 HG LEU 7 6.587 7.236 -1.387
58 1HD1 LEU 7 1HD1 LEU 7 8.835 5.791 -1.608
59 2HD1 LEU 7 2HD1 LEU 7 8.405 6.705 -0.162
60 3HD1 LEU 7 3HD1 LEU 7 9.531 7.389 -1.335
61 1HD2 LEU 7 1HD2 LEU 7 7.454 9.384 -1.129
62 2HD2 LEU 7 2HD2 LEU 7 7.025 9.308 -2.837
63 3HD2 LEU 7 3HD2 LEU 7 8.707 9.127 -2.341
64 H HIS 8 H HIS 8 10.407 6.425 -2.914
65 HA HIS 8 HA HIS 8 11.333 4.359 -4.755
66 1HB HIS 8 2HB HIS 8 12.581 6.105 -2.811
67 2HB HIS 8 1HB HIS 8 13.037 4.429 -2.527
68 HD1 HIS 8 1HD HIS 8 14.850 3.519 -3.970
69 HD2 HIS 8 2HD HIS 8 13.163 6.969 -5.557
70 HE1 HIS 8 1HE HIS 8 16.254 4.093 -5.976
71 HE2 HIS 8 2HE HIS 8 15.262 6.228 -6.874
72 H LYS 9 H LYS 9 11.626 2.205 -4.169
73 HA LYS 9 HA LYS 9 9.682 1.169 -2.359
74 1HB LYS 9 2HB LYS 9 10.782 -1.045 -2.928
75 2HB LYS 9 1HB LYS 9 10.124 -0.139 -4.283
76 1HG LYS 9 2HG LYS 9 12.089 -0.188 -5.292
77 2HG LYS 9 1HG LYS 9 12.830 0.647 -3.925
78 1HD LYS 9 2HD LYS 9 12.916 -1.651 -2.805
79 2HD LYS 9 1HD LYS 9 12.578 -2.308 -4.407
80 1HE LYS 9 2HE LYS 9 14.565 -0.880 -5.187
81 2HE LYS 9 1HE LYS 9 14.971 -0.758 -3.475
82 1HZ LYS 9 1HZ LYS 9 15.423 -2.999 -3.334
83 2HZ LYS 9 2HZ LYS 9 15.990 -2.642 -4.888
84 3HZ LYS 9 3HZ LYS 9 14.491 -3.398 -4.689
85 H GLU 10 H GLU 10 9.868 0.852 -0.256
86 HA GLU 10 HA GLU 10 12.440 0.128 0.902
87 1HB GLU 10 2HB GLU 10 11.450 2.766 1.044
88 2HB GLU 10 1HB GLU 10 11.185 2.061 2.632
89 1HG GLU 10 2HG GLU 10 13.285 2.606 3.078
90 2HG GLU 10 1HG GLU 10 13.750 1.279 2.016
91 HA PRO 11 HA PRO 11 9.554 -2.439 3.117
92 1HB PRO 11 2HB PRO 11 11.276 -3.850 4.579
93 2HB PRO 11 1HB PRO 11 11.179 -4.054 2.827
94 1HG PRO 11 2HG PRO 11 13.157 -2.483 4.438
95 2HG PRO 11 1HG PRO 11 13.442 -3.552 3.052
96 1HD PRO 11 2HD PRO 11 13.292 -0.818 2.870
97 2HD PRO 11 1HD PRO 11 12.914 -1.920 1.533
98 H ALA 12 H ALA 12 9.062 -3.044 5.405
99 HA ALA 12 HA ALA 12 10.053 -1.271 7.464
100 1HB ALA 12 1HB ALA 12 7.119 -1.190 6.775
101 2HB ALA 12 2HB ALA 12 8.285 0.030 6.264
102 3HB ALA 12 3HB ALA 12 7.968 -0.222 7.980
103 H THR 13 H THR 13 7.252 -1.912 8.772
104 HA THR 13 HA THR 13 7.327 -4.748 9.146
105 HB THR 13 HB THR 13 9.204 -4.273 10.549
106 HG1 THR 13 1HG THR 13 7.146 -4.372 12.452
107 1HG2 THR 13 1HG2 THR 13 9.404 -2.157 11.244
108 2HG2 THR 13 2HG2 THR 13 8.512 -2.737 12.650
109 3HG2 THR 13 3HG2 THR 13 7.661 -1.911 11.345
110 H LEU 14 H LEU 14 5.887 -5.255 11.219
111 HA LEU 14 HA LEU 14 3.457 -3.674 10.837
112 1HB LEU 14 2HB LEU 14 2.535 -5.689 12.300
113 2HB LEU 14 1HB LEU 14 2.719 -5.795 10.563
114 HG LEU 14 HG LEU 14 3.482 -7.806 11.826
115 1HD1 LEU 14 1HD1 LEU 14 5.978 -7.356 10.661
116 2HD1 LEU 14 2HD1 LEU 14 4.836 -6.393 9.722
117 3HD1 LEU 14 3HD1 LEU 14 4.571 -8.124 9.928
118 1HD2 LEU 14 1HD2 LEU 14 5.494 -5.846 12.888
119 2HD2 LEU 14 2HD2 LEU 14 5.810 -7.580 12.832
120 3HD2 LEU 14 3HD2 LEU 14 4.458 -6.959 13.779
121 H ILE 15 H ILE 15 3.700 -1.925 12.143
122 HA ILE 15 HA ILE 15 4.483 -2.250 14.915
123 HB ILE 15 HB ILE 15 3.439 0.316 13.765
124 1HG1 ILE 15 2HG1 ILE 15 6.231 -0.800 13.405
125 2HG1 ILE 15 1HG1 ILE 15 5.056 -0.517 12.124
126 1HG2 ILE 15 1HG2 ILE 15 3.859 0.368 16.103
127 2HG2 ILE 15 2HG2 ILE 15 5.179 1.236 15.319
128 3HG2 ILE 15 3HG2 ILE 15 5.428 -0.409 15.903
129 1HD1 ILE 15 1HD1 ILE 15 5.152 1.874 12.551
130 2HD1 ILE 15 2HD1 ILE 15 6.753 1.224 12.195
131 3HD1 ILE 15 3HD1 ILE 15 6.303 1.601 13.858
132 H LYS 16 H LYS 16 1.724 -0.539 13.431
133 HA LYS 16 HA LYS 16 0.074 -1.457 15.689
134 1HB LYS 16 2HB LYS 16 0.457 1.046 15.322
135 2HB LYS 16 1HB LYS 16 -0.560 0.883 13.897
136 1HG LYS 16 2HG LYS 16 -2.454 0.697 15.104
137 2HG LYS 16 1HG LYS 16 -1.668 -0.209 16.398
138 1HD LYS 16 2HD LYS 16 -1.823 1.677 17.592
139 2HD LYS 16 1HD LYS 16 -0.494 2.270 16.592
140 1HE LYS 16 2HE LYS 16 -1.920 3.951 16.137
141 2HE LYS 16 1HE LYS 16 -2.597 2.803 14.984
142 1HZ LYS 16 1HZ LYS 16 -4.164 2.111 16.758
143 2HZ LYS 16 2HZ LYS 16 -4.366 3.715 16.266
144 3HZ LYS 16 3HZ LYS 16 -3.583 3.372 17.725
145 H ALA 17 H ALA 17 -2.331 -1.596 15.085
146 HA ALA 17 HA ALA 17 -2.510 -3.362 12.798
147 1HB ALA 17 1HB ALA 17 -3.614 -3.498 15.256
148 2HB ALA 17 2HB ALA 17 -4.248 -4.340 13.842
149 3HB ALA 17 3HB ALA 17 -4.951 -2.802 14.341
150 H ILE 18 H ILE 18 -3.952 -3.168 11.095
151 HA ILE 18 HA ILE 18 -4.869 -0.418 10.582
152 HB ILE 18 HB ILE 18 -3.171 -1.103 9.001
153 1HG1 ILE 18 2HG1 ILE 18 -4.401 -0.819 6.892
154 2HG1 ILE 18 1HG1 ILE 18 -5.910 -1.203 7.713
155 1HG2 ILE 18 1HG2 ILE 18 -3.478 -3.535 9.258
156 2HG2 ILE 18 2HG2 ILE 18 -3.394 -3.033 7.571
157 3HG2 ILE 18 3HG2 ILE 18 -4.952 -3.430 8.295
158 1HD1 ILE 18 1HD1 ILE 18 -4.884 0.876 9.198
159 2HD1 ILE 18 2HD1 ILE 18 -6.149 0.983 7.976
160 3HD1 ILE 18 3HD1 ILE 18 -4.471 1.301 7.538
161 H ASP 19 H ASP 19 -6.990 -0.127 10.658
162 HA ASP 19 HA ASP 19 -8.749 -2.392 9.974
163 1HB ASP 19 2HB ASP 19 -8.704 -1.517 12.411
164 2HB ASP 19 1HB ASP 19 -9.585 -0.131 11.775
165 H GLY 20 H GLY 20 -7.635 -0.325 8.200
166 1HA GLY 20 2HA GLY 20 -8.463 0.738 6.319
167 2HA GLY 20 1HA GLY 20 -10.089 0.382 6.879
168 H ASP 21 H ASP 21 -7.581 2.126 8.645
169 HA ASP 21 HA ASP 21 -8.919 4.667 8.168
170 1HB ASP 21 2HB ASP 21 -8.542 3.537 10.951
171 2HB ASP 21 1HB ASP 21 -9.123 5.155 10.573
172 H THR 22 H THR 22 -6.366 3.016 10.026
173 HA THR 22 HA THR 22 -4.377 4.807 8.960
174 HB THR 22 HB THR 22 -3.575 5.560 11.188
175 HG1 THR 22 1HG THR 22 -4.680 3.878 12.371
176 1HG2 THR 22 1HG2 THR 22 -5.096 7.316 11.529
177 2HG2 THR 22 2HG2 THR 22 -6.437 6.390 10.853
178 3HG2 THR 22 3HG2 THR 22 -5.141 6.963 9.802
179 H VAL 23 H VAL 23 -2.365 3.928 8.976
180 HA VAL 23 HA VAL 23 -1.842 1.576 10.632
181 HB VAL 23 HB VAL 23 -2.699 0.696 8.497
182 1HG1 VAL 23 1HG1 VAL 23 -1.533 2.792 7.299
183 2HG1 VAL 23 2HG1 VAL 23 -1.975 1.311 6.452
184 3HG1 VAL 23 3HG1 VAL 23 -0.313 1.557 6.992
185 1HG2 VAL 23 1HG2 VAL 23 0.207 0.090 8.390
186 2HG2 VAL 23 2HG2 VAL 23 -1.178 -1.002 8.381
187 3HG2 VAL 23 3HG2 VAL 23 -0.659 -0.250 9.889
188 H LYS 24 H LYS 24 -0.037 2.057 11.690
189 HA LYS 24 HA LYS 24 1.909 3.865 10.497
190 1HB LYS 24 2HB LYS 24 2.982 3.787 12.745
191 2HB LYS 24 1HB LYS 24 1.315 4.346 12.770
192 1HG LYS 24 2HG LYS 24 0.610 2.608 13.999
193 2HG LYS 24 1HG LYS 24 1.657 1.458 13.164
194 1HD LYS 24 2HD LYS 24 2.378 1.614 15.445
195 2HD LYS 24 1HD LYS 24 3.588 2.399 14.429
196 1HE LYS 24 2HE LYS 24 3.099 4.483 15.217
197 2HE LYS 24 1HE LYS 24 1.410 4.087 15.530
198 1HZ LYS 24 1HZ LYS 24 3.215 4.365 17.447
199 2HZ LYS 24 2HZ LYS 24 3.380 2.706 17.164
200 3HZ LYS 24 3HZ LYS 24 1.873 3.343 17.592
201 H LEU 25 H LEU 25 3.722 3.235 9.561
202 HA LEU 25 HA LEU 25 4.741 0.531 10.125
203 1HB LEU 25 2HB LEU 25 4.785 1.960 7.465
204 2HB LEU 25 1HB LEU 25 5.456 0.374 7.789
205 HG LEU 25 HG LEU 25 2.531 0.951 8.170
206 1HD1 LEU 25 1HD1 LEU 25 3.658 -0.278 5.681
207 2HD1 LEU 25 2HD1 LEU 25 3.425 1.465 5.816
208 3HD1 LEU 25 3HD1 LEU 25 2.046 0.376 5.968
209 1HD2 LEU 25 1HD2 LEU 25 2.919 -1.072 9.158
210 2HD2 LEU 25 2HD2 LEU 25 4.285 -1.449 8.107
211 3HD2 LEU 25 3HD2 LEU 25 2.636 -1.599 7.500
212 H MET 26 H MET 26 7.054 0.265 9.831
213 HA MET 26 HA MET 26 8.510 2.472 10.907
214 1HB MET 26 2HB MET 26 8.894 -0.339 10.605
215 2HB MET 26 1HB MET 26 10.294 0.478 9.925
216 1HG MET 26 2HG MET 26 9.769 1.785 12.337
217 2HG MET 26 1HG MET 26 9.566 0.068 12.674
218 1HE MET 26 1HE MET 26 12.980 -1.428 12.553
219 2HE MET 26 2HE MET 26 11.358 -1.739 11.939
220 3HE MET 26 3HE MET 26 11.584 -1.220 13.610
221 H TYR 27 H TYR 27 8.713 4.183 9.560
222 HA TYR 27 HA TYR 27 10.094 3.699 7.004
223 1HB TYR 27 2HB TYR 27 7.751 4.389 6.634
224 2HB TYR 27 1HB TYR 27 8.042 5.849 7.575
225 HD1 TYR 27 1HD TYR 27 8.210 4.335 4.336
226 HD2 TYR 27 2HD TYR 27 9.791 7.494 6.709
227 HE1 TYR 27 1HE TYR 27 8.948 5.492 2.295
228 HE2 TYR 27 2HE TYR 27 10.533 8.659 4.674
229 HH TYR 27 HH TYR 27 10.883 7.279 1.790
230 H LYS 28 H LYS 28 12.132 4.323 7.302
231 HA LYS 28 HA LYS 28 13.945 5.613 7.765
232 1HB LYS 28 2HB LYS 28 11.767 7.600 7.423
233 2HB LYS 28 1HB LYS 28 13.241 8.168 8.194
234 1HG LYS 28 2HG LYS 28 14.048 6.688 5.947
235 2HG LYS 28 1HG LYS 28 12.705 7.706 5.423
236 1HD LYS 28 2HD LYS 28 14.431 9.170 5.118
237 2HD LYS 28 1HD LYS 28 14.033 9.537 6.797
238 1HE LYS 28 2HE LYS 28 15.936 8.602 7.595
239 2HE LYS 28 1HE LYS 28 15.970 7.352 6.353
240 1HZ LYS 28 1HZ LYS 28 17.755 9.157 6.295
241 2HZ LYS 28 2HZ LYS 28 16.543 10.172 5.689
242 3HZ LYS 28 3HZ LYS 28 16.979 8.774 4.840
243 H GLY 29 H GLY 29 12.246 4.401 9.932
244 1HA GLY 29 2HA GLY 29 12.805 4.167 12.198
245 2HA GLY 29 1HA GLY 29 13.619 5.722 12.135
246 H GLN 30 H GLN 30 10.949 6.619 10.727
247 HA GLN 30 HA GLN 30 9.560 7.158 13.267
248 1HB GLN 30 2HB GLN 30 10.556 8.961 11.451
249 2HB GLN 30 1HB GLN 30 8.867 8.856 10.976
250 1HG GLN 30 2HG GLN 30 8.116 9.797 12.905
251 2HG GLN 30 1HG GLN 30 9.472 9.193 13.857
252 1HE2 GLN 30 1HE2 GLN 30 8.314 11.719 11.791
253 2HE2 GLN 30 2HE2 GLN 30 9.613 12.824 12.064
254 HA PRO 31 HA PRO 31 6.066 4.930 11.708
255 1HB PRO 31 2HB PRO 31 4.119 5.949 13.274
256 2HB PRO 31 1HB PRO 31 5.364 4.864 13.904
257 1HG PRO 31 2HG PRO 31 5.194 7.849 14.063
258 2HG PRO 31 1HG PRO 31 5.654 6.686 15.321
259 1HD PRO 31 2HD PRO 31 7.470 8.112 13.879
260 2HD PRO 31 1HD PRO 31 7.806 6.496 14.532
261 H MET 32 H MET 32 4.270 5.161 10.357
262 HA MET 32 HA MET 32 3.388 7.855 9.668
263 1HB MET 32 2HB MET 32 5.138 6.231 8.018
264 2HB MET 32 1HB MET 32 3.642 6.621 7.180
265 1HG MET 32 2HG MET 32 5.146 8.779 8.579
266 2HG MET 32 1HG MET 32 5.707 8.196 7.014
267 1HE MET 32 1HE MET 32 3.518 9.673 4.479
268 2HE MET 32 2HE MET 32 3.382 7.969 4.911
269 3HE MET 32 3HE MET 32 4.956 8.764 4.944
270 H THR 33 H THR 33 1.254 7.771 9.873
271 HA THR 33 HA THR 33 -0.175 5.283 9.422
272 HB THR 33 HB THR 33 -2.142 6.603 10.275
273 HG1 THR 33 1HG THR 33 -0.212 8.562 10.928
274 1HG2 THR 33 1HG2 THR 33 -0.610 5.267 11.770
275 2HG2 THR 33 2HG2 THR 33 -1.540 6.552 12.540
276 3HG2 THR 33 3HG2 THR 33 0.169 6.796 12.175
277 H PHE 34 H PHE 34 -0.016 5.107 7.161
278 HA PHE 34 HA PHE 34 -1.972 6.744 5.728
279 1HB PHE 34 2HB PHE 34 -0.497 7.021 3.807
280 2HB PHE 34 1HB PHE 34 0.222 7.751 5.237
281 HD1 PHE 34 1HD PHE 34 0.946 5.918 2.430
282 HD2 PHE 34 2HD PHE 34 1.713 5.936 6.613
283 HE1 PHE 34 1HE PHE 34 2.990 4.606 2.055
284 HE2 PHE 34 2HE PHE 34 3.760 4.622 6.248
285 HZ PHE 34 HZ PHE 34 4.401 3.957 3.966
286 H ARG 35 H ARG 35 -3.405 5.375 4.852
287 HA ARG 35 HA ARG 35 -2.423 2.891 3.664
288 1HB ARG 35 2HB ARG 35 -3.719 1.461 4.897
289 2HB ARG 35 1HB ARG 35 -3.361 2.677 6.109
290 1HG ARG 35 2HG ARG 35 -5.897 2.582 4.486
291 2HG ARG 35 1HG ARG 35 -5.714 1.928 6.111
292 1HD ARG 35 2HD ARG 35 -5.547 4.007 7.081
293 2HD ARG 35 1HD ARG 35 -4.972 4.767 5.600
294 HE ARG 35 HE ARG 35 -7.679 3.816 5.439
295 1HH1 ARG 35 1HH1 ARG 35 -5.627 6.485 6.366
296 2HH1 ARG 35 2HH1 ARG 35 -6.878 7.670 6.194
297 1HH2 ARG 35 1HH2 ARG 35 -9.326 5.376 5.212
298 2HH2 ARG 35 2HH2 ARG 35 -8.977 7.041 5.540
299 H LEU 36 H LEU 36 -3.113 2.704 1.669
300 HA LEU 36 HA LEU 36 -5.861 3.398 0.995
301 1HB LEU 36 2HB LEU 36 -4.206 5.329 0.472
302 2HB LEU 36 1HB LEU 36 -3.680 4.302 -0.848
303 HG LEU 36 HG LEU 36 -6.556 4.516 -0.844
304 1HD1 LEU 36 1HD1 LEU 36 -5.507 6.801 0.165
305 2HD1 LEU 36 2HD1 LEU 36 -6.987 6.715 -0.787
306 3HD1 LEU 36 3HD1 LEU 36 -5.463 7.140 -1.565
307 1HD2 LEU 36 1HD2 LEU 36 -4.604 4.076 -2.656
308 2HD2 LEU 36 2HD2 LEU 36 -4.964 5.772 -2.975
309 3HD2 LEU 36 3HD2 LEU 36 -6.246 4.566 -3.072
310 H LEU 37 H LEU 37 -6.695 2.213 -0.748
311 HA LEU 37 HA LEU 37 -4.904 0.332 -2.080
312 1HB LEU 37 2HB LEU 37 -6.523 -1.533 -1.607
313 2HB LEU 37 1HB LEU 37 -5.567 -0.987 -0.241
314 HG LEU 37 HG LEU 37 -8.287 0.176 -0.627
315 1HD1 LEU 37 1HD1 LEU 37 -7.699 -2.593 0.391
316 2HD1 LEU 37 2HD1 LEU 37 -8.810 -2.120 -0.894
317 3HD1 LEU 37 3HD1 LEU 37 -9.175 -1.710 0.782
318 1HD2 LEU 37 1HD2 LEU 37 -8.177 0.012 1.898
319 2HD2 LEU 37 2HD2 LEU 37 -7.039 1.123 1.136
320 3HD2 LEU 37 3HD2 LEU 37 -6.488 -0.454 1.698
321 H LEU 38 H LEU 38 -5.451 -0.080 -4.142
322 HA LEU 38 HA LEU 38 -7.336 1.504 -5.467
323 1HB LEU 38 2HB LEU 38 -5.265 0.119 -6.321
324 2HB LEU 38 1HB LEU 38 -6.476 -1.115 -6.616
325 HG LEU 38 HG LEU 38 -6.829 1.658 -7.706
326 1HD1 LEU 38 1HD1 LEU 38 -5.084 -0.537 -8.757
327 2HD1 LEU 38 2HD1 LEU 38 -4.740 1.186 -8.612
328 3HD1 LEU 38 3HD1 LEU 38 -5.860 0.612 -9.847
329 1HD2 LEU 38 1HD2 LEU 38 -7.858 -0.025 -9.518
330 2HD2 LEU 38 2HD2 LEU 38 -8.778 0.596 -8.146
331 3HD2 LEU 38 3HD2 LEU 38 -8.048 -1.009 -8.066
332 H VAL 39 H VAL 39 -9.403 1.363 -4.711
333 HA VAL 39 HA VAL 39 -10.751 -1.227 -5.102
334 HB VAL 39 HB VAL 39 -12.334 -0.472 -3.261
335 1HG1 VAL 39 1HG1 VAL 39 -11.019 -2.265 -2.663
336 2HG1 VAL 39 2HG1 VAL 39 -10.550 -1.070 -1.453
337 3HG1 VAL 39 3HG1 VAL 39 -9.516 -1.363 -2.851
338 1HG2 VAL 39 1HG2 VAL 39 -11.919 1.339 -1.981
339 2HG2 VAL 39 2HG2 VAL 39 -11.032 1.886 -3.403
340 3HG2 VAL 39 3HG2 VAL 39 -10.171 1.129 -2.064
341 H ASP 40 H ASP 40 -12.290 -1.136 -6.592
342 HA ASP 40 HA ASP 40 -13.817 1.347 -6.918
343 1HB ASP 40 2HB ASP 40 -11.895 0.882 -8.669
344 2HB ASP 40 1HB ASP 40 -13.085 -0.217 -9.359
345 H THR 41 H THR 41 -15.956 1.034 -7.032
346 HA THR 41 HA THR 41 -16.906 -1.729 -7.304
347 HB THR 41 HB THR 41 -18.131 0.679 -5.956
348 HG1 THR 41 1HG THR 41 -17.239 -0.179 -4.286
349 1HG2 THR 41 1HG2 THR 41 -19.977 -0.713 -5.263
350 2HG2 THR 41 2HG2 THR 41 -19.345 -2.063 -6.204
351 3HG2 THR 41 3HG2 THR 41 -19.922 -0.612 -7.022
352 HA PRO 42 HA PRO 42 -18.400 -0.601 -11.374
353 1HB PRO 42 2HB PRO 42 -20.146 -2.963 -10.914
354 2HB PRO 42 1HB PRO 42 -19.072 -2.603 -12.271
355 1HG PRO 42 2HG PRO 42 -18.404 -4.431 -10.453
356 2HG PRO 42 1HG PRO 42 -17.186 -3.344 -11.147
357 1HD PRO 42 2HD PRO 42 -18.505 -3.249 -8.467
358 2HD PRO 42 1HD PRO 42 -16.827 -2.877 -8.915
359 H GLU 43 H GLU 43 -20.033 0.674 -12.023
360 HA GLU 43 HA GLU 43 -22.720 0.462 -11.350
361 1HB GLU 43 2HB GLU 43 -21.343 1.352 -9.146
362 2HB GLU 43 1HB GLU 43 -21.861 2.860 -9.885
363 1HG GLU 43 2HG GLU 43 -24.090 2.409 -9.569
364 2HG GLU 43 1HG GLU 43 -23.838 0.665 -9.507
365 H THR 44 H THR 44 -23.630 3.033 -11.400
366 HA THR 44 HA THR 44 -23.310 3.764 -14.090
367 HB THR 44 HB THR 44 -24.478 5.894 -13.383
368 HG1 THR 44 1HG THR 44 -23.588 5.766 -11.190
369 1HG2 THR 44 1HG2 THR 44 -26.556 4.931 -13.122
370 2HG2 THR 44 2HG2 THR 44 -25.927 3.575 -12.187
371 3HG2 THR 44 3HG2 THR 44 -25.638 3.657 -13.926
372 H LYS 45 H LYS 45 -22.075 5.299 -15.109
373 HA LYS 45 HA LYS 45 -20.317 6.696 -15.481
374 1HB LYS 45 2HB LYS 45 -21.591 7.652 -13.099
375 2HB LYS 45 1HB LYS 45 -19.857 7.861 -12.924
376 1HG LYS 45 2HG LYS 45 -20.053 8.866 -15.341
377 2HG LYS 45 1HG LYS 45 -21.735 9.107 -14.865
378 1HD LYS 45 2HD LYS 45 -19.700 9.937 -12.895
379 2HD LYS 45 1HD LYS 45 -19.772 10.888 -14.380
380 1HE LYS 45 2HE LYS 45 -21.987 10.382 -12.404
381 2HE LYS 45 1HE LYS 45 -21.219 11.920 -12.792
382 1HZ LYS 45 1HZ LYS 45 -23.335 10.523 -14.163
383 2HZ LYS 45 2HZ LYS 45 -22.128 11.107 -15.192
384 3HZ LYS 45 3HZ LYS 45 -22.947 12.170 -14.164
385 H HIS 46 H HIS 46 -18.197 7.465 -13.700
386 HA HIS 46 HA HIS 46 -16.946 4.830 -13.298
387 1HB HIS 46 2HB HIS 46 -16.075 6.857 -14.901
388 2HB HIS 46 1HB HIS 46 -15.186 7.191 -13.418
389 HD1 HIS 46 1HD HIS 46 -13.202 6.535 -15.259
390 HD2 HIS 46 2HD HIS 46 -15.510 3.463 -13.680
391 HE1 HIS 46 1HE HIS 46 -11.877 4.432 -15.646
392 HE2 HIS 46 2HE HIS 46 -13.339 2.576 -14.771
393 HA PRO 47 HA PRO 47 -17.133 6.635 -9.066
394 1HB PRO 47 2HB PRO 47 -18.284 4.585 -7.814
395 2HB PRO 47 1HB PRO 47 -19.244 5.689 -8.808
396 1HG PRO 47 2HG PRO 47 -18.213 2.956 -9.462
397 2HG PRO 47 1HG PRO 47 -19.796 3.672 -9.818
398 1HD PRO 47 2HD PRO 47 -17.698 3.510 -11.617
399 2HD PRO 47 1HD PRO 47 -19.042 4.664 -11.727
400 H LYS 48 H LYS 48 -15.883 6.121 -7.224
401 HA LYS 48 HA LYS 48 -14.079 3.815 -7.518
402 1HB LYS 48 2HB LYS 48 -13.408 6.618 -7.507
403 2HB LYS 48 1HB LYS 48 -12.667 5.817 -6.128
404 1HG LYS 48 2HG LYS 48 -11.745 4.120 -7.714
405 2HG LYS 48 1HG LYS 48 -12.342 5.124 -9.036
406 1HD LYS 48 2HD LYS 48 -10.991 6.953 -7.547
407 2HD LYS 48 1HD LYS 48 -10.024 5.503 -7.270
408 1HE LYS 48 2HE LYS 48 -10.376 5.327 -9.931
409 2HE LYS 48 1HE LYS 48 -10.432 7.078 -9.736
410 1HZ LYS 48 1HZ LYS 48 -8.265 7.175 -9.183
411 2HZ LYS 48 2HZ LYS 48 -8.177 5.718 -10.038
412 3HZ LYS 48 3HZ LYS 48 -8.279 5.702 -8.351
413 H LYS 49 H LYS 49 -15.041 2.530 -5.992
414 HA LYS 49 HA LYS 49 -14.522 3.178 -3.248
415 1HB LYS 49 2HB LYS 49 -16.733 4.327 -3.802
416 2HB LYS 49 1HB LYS 49 -17.414 2.716 -3.967
417 1HG LYS 49 2HG LYS 49 -17.589 2.451 -1.766
418 2HG LYS 49 1HG LYS 49 -15.952 3.044 -1.482
419 1HD LYS 49 2HD LYS 49 -16.819 4.919 -0.660
420 2HD LYS 49 1HD LYS 49 -17.483 5.278 -2.256
421 1HE LYS 49 2HE LYS 49 -19.429 5.278 -1.094
422 2HE LYS 49 1HE LYS 49 -19.332 3.547 -1.414
423 1HZ LYS 49 1HZ LYS 49 -19.719 3.579 0.828
424 2HZ LYS 49 2HZ LYS 49 -18.839 5.001 1.089
425 3HZ LYS 49 3HZ LYS 49 -18.027 3.542 0.818
426 H GLY 50 H GLY 50 -14.883 1.378 -1.819
427 1HA GLY 50 2HA GLY 50 -15.912 -1.108 -2.672
428 2HA GLY 50 1HA GLY 50 -14.171 -1.096 -2.905
429 H VAL 51 H VAL 51 -15.800 0.611 -0.311
430 HA VAL 51 HA VAL 51 -14.666 -1.329 1.596
431 HB VAL 51 HB VAL 51 -13.405 0.757 1.670
432 1HG1 VAL 51 1HG1 VAL 51 -14.299 2.807 1.626
433 2HG1 VAL 51 2HG1 VAL 51 -15.542 2.393 2.805
434 3HG1 VAL 51 3HG1 VAL 51 -15.776 1.996 1.104
435 1HG2 VAL 51 1HG2 VAL 51 -15.181 0.382 4.080
436 2HG2 VAL 51 2HG2 VAL 51 -13.646 1.250 4.062
437 3HG2 VAL 51 3HG2 VAL 51 -13.684 -0.483 3.741
438 H GLU 52 H GLU 52 -16.690 -2.437 1.609
439 HA GLU 52 HA GLU 52 -18.972 -0.977 2.709
440 1HB GLU 52 2HB GLU 52 -18.976 -2.736 0.728
441 2HB GLU 52 1HB GLU 52 -19.097 -3.885 2.053
442 1HG GLU 52 2HG GLU 52 -20.975 -1.866 2.582
443 2HG GLU 52 1HG GLU 52 -21.130 -2.262 0.871
444 H LYS 53 H LYS 53 -19.841 -1.372 4.696
445 HA LYS 53 HA LYS 53 -18.195 -2.316 6.743
446 1HB LYS 53 2HB LYS 53 -20.654 -1.017 6.568
447 2HB LYS 53 1HB LYS 53 -21.022 -2.522 7.399
448 1HG LYS 53 2HG LYS 53 -20.185 -1.730 9.286
449 2HG LYS 53 1HG LYS 53 -18.640 -1.398 8.504
450 1HD LYS 53 2HD LYS 53 -19.143 0.798 8.134
451 2HD LYS 53 1HD LYS 53 -20.875 0.487 7.988
452 1HE LYS 53 2HE LYS 53 -20.979 1.424 10.028
453 2HE LYS 53 1HE LYS 53 -20.450 -0.163 10.585
454 1HZ LYS 53 1HZ LYS 53 -18.304 0.568 10.906
455 2HZ LYS 53 2HZ LYS 53 -19.192 1.936 11.356
456 3HZ LYS 53 3HZ LYS 53 -18.456 1.869 9.835
457 H TYR 54 H TYR 54 -17.420 -4.371 6.278
458 HA TYR 54 HA TYR 54 -19.384 -6.528 6.652
459 1HB TYR 54 2HB TYR 54 -17.700 -7.862 5.125
460 2HB TYR 54 1HB TYR 54 -18.969 -6.874 4.412
461 HD1 TYR 54 1HD TYR 54 -15.708 -5.830 5.881
462 HD2 TYR 54 2HD TYR 54 -18.098 -6.155 2.377
463 HE1 TYR 54 1HE TYR 54 -14.015 -4.575 4.617
464 HE2 TYR 54 2HE TYR 54 -16.409 -4.901 1.102
465 HH TYR 54 HH TYR 54 -13.813 -3.252 2.620
466 H GLY 55 H GLY 55 -17.486 -5.131 8.473
467 1HA GLY 55 2HA GLY 55 -16.299 -5.816 10.327
468 2HA GLY 55 1HA GLY 55 -16.497 -7.475 9.784
469 HA PRO 56 HA PRO 56 -12.025 -6.631 9.301
470 1HB PRO 56 2HB PRO 56 -11.199 -9.131 9.880
471 2HB PRO 56 1HB PRO 56 -11.634 -7.967 11.136
472 1HG PRO 56 2HG PRO 56 -13.254 -10.208 9.991
473 2HG PRO 56 1HG PRO 56 -13.064 -9.719 11.684
474 1HD PRO 56 2HD PRO 56 -15.223 -9.037 10.177
475 2HD PRO 56 1HD PRO 56 -14.607 -8.025 11.499
476 H GLU 57 H GLU 57 -14.270 -8.409 7.553
477 HA GLU 57 HA GLU 57 -12.964 -10.126 5.908
478 1HB GLU 57 2HB GLU 57 -15.172 -8.168 5.369
479 2HB GLU 57 1HB GLU 57 -14.542 -9.169 4.067
480 1HG GLU 57 2HG GLU 57 -15.171 -10.664 6.492
481 2HG GLU 57 1HG GLU 57 -16.561 -9.854 5.771
482 H ALA 58 H ALA 58 -12.686 -6.642 5.907
483 HA ALA 58 HA ALA 58 -11.358 -6.448 3.384
484 1HB ALA 58 1HB ALA 58 -12.190 -4.401 3.836
485 2HB ALA 58 2HB ALA 58 -10.635 -4.173 4.634
486 3HB ALA 58 3HB ALA 58 -12.055 -4.613 5.582
487 H SER 59 H SER 59 -10.163 -5.941 6.710
488 HA SER 59 HA SER 59 -7.441 -5.925 6.020
489 1HB SER 59 2HB SER 59 -7.097 -6.417 8.491
490 2HB SER 59 1HB SER 59 -8.066 -4.989 8.121
491 HG SER 59 HG SER 59 -9.414 -5.927 9.450
492 H ALA 60 H ALA 60 -9.664 -8.517 6.319
493 HA ALA 60 HA ALA 60 -8.135 -10.644 7.166
494 1HB ALA 60 1HB ALA 60 -10.478 -10.343 5.390
495 2HB ALA 60 2HB ALA 60 -10.270 -11.320 6.844
496 3HB ALA 60 3HB ALA 60 -9.610 -11.875 5.305
497 H PHE 61 H PHE 61 -7.995 -8.941 4.126
498 HA PHE 61 HA PHE 61 -6.657 -10.848 2.572
499 1HB PHE 61 2HB PHE 61 -7.005 -7.901 2.487
500 2HB PHE 61 1HB PHE 61 -5.664 -8.564 1.555
501 HD1 PHE 61 1HD PHE 61 -9.242 -8.143 1.771
502 HD2 PHE 61 2HD PHE 61 -6.118 -10.227 -0.231
503 HE1 PHE 61 1HE PHE 61 -10.800 -8.732 -0.039
504 HE2 PHE 61 2HE PHE 61 -7.672 -10.818 -2.047
505 HZ PHE 61 HZ PHE 61 -10.016 -10.072 -1.951
506 H THR 62 H THR 62 -5.200 -8.012 4.179
507 HA THR 62 HA THR 62 -2.548 -8.960 3.890
508 HB THR 62 HB THR 62 -2.305 -7.190 5.908
509 HG1 THR 62 1HG THR 62 -4.539 -6.924 6.156
510 1HG2 THR 62 1HG2 THR 62 -1.254 -6.199 4.233
511 2HG2 THR 62 2HG2 THR 62 -2.804 -5.495 3.775
512 3HG2 THR 62 3HG2 THR 62 -2.267 -7.001 3.034
513 H LYS 63 H LYS 63 -4.950 -9.248 6.427
514 HA LYS 63 HA LYS 63 -3.433 -10.081 8.566
515 1HB LYS 63 2HB LYS 63 -6.208 -10.739 7.658
516 2HB LYS 63 1HB LYS 63 -5.534 -11.563 9.057
517 1HG LYS 63 2HG LYS 63 -4.964 -9.063 9.761
518 2HG LYS 63 1HG LYS 63 -6.357 -8.741 8.728
519 1HD LYS 63 2HD LYS 63 -7.745 -10.190 10.043
520 2HD LYS 63 1HD LYS 63 -6.357 -10.738 10.986
521 1HE LYS 63 2HE LYS 63 -6.785 -7.830 10.959
522 2HE LYS 63 1HE LYS 63 -8.053 -8.764 11.750
523 1HZ LYS 63 1HZ LYS 63 -6.692 -9.362 13.423
524 2HZ LYS 63 2HZ LYS 63 -5.846 -7.965 12.983
525 3HZ LYS 63 3HZ LYS 63 -5.321 -9.478 12.438
526 H LYS 64 H LYS 64 -3.934 -11.723 5.590
527 HA LYS 64 HA LYS 64 -3.361 -14.356 6.608
528 1HB LYS 64 2HB LYS 64 -3.576 -13.262 3.801
529 2HB LYS 64 1HB LYS 64 -3.253 -14.952 4.166
530 1HG LYS 64 2HG LYS 64 -5.476 -14.498 5.663
531 2HG LYS 64 1HG LYS 64 -5.759 -13.440 4.278
532 1HD LYS 64 2HD LYS 64 -5.166 -15.454 2.830
533 2HD LYS 64 1HD LYS 64 -5.321 -16.416 4.302
534 1HE LYS 64 2HE LYS 64 -7.595 -16.018 4.478
535 2HE LYS 64 1HE LYS 64 -7.517 -14.556 3.494
536 1HZ LYS 64 1HZ LYS 64 -8.560 -16.472 2.363
537 2HZ LYS 64 2HZ LYS 64 -7.085 -17.297 2.439
538 3HZ LYS 64 3HZ LYS 64 -7.209 -15.869 1.539
539 H MET 65 H MET 65 -1.671 -12.252 4.269
540 HA MET 65 HA MET 65 0.808 -13.681 4.774
541 1HB MET 65 2HB MET 65 0.197 -11.399 2.886
542 2HB MET 65 1HB MET 65 1.718 -12.277 2.958
543 1HG MET 65 2HG MET 65 -0.754 -13.855 2.546
544 2HG MET 65 1HG MET 65 -0.184 -12.856 1.209
545 1HE MET 65 1HE MET 65 -0.680 -15.890 1.994
546 2HE MET 65 2HE MET 65 0.741 -16.933 1.945
547 3HE MET 65 3HE MET 65 0.088 -16.259 0.450
548 H TRP 66 H TRP 66 -0.312 -10.302 4.900
549 HA TRP 66 HA TRP 66 1.962 -9.148 5.953
550 1HB TRP 66 2HB TRP 66 -0.034 -7.913 5.132
551 2HB TRP 66 1HB TRP 66 -0.883 -8.368 6.604
552 HD1 TRP 66 HD TRP 66 2.140 -6.240 5.481
553 HE1 TRP 66 1HE TRP 66 2.498 -4.384 7.229
554 HE3 TRP 66 3HE TRP 66 -1.358 -7.679 8.919
555 HZ2 TRP 66 2HZ TRP 66 1.437 -3.632 9.735
556 HZ3 TRP 66 3HZ TRP 66 -1.625 -6.336 10.964
557 HH2 TRP 66 HH TRP 66 -0.254 -4.355 11.363
558 H GLU 67 H GLU 67 -0.418 -11.126 7.555
559 HA GLU 67 HA GLU 67 0.620 -10.413 10.187
560 1HB GLU 67 2HB GLU 67 -1.896 -10.935 9.400
561 2HB GLU 67 1HB GLU 67 -1.417 -12.542 9.929
562 1HG GLU 67 2HG GLU 67 -0.564 -11.168 12.034
563 2HG GLU 67 1HG GLU 67 -1.832 -10.067 11.496
564 H ASN 68 H ASN 68 0.038 -13.454 8.385
565 HA ASN 68 HA ASN 68 1.704 -14.929 10.211
566 1HB ASN 68 2HB ASN 68 0.375 -15.733 7.618
567 2HB ASN 68 1HB ASN 68 1.262 -16.839 8.660
568 1HD2 ASN 68 1HD2 ASN 68 0.214 -17.793 10.269
569 2HD2 ASN 68 2HD2 ASN 68 -1.377 -17.391 10.805
570 H ALA 69 H ALA 69 2.133 -13.407 7.110
571 HA ALA 69 HA ALA 69 4.798 -14.621 6.864
572 1HB ALA 69 1HB ALA 69 3.260 -14.804 4.920
573 2HB ALA 69 2HB ALA 69 4.771 -13.975 4.552
574 3HB ALA 69 3HB ALA 69 3.291 -13.047 4.782
575 H LYS 70 H LYS 70 6.642 -13.366 6.716
576 HA LYS 70 HA LYS 70 6.342 -10.643 7.739
577 1HB LYS 70 2HB LYS 70 8.532 -12.668 7.758
578 2HB LYS 70 1HB LYS 70 8.971 -10.968 7.838
579 1HG LYS 70 2HG LYS 70 6.976 -12.193 9.714
580 2HG LYS 70 1HG LYS 70 8.710 -12.200 10.038
581 1HD LYS 70 2HD LYS 70 7.517 -9.602 9.279
582 2HD LYS 70 1HD LYS 70 7.065 -10.244 10.859
583 1HE LYS 70 2HE LYS 70 9.503 -10.541 11.339
584 2HE LYS 70 1HE LYS 70 9.844 -9.683 9.838
585 1HZ LYS 70 1HZ LYS 70 9.262 -7.712 10.728
586 2HZ LYS 70 2HZ LYS 70 9.639 -8.477 12.189
587 3HZ LYS 70 3HZ LYS 70 8.028 -8.363 11.686
588 H LYS 71 H LYS 71 5.797 -9.473 5.920
589 HA LYS 71 HA LYS 71 7.979 -8.707 4.237
590 1HB LYS 71 2HB LYS 71 6.881 -9.256 2.111
591 2HB LYS 71 1HB LYS 71 7.244 -10.703 3.034
592 1HG LYS 71 2HG LYS 71 4.607 -9.747 3.664
593 2HG LYS 71 1HG LYS 71 4.790 -9.957 1.923
594 1HD LYS 71 2HD LYS 71 5.631 -12.074 3.886
595 2HD LYS 71 1HD LYS 71 3.982 -11.971 3.264
596 1HE LYS 71 2HE LYS 71 6.356 -12.049 1.429
597 2HE LYS 71 1HE LYS 71 5.630 -13.527 2.062
598 1HZ LYS 71 1HZ LYS 71 3.811 -11.593 0.868
599 2HZ LYS 71 2HZ LYS 71 3.799 -13.282 0.788
600 3HZ LYS 71 3HZ LYS 71 4.852 -12.398 -0.196
601 H ILE 72 H ILE 72 7.654 -6.611 4.876
602 HA ILE 72 HA ILE 72 5.192 -5.366 3.898
603 HB ILE 72 HB ILE 72 6.320 -4.591 6.574
604 1HG1 ILE 72 2HG1 ILE 72 4.069 -5.833 7.287
605 2HG1 ILE 72 1HG1 ILE 72 4.441 -6.791 5.858
606 1HG2 ILE 72 1HG2 ILE 72 3.602 -4.145 5.352
607 2HG2 ILE 72 2HG2 ILE 72 4.921 -2.978 5.307
608 3HG2 ILE 72 3HG2 ILE 72 4.221 -3.456 6.853
609 1HD1 ILE 72 1HD1 ILE 72 6.203 -6.392 8.262
610 2HD1 ILE 72 2HD1 ILE 72 6.661 -7.278 6.807
611 3HD1 ILE 72 3HD1 ILE 72 5.334 -7.859 7.813
612 H GLU 73 H GLU 73 5.475 -3.507 2.899
613 HA GLU 73 HA GLU 73 7.824 -1.874 3.395
614 1HB GLU 73 2HB GLU 73 7.186 -2.588 0.551
615 2HB GLU 73 1HB GLU 73 8.654 -1.878 1.201
616 1HG GLU 73 2HG GLU 73 8.873 -4.140 2.457
617 2HG GLU 73 1HG GLU 73 7.751 -4.720 1.229
618 H VAL 74 H VAL 74 7.681 0.194 2.023
619 HA VAL 74 HA VAL 74 4.868 1.057 2.039
620 HB VAL 74 HB VAL 74 5.735 3.352 2.297
621 1HG1 VAL 74 1HG1 VAL 74 6.467 3.120 4.620
622 2HG1 VAL 74 2HG1 VAL 74 6.748 1.399 4.361
623 3HG1 VAL 74 3HG1 VAL 74 5.112 2.050 4.260
624 1HG2 VAL 74 1HG2 VAL 74 8.170 2.175 1.502
625 2HG2 VAL 74 2HG2 VAL 74 8.394 2.734 3.158
626 3HG2 VAL 74 3HG2 VAL 74 7.863 3.861 1.911
627 H GLU 75 H GLU 75 3.924 1.795 0.245
628 HA GLU 75 HA GLU 75 5.473 1.786 -2.225
629 1HB GLU 75 2HB GLU 75 3.003 0.822 -1.664
630 2HB GLU 75 1HB GLU 75 2.582 2.400 -2.314
631 1HG GLU 75 2HG GLU 75 4.288 1.641 -4.203
632 2HG GLU 75 1HG GLU 75 3.775 0.047 -3.652
633 H PHE 76 H PHE 76 3.938 3.546 -3.759
634 HA PHE 76 HA PHE 76 4.963 6.091 -2.773
635 1HB PHE 76 2HB PHE 76 4.389 6.879 -5.100
636 2HB PHE 76 1HB PHE 76 5.591 5.596 -5.023
637 HD1 PHE 76 1HD PHE 76 1.961 6.185 -5.545
638 HD2 PHE 76 2HD PHE 76 5.308 3.656 -6.260
639 HE1 PHE 76 1HE PHE 76 0.601 4.829 -7.084
640 HE2 PHE 76 2HE PHE 76 3.955 2.296 -7.802
641 HZ PHE 76 HZ PHE 76 1.599 2.882 -8.215
642 H ASP 77 H ASP 77 3.730 7.807 -2.220
643 HA ASP 77 HA ASP 77 0.825 7.376 -2.154
644 1HB ASP 77 2HB ASP 77 0.814 9.138 -0.402
645 2HB ASP 77 1HB ASP 77 1.804 7.748 0.033
646 H LYS 78 H LYS 78 -0.553 9.305 -2.453
647 HA LYS 78 HA LYS 78 -0.092 10.533 -4.920
648 1HB LYS 78 2HB LYS 78 -2.292 10.210 -3.551
649 2HB LYS 78 1HB LYS 78 -1.888 11.779 -2.868
650 1HG LYS 78 2HG LYS 78 -1.693 12.556 -5.311
651 2HG LYS 78 1HG LYS 78 -2.579 11.079 -5.693
652 1HD LYS 78 2HD LYS 78 -3.530 13.125 -3.695
653 2HD LYS 78 1HD LYS 78 -4.000 13.129 -5.395
654 1HE LYS 78 2HE LYS 78 -5.295 11.254 -5.187
655 2HE LYS 78 1HE LYS 78 -4.337 10.611 -3.853
656 1HZ LYS 78 1HZ LYS 78 -5.353 12.111 -2.349
657 2HZ LYS 78 2HZ LYS 78 -6.605 11.404 -3.241
658 3HZ LYS 78 3HZ LYS 78 -6.101 12.980 -3.594
659 H GLY 79 H GLY 79 -0.279 12.219 -1.776
660 1HA GLY 79 2HA GLY 79 1.266 13.779 -0.934
661 2HA GLY 79 1HA GLY 79 2.058 13.809 -2.503
662 H GLN 80 H GLN 80 -1.397 14.159 -2.214
663 HA GLN 80 HA GLN 80 -1.135 17.048 -2.710
664 1HB GLN 80 2HB GLN 80 -1.662 15.577 -4.767
665 2HB GLN 80 1HB GLN 80 -3.254 15.384 -4.045
666 1HG GLN 80 2HG GLN 80 -2.235 18.144 -4.306
667 2HG GLN 80 1HG GLN 80 -2.667 17.305 -5.795
668 1HE2 GLN 80 1HE2 GLN 80 -4.834 16.326 -5.853
669 2HE2 GLN 80 2HE2 GLN 80 -6.127 17.149 -5.057
670 H ARG 81 H ARG 81 -3.517 14.500 -1.966
671 HA ARG 81 HA ARG 81 -5.000 16.421 -0.329
672 1HB ARG 81 2HB ARG 81 -5.700 14.049 -1.886
673 2HB ARG 81 1HB ARG 81 -6.422 14.048 -0.282
674 1HG ARG 81 2HG ARG 81 -6.664 16.268 -2.304
675 2HG ARG 81 1HG ARG 81 -7.892 15.048 -1.959
676 1HD ARG 81 2HD ARG 81 -7.315 16.052 0.532
677 2HD ARG 81 1HD ARG 81 -7.195 17.477 -0.498
678 HE ARG 81 HE ARG 81 -9.561 15.933 -0.984
679 1HH1 ARG 81 1HH1 ARG 81 -8.146 18.396 1.041
680 2HH1 ARG 81 2HH1 ARG 81 -9.671 19.094 1.472
681 1HH2 ARG 81 1HH2 ARG 81 -11.568 16.848 -0.418
682 2HH2 ARG 81 2HH2 ARG 81 -11.614 18.216 0.644
683 H THR 82 H THR 82 -3.937 16.548 1.592
684 HA THR 82 HA THR 82 -3.019 14.163 2.948
685 HB THR 82 HB THR 82 -1.936 15.565 4.440
686 HG1 THR 82 1HG THR 82 -3.724 17.671 3.817
687 1HG2 THR 82 1HG2 THR 82 -1.151 16.048 2.133
688 2HG2 THR 82 2HG2 THR 82 -0.908 17.371 3.274
689 3HG2 THR 82 3HG2 THR 82 -2.231 17.442 2.109
690 H ASP 83 H ASP 83 -3.586 13.998 5.379
691 HA ASP 83 HA ASP 83 -6.505 14.316 5.627
692 1HB ASP 83 2HB ASP 83 -4.842 12.004 5.892
693 2HB ASP 83 1HB ASP 83 -5.582 12.346 7.452
694 H LYS 84 H LYS 84 -3.533 14.118 7.626
695 HA LYS 84 HA LYS 84 -4.924 15.790 9.611
696 1HB LYS 84 2HB LYS 84 -4.098 13.492 10.287
697 2HB LYS 84 1HB LYS 84 -2.467 14.123 10.111
698 1HG LYS 84 2HG LYS 84 -2.670 15.527 11.932
699 2HG LYS 84 1HG LYS 84 -4.433 15.540 11.855
700 1HD LYS 84 2HD LYS 84 -4.349 13.091 12.475
701 2HD LYS 84 1HD LYS 84 -2.633 13.324 12.813
702 1HE LYS 84 2HE LYS 84 -4.842 14.931 14.088
703 2HE LYS 84 1HE LYS 84 -4.123 13.493 14.814
704 1HZ LYS 84 1HZ LYS 84 -2.937 15.217 15.760
705 2HZ LYS 84 2HZ LYS 84 -2.898 16.131 14.337
706 3HZ LYS 84 3HZ LYS 84 -1.925 14.754 14.485
707 H TYR 85 H TYR 85 -1.527 15.216 8.639
708 HA TYR 85 HA TYR 85 -1.162 18.134 8.574
709 1HB TYR 85 2HB TYR 85 -0.085 16.368 10.513
710 2HB TYR 85 1HB TYR 85 1.251 16.904 9.499
711 HD1 TYR 85 1HD TYR 85 -0.690 17.671 12.320
712 HD2 TYR 85 2HD TYR 85 1.300 19.508 9.037
713 HE1 TYR 85 1HE TYR 85 -0.607 19.792 13.563
714 HE2 TYR 85 2HE TYR 85 1.388 21.633 10.273
715 HH TYR 85 HH TYR 85 1.286 22.101 13.141
716 H GLY 86 H GLY 86 -1.021 15.407 6.782
717 1HA GLY 86 2HA GLY 86 -0.159 15.958 4.468
718 2HA GLY 86 1HA GLY 86 1.349 16.326 5.280
719 H ARG 87 H ARG 87 -0.970 13.630 5.568
720 HA ARG 87 HA ARG 87 1.309 11.798 5.289
721 1HB ARG 87 2HB ARG 87 -1.294 10.670 6.107
722 2HB ARG 87 1HB ARG 87 0.315 10.374 6.748
723 1HG ARG 87 2HG ARG 87 0.173 12.580 7.915
724 2HG ARG 87 1HG ARG 87 -1.512 12.672 7.399
725 1HD ARG 87 2HD ARG 87 -1.596 11.789 9.570
726 2HD ARG 87 1HD ARG 87 -1.806 10.398 8.507
727 HE ARG 87 HE ARG 87 0.189 9.558 9.257
728 1HH1 ARG 87 1HH1 ARG 87 -0.067 12.904 10.213
729 2HH1 ARG 87 2HH1 ARG 87 1.328 12.849 11.237
730 1HH2 ARG 87 1HH2 ARG 87 2.026 9.483 10.603
731 2HH2 ARG 87 2HH2 ARG 87 2.517 10.907 11.457
732 H GLY 88 H GLY 88 1.527 11.465 3.119
733 1HA GLY 88 2HA GLY 88 -0.501 11.306 1.212
734 2HA GLY 88 1HA GLY 88 1.064 10.509 1.071
735 H LEU 89 H LEU 89 -2.257 10.044 1.425
736 HA LEU 89 HA LEU 89 -2.132 7.556 2.825
737 1HB LEU 89 2HB LEU 89 -4.563 7.416 1.788
738 2HB LEU 89 1HB LEU 89 -4.186 8.421 3.171
739 HG LEU 89 HG LEU 89 -4.138 10.403 1.813
740 1HD1 LEU 89 1HD1 LEU 89 -4.751 8.720 -0.601
741 2HD1 LEU 89 2HD1 LEU 89 -3.122 9.247 -0.185
742 3HD1 LEU 89 3HD1 LEU 89 -4.372 10.440 -0.538
743 1HD2 LEU 89 1HD2 LEU 89 -6.492 8.590 1.446
744 2HD2 LEU 89 2HD2 LEU 89 -6.481 10.212 0.753
745 3HD2 LEU 89 3HD2 LEU 89 -6.318 9.997 2.496
746 H ALA 90 H ALA 90 -0.896 6.090 1.843
747 HA ALA 90 HA ALA 90 -2.047 4.469 -0.119
748 1HB ALA 90 1HB ALA 90 -1.062 6.556 -1.416
749 2HB ALA 90 2HB ALA 90 -0.967 4.926 -2.082
750 3HB ALA 90 3HB ALA 90 0.432 5.631 -1.271
751 H TYR 91 H TYR 91 -1.462 2.573 0.709
752 HA TYR 91 HA TYR 91 1.365 2.044 1.121
753 1HB TYR 91 2HB TYR 91 1.230 2.290 3.338
754 2HB TYR 91 1HB TYR 91 -0.513 2.488 3.265
755 HD1 TYR 91 1HD TYR 91 -1.758 1.032 4.507
756 HD2 TYR 91 2HD TYR 91 1.986 -0.282 2.980
757 HE1 TYR 91 1HE TYR 91 -2.064 -1.121 5.642
758 HE2 TYR 91 2HE TYR 91 1.694 -2.446 4.107
759 HH TYR 91 HH TYR 91 -0.325 -3.003 6.527
760 H ILE 92 H ILE 92 1.569 0.426 -0.361
761 HA ILE 92 HA ILE 92 0.135 -2.039 0.207
762 HB ILE 92 HB ILE 92 0.051 -0.824 -2.559
763 1HG1 ILE 92 2HG1 ILE 92 -1.525 0.230 -0.939
764 2HG1 ILE 92 1HG1 ILE 92 -2.338 -0.611 -2.252
765 1HG2 ILE 92 1HG2 ILE 92 -0.016 -3.508 -1.784
766 2HG2 ILE 92 2HG2 ILE 92 -0.441 -2.837 -3.358
767 3HG2 ILE 92 3HG2 ILE 92 -1.689 -3.079 -2.137
768 1HD1 ILE 92 1HD1 ILE 92 -3.204 -2.198 -0.884
769 2HD1 ILE 92 2HD1 ILE 92 -3.096 -0.862 0.263
770 3HD1 ILE 92 3HD1 ILE 92 -1.857 -2.118 0.252
771 H TYR 93 H TYR 93 1.831 -3.340 0.529
772 HA TYR 93 HA TYR 93 3.600 -3.862 -1.687
773 1HB TYR 93 2HB TYR 93 4.470 -2.174 0.448
774 2HB TYR 93 1HB TYR 93 5.373 -3.686 0.521
775 HD1 TYR 93 1HD TYR 93 6.523 -4.481 -1.623
776 HD2 TYR 93 2HD TYR 93 5.039 -0.526 -1.120
777 HE1 TYR 93 1HE TYR 93 7.973 -3.711 -3.454
778 HE2 TYR 93 2HE TYR 93 6.485 0.254 -2.950
779 HH TYR 93 HH TYR 93 7.630 -0.657 -4.908
780 H ALA 94 H ALA 94 4.216 -5.946 -1.769
781 HA ALA 94 HA ALA 94 3.891 -7.602 0.637
782 1HB ALA 94 1HB ALA 94 1.953 -8.291 -0.325
783 2HB ALA 94 2HB ALA 94 3.055 -9.360 -1.190
784 3HB ALA 94 3HB ALA 94 2.484 -7.877 -1.956
785 H ASP 95 H ASP 95 6.026 -8.009 0.981
786 HA ASP 95 HA ASP 95 8.110 -8.881 0.680
787 1HB ASP 95 2HB ASP 95 6.372 -10.777 -0.190
788 2HB ASP 95 1HB ASP 95 7.344 -10.546 -1.639
789 H GLY 96 H GLY 96 7.651 -6.459 -0.603
790 1HA GLY 96 2HA GLY 96 8.620 -5.063 -2.144
791 2HA GLY 96 1HA GLY 96 9.837 -6.313 -2.353
792 H LYS 97 H LYS 97 6.361 -6.467 -3.031
793 HA LYS 97 HA LYS 97 7.029 -7.173 -5.802
794 1HB LYS 97 2HB LYS 97 5.641 -8.713 -4.271
795 2HB LYS 97 1HB LYS 97 4.338 -7.556 -4.511
796 1HG LYS 97 2HG LYS 97 5.664 -8.500 -6.962
797 2HG LYS 97 1HG LYS 97 4.746 -9.712 -6.065
798 1HD LYS 97 2HD LYS 97 3.552 -7.032 -6.663
799 2HD LYS 97 1HD LYS 97 3.547 -8.307 -7.883
800 1HE LYS 97 2HE LYS 97 1.602 -8.892 -6.913
801 2HE LYS 97 1HE LYS 97 2.647 -9.669 -5.725
802 1HZ LYS 97 1HZ LYS 97 0.757 -7.921 -5.087
803 2HZ LYS 97 2HZ LYS 97 2.063 -6.860 -5.264
804 3HZ LYS 97 3HZ LYS 97 2.160 -8.141 -4.165
805 H MET 98 H MET 98 7.119 -5.299 -6.923
806 HA MET 98 HA MET 98 5.074 -3.264 -6.524
807 1HB MET 98 2HB MET 98 7.759 -3.146 -7.182
808 2HB MET 98 1HB MET 98 6.959 -2.815 -8.712
809 1HG MET 98 2HG MET 98 5.987 -1.368 -6.319
810 2HG MET 98 1HG MET 98 7.561 -0.911 -6.970
811 1HE MET 98 1HE MET 98 6.759 1.729 -9.019
812 2HE MET 98 2HE MET 98 7.506 0.414 -9.926
813 3HE MET 98 3HE MET 98 7.921 0.661 -8.232
814 H VAL 99 H VAL 99 3.629 -2.585 -8.097
815 HA VAL 99 HA VAL 99 2.539 -4.554 -9.765
816 HB VAL 99 HB VAL 99 1.235 -2.654 -8.916
817 1HG1 VAL 99 1HG1 VAL 99 3.306 -1.087 -9.666
818 2HG1 VAL 99 2HG1 VAL 99 1.683 -0.488 -9.325
819 3HG1 VAL 99 3HG1 VAL 99 2.178 -0.794 -10.991
820 1HG2 VAL 99 1HG2 VAL 99 0.024 -2.123 -11.020
821 2HG2 VAL 99 2HG2 VAL 99 0.341 -3.845 -10.802
822 3HG2 VAL 99 3HG2 VAL 99 1.326 -2.901 -11.919
823 H ASN 100 H ASN 100 4.927 -2.068 -10.362
824 HA ASN 100 HA ASN 100 5.408 -3.230 -13.007
825 1HB ASN 100 2HB ASN 100 4.028 -0.930 -12.878
826 2HB ASN 100 1HB ASN 100 5.661 -0.276 -12.812
827 1HD2 ASN 100 1HD2 ASN 100 5.711 0.635 -14.800
828 2HD2 ASN 100 2HD2 ASN 100 5.629 -0.260 -16.275
829 H GLU 101 H GLU 101 7.532 -2.531 -13.912
830 HA GLU 101 HA GLU 101 9.496 -2.328 -11.734
831 1HB GLU 101 2HB GLU 101 9.603 -3.522 -14.491
832 2HB GLU 101 1HB GLU 101 11.080 -3.121 -13.623
833 1HG GLU 101 2HG GLU 101 10.621 -5.423 -13.266
834 2HG GLU 101 1HG GLU 101 10.297 -4.570 -11.759
835 H ALA 102 H ALA 102 10.853 -0.642 -11.593
836 HA ALA 102 HA ALA 102 10.785 1.346 -13.769
837 1HB ALA 102 1HB ALA 102 11.403 2.990 -11.945
838 2HB ALA 102 2HB ALA 102 11.021 1.711 -10.793
839 3HB ALA 102 3HB ALA 102 9.770 2.325 -11.876
840 H LEU 103 H LEU 103 12.883 0.304 -11.074
841 HA LEU 103 HA LEU 103 15.208 0.849 -12.798
842 1HB LEU 103 2HB LEU 103 16.509 1.076 -10.736
843 2HB LEU 103 1HB LEU 103 15.180 2.219 -10.801
844 HG LEU 103 HG LEU 103 14.015 0.186 -9.430
845 1HD1 LEU 103 1HD1 LEU 103 16.910 0.226 -8.590
846 2HD1 LEU 103 2HD1 LEU 103 16.075 -1.120 -9.367
847 3HD1 LEU 103 3HD1 LEU 103 15.597 -0.601 -7.750
848 1HD2 LEU 103 1HD2 LEU 103 13.918 1.676 -7.723
849 2HD2 LEU 103 2HD2 LEU 103 14.500 2.765 -8.982
850 3HD2 LEU 103 3HD2 LEU 103 15.634 2.073 -7.823
851 H VAL 104 H VAL 104 17.084 -0.584 -12.495
852 HA VAL 104 HA VAL 104 16.363 -3.290 -11.607
853 HB VAL 104 HB VAL 104 17.675 -4.170 -13.591
854 1HG1 VAL 104 1HG1 VAL 104 15.110 -4.008 -13.290
855 2HG1 VAL 104 2HG1 VAL 104 15.763 -4.368 -14.888
856 3HG1 VAL 104 3HG1 VAL 104 15.213 -2.736 -14.506
857 1HG2 VAL 104 1HG2 VAL 104 17.011 -1.738 -15.118
858 2HG2 VAL 104 2HG2 VAL 104 18.384 -2.836 -15.268
859 3HG2 VAL 104 3HG2 VAL 104 18.375 -1.601 -14.008
860 H ARG 105 H ARG 105 18.338 -4.721 -11.478
861 HA ARG 105 HA ARG 105 20.525 -3.175 -10.285
862 1HB ARG 105 2HB ARG 105 19.545 -5.992 -9.910
863 2HB ARG 105 1HB ARG 105 21.152 -5.515 -9.380
864 1HG ARG 105 2HG ARG 105 20.218 -3.858 -7.896
865 2HG ARG 105 1HG ARG 105 18.593 -4.207 -8.489
866 1HD ARG 105 2HD ARG 105 18.568 -6.332 -7.494
867 2HD ARG 105 1HD ARG 105 20.314 -6.335 -7.259
868 HE ARG 105 HE ARG 105 20.025 -5.164 -5.310
869 1HH1 ARG 105 1HH1 ARG 105 17.053 -5.088 -7.138
870 2HH1 ARG 105 2HH1 ARG 105 16.133 -4.385 -5.850
871 1HH2 ARG 105 1HH2 ARG 105 18.817 -4.238 -3.616
872 2HH2 ARG 105 2HH2 ARG 105 17.134 -3.901 -3.851
873 H GLN 106 H GLN 106 22.739 -3.965 -10.590
874 HA GLN 106 HA GLN 106 23.142 -4.805 -13.368
875 1HB GLN 106 2HB GLN 106 25.397 -3.920 -13.136
876 2HB GLN 106 1HB GLN 106 24.217 -2.712 -12.646
877 1HG GLN 106 2HG GLN 106 24.636 -3.423 -10.272
878 2HG GLN 106 1HG GLN 106 25.982 -4.385 -10.882
879 1HE2 GLN 106 1HE2 GLN 106 26.931 -2.668 -12.844
880 2HE2 GLN 106 2HE2 GLN 106 27.591 -1.262 -12.089
881 H GLY 107 H GLY 107 24.539 -6.492 -13.929
882 1HA GLY 107 2HA GLY 107 25.834 -8.393 -13.604
883 2HA GLY 107 1HA GLY 107 25.805 -8.083 -11.874
884 H LEU 108 H LEU 108 23.833 -8.646 -10.701
885 HA LEU 108 HA LEU 108 22.924 -11.241 -11.414
886 1HB LEU 108 2HB LEU 108 22.647 -9.408 -9.159
887 2HB LEU 108 1HB LEU 108 21.195 -10.347 -9.451
888 HG LEU 108 HG LEU 108 22.719 -11.380 -7.795
889 1HD1 LEU 108 1HD1 LEU 108 22.876 -13.633 -9.082
890 2HD1 LEU 108 2HD1 LEU 108 21.994 -12.766 -10.340
891 3HD1 LEU 108 3HD1 LEU 108 21.293 -12.935 -8.730
892 1HD2 LEU 108 1HD2 LEU 108 24.808 -12.365 -8.510
893 2HD2 LEU 108 2HD2 LEU 108 24.830 -10.628 -8.822
894 3HD2 LEU 108 3HD2 LEU 108 24.565 -11.759 -10.149
895 H ALA 109 H ALA 109 21.768 -8.061 -12.068
896 HA ALA 109 HA ALA 109 20.058 -7.314 -13.373
897 1HB ALA 109 1HB ALA 109 19.071 -10.063 -13.945
898 2HB ALA 109 2HB ALA 109 20.640 -9.576 -14.581
899 3HB ALA 109 3HB ALA 109 19.194 -8.663 -15.010
900 H LYS 110 H LYS 110 18.795 -10.313 -11.902
901 HA LYS 110 HA LYS 110 17.034 -10.702 -10.517
902 1HB LYS 110 2HB LYS 110 17.254 -7.774 -9.800
903 2HB LYS 110 1HB LYS 110 16.456 -9.028 -8.862
904 1HG LYS 110 2HG LYS 110 19.233 -9.661 -9.423
905 2HG LYS 110 1HG LYS 110 19.043 -8.145 -8.541
906 1HD LYS 110 2HD LYS 110 17.568 -9.369 -6.927
907 2HD LYS 110 1HD LYS 110 18.008 -10.865 -7.754
908 1HE LYS 110 2HE LYS 110 19.565 -10.871 -6.081
909 2HE LYS 110 1HE LYS 110 20.454 -9.985 -7.319
910 1HZ LYS 110 1HZ LYS 110 19.354 -9.050 -4.795
911 2HZ LYS 110 2HZ LYS 110 19.209 -7.986 -6.102
912 3HZ LYS 110 3HZ LYS 110 20.735 -8.541 -5.631
Start of MODEL 7
1 1H ALA 1 1HT ALA 1 -1.821 14.591 -16.034
2 2H ALA 1 2HT ALA 1 -1.488 14.734 -14.356
3 3H ALA 1 3HT ALA 1 -0.500 13.739 -15.347
4 HA ALA 1 HA ALA 1 0.469 15.496 -16.390
5 1HB ALA 1 1HB ALA 1 -1.330 17.515 -15.136
6 2HB ALA 1 2HB ALA 1 -1.879 16.631 -16.560
7 3HB ALA 1 3HB ALA 1 -0.410 17.604 -16.638
8 H THR 2 H THR 2 0.684 14.183 -13.798
9 HA THR 2 HA THR 2 2.181 16.287 -12.387
10 HB THR 2 HB THR 2 1.515 14.654 -10.336
11 HG1 THR 2 1HG THR 2 -0.749 14.690 -12.042
12 1HG2 THR 2 1HG2 THR 2 1.218 17.051 -10.270
13 2HG2 THR 2 2HG2 THR 2 -0.246 16.234 -9.725
14 3HG2 THR 2 3HG2 THR 2 -0.175 16.928 -11.344
15 H SER 3 H SER 3 4.247 15.771 -12.721
16 HA SER 3 HA SER 3 5.136 13.075 -13.087
17 1HB SER 3 2HB SER 3 6.121 15.461 -13.884
18 2HB SER 3 1HB SER 3 7.133 15.177 -12.468
19 HG SER 3 HG SER 3 6.777 13.395 -14.651
20 H THR 4 H THR 4 5.209 11.702 -11.432
21 HA THR 4 HA THR 4 5.957 12.694 -8.777
22 HB THR 4 HB THR 4 5.285 10.117 -8.330
23 HG1 THR 4 1HG THR 4 3.487 9.663 -9.681
24 1HG2 THR 4 1HG2 THR 4 3.307 10.843 -7.433
25 2HG2 THR 4 2HG2 THR 4 3.020 12.006 -8.726
26 3HG2 THR 4 3HG2 THR 4 4.234 12.343 -7.492
27 H LYS 5 H LYS 5 7.936 12.381 -8.027
28 HA LYS 5 HA LYS 5 9.967 11.114 -9.473
29 1HB LYS 5 2HB LYS 5 11.352 11.422 -7.499
30 2HB LYS 5 1HB LYS 5 10.367 12.852 -7.773
31 1HG LYS 5 2HG LYS 5 9.305 10.780 -5.938
32 2HG LYS 5 1HG LYS 5 10.651 11.773 -5.377
33 1HD LYS 5 2HD LYS 5 9.146 13.728 -6.313
34 2HD LYS 5 1HD LYS 5 7.856 12.552 -6.046
35 1HE LYS 5 2HE LYS 5 9.756 13.729 -4.036
36 2HE LYS 5 1HE LYS 5 7.995 13.817 -4.060
37 1HZ LYS 5 1HZ LYS 5 8.411 12.212 -2.480
38 2HZ LYS 5 2HZ LYS 5 9.725 11.552 -3.317
39 3HZ LYS 5 3HZ LYS 5 8.147 11.268 -3.859
40 H LYS 6 H LYS 6 11.112 9.180 -9.112
41 HA LYS 6 HA LYS 6 9.464 6.958 -8.407
42 1HB LYS 6 2HB LYS 6 12.442 6.919 -8.889
43 2HB LYS 6 1HB LYS 6 11.310 5.585 -9.066
44 1HG LYS 6 2HG LYS 6 11.338 8.073 -10.761
45 2HG LYS 6 1HG LYS 6 12.021 6.512 -11.222
46 1HD LYS 6 2HD LYS 6 9.165 6.671 -10.362
47 2HD LYS 6 1HD LYS 6 9.609 7.186 -11.990
48 1HE LYS 6 2HE LYS 6 10.933 4.778 -11.676
49 2HE LYS 6 1HE LYS 6 9.385 4.511 -10.874
50 1HZ LYS 6 1HZ LYS 6 9.194 3.921 -13.170
51 2HZ LYS 6 2HZ LYS 6 9.802 5.418 -13.670
52 3HZ LYS 6 3HZ LYS 6 8.292 5.330 -12.912
53 H LEU 7 H LEU 7 9.101 6.244 -6.424
54 HA LEU 7 HA LEU 7 10.653 7.126 -4.187
55 1HB LEU 7 2HB LEU 7 8.111 5.877 -4.631
56 2HB LEU 7 1HB LEU 7 8.993 4.964 -3.423
57 HG LEU 7 HG LEU 7 7.578 6.620 -2.360
58 1HD1 LEU 7 1HD1 LEU 7 10.516 7.271 -2.207
59 2HD1 LEU 7 2HD1 LEU 7 9.631 6.103 -1.225
60 3HD1 LEU 7 3HD1 LEU 7 9.302 7.827 -1.054
61 1HD2 LEU 7 1HD2 LEU 7 9.186 8.823 -3.590
62 2HD2 LEU 7 2HD2 LEU 7 7.605 8.892 -2.814
63 3HD2 LEU 7 3HD2 LEU 7 7.768 8.179 -4.419
64 H HIS 8 H HIS 8 11.701 5.718 -2.643
65 HA HIS 8 HA HIS 8 13.242 3.650 -3.986
66 1HB HIS 8 2HB HIS 8 13.814 5.549 -2.000
67 2HB HIS 8 1HB HIS 8 13.883 3.991 -1.183
68 HD1 HIS 8 1HD HIS 8 15.131 5.165 -4.592
69 HD2 HIS 8 2HD HIS 8 16.452 3.183 -1.186
70 HE1 HIS 8 1HE HIS 8 17.520 4.542 -5.061
71 HE2 HIS 8 2HE HIS 8 18.327 3.423 -2.952
72 H LYS 9 H LYS 9 13.284 1.504 -3.422
73 HA LYS 9 HA LYS 9 10.932 0.520 -2.058
74 1HB LYS 9 2HB LYS 9 13.218 -0.972 -3.355
75 2HB LYS 9 1HB LYS 9 11.732 -1.701 -2.763
76 1HG LYS 9 2HG LYS 9 11.837 0.387 -4.928
77 2HG LYS 9 1HG LYS 9 11.803 -1.353 -5.224
78 1HD LYS 9 2HD LYS 9 9.718 -0.265 -3.430
79 2HD LYS 9 1HD LYS 9 9.594 0.159 -5.137
80 1HE LYS 9 2HE LYS 9 9.152 -1.976 -5.777
81 2HE LYS 9 1HE LYS 9 10.138 -2.679 -4.496
82 1HZ LYS 9 1HZ LYS 9 8.178 -1.599 -3.066
83 2HZ LYS 9 2HZ LYS 9 8.130 -3.186 -3.652
84 3HZ LYS 9 3HZ LYS 9 7.326 -1.953 -4.485
85 H GLU 10 H GLU 10 10.956 0.520 0.095
86 HA GLU 10 HA GLU 10 13.178 -0.816 1.449
87 1HB GLU 10 2HB GLU 10 13.111 1.876 1.470
88 2HB GLU 10 1HB GLU 10 12.059 1.553 2.841
89 1HG GLU 10 2HG GLU 10 13.750 0.876 4.140
90 2HG GLU 10 1HG GLU 10 14.542 0.003 2.828
91 HA PRO 11 HA PRO 11 9.662 -2.690 3.433
92 1HB PRO 11 2HB PRO 11 10.956 -4.342 5.096
93 2HB PRO 11 1HB PRO 11 10.962 -4.600 3.347
94 1HG PRO 11 2HG PRO 11 13.070 -3.386 5.090
95 2HG PRO 11 1HG PRO 11 13.251 -4.527 3.746
96 1HD PRO 11 2HD PRO 11 13.652 -1.817 3.530
97 2HD PRO 11 1HD PRO 11 13.195 -2.865 2.173
98 H ALA 12 H ALA 12 8.506 -1.415 4.760
99 HA ALA 12 HA ALA 12 9.154 -1.278 7.536
100 1HB ALA 12 1HB ALA 12 9.908 0.957 5.817
101 2HB ALA 12 2HB ALA 12 10.411 0.572 7.462
102 3HB ALA 12 3HB ALA 12 8.896 1.428 7.182
103 H THR 13 H THR 13 7.172 -1.912 8.156
104 HA THR 13 HA THR 13 5.006 -0.136 8.143
105 HB THR 13 HB THR 13 4.051 -2.459 6.635
106 HG1 THR 13 1HG THR 13 5.475 -0.512 5.176
107 1HG2 THR 13 1HG2 THR 13 3.226 0.182 7.120
108 2HG2 THR 13 2HG2 THR 13 2.399 -1.074 6.197
109 3HG2 THR 13 3HG2 THR 13 3.504 0.036 5.385
110 H LEU 14 H LEU 14 6.600 -2.533 9.548
111 HA LEU 14 HA LEU 14 4.239 -3.893 10.610
112 1HB LEU 14 2HB LEU 14 6.391 -5.080 9.809
113 2HB LEU 14 1HB LEU 14 7.075 -4.546 11.331
114 HG LEU 14 HG LEU 14 5.126 -5.731 12.463
115 1HD1 LEU 14 1HD1 LEU 14 4.702 -6.521 9.628
116 2HD1 LEU 14 2HD1 LEU 14 3.525 -6.175 10.895
117 3HD1 LEU 14 3HD1 LEU 14 4.393 -7.711 10.893
118 1HD2 LEU 14 1HD2 LEU 14 7.605 -6.556 11.899
119 2HD2 LEU 14 2HD2 LEU 14 6.693 -7.783 11.021
120 3HD2 LEU 14 3HD2 LEU 14 6.432 -7.560 12.750
121 H ILE 15 H ILE 15 3.460 -2.154 11.865
122 HA ILE 15 HA ILE 15 4.953 -1.765 14.371
123 HB ILE 15 HB ILE 15 3.220 0.336 13.063
124 1HG1 ILE 15 2HG1 ILE 15 6.235 0.124 13.251
125 2HG1 ILE 15 1HG1 ILE 15 5.272 0.032 11.780
126 1HG2 ILE 15 1HG2 ILE 15 3.158 0.605 15.414
127 2HG2 ILE 15 2HG2 ILE 15 4.317 1.790 14.812
128 3HG2 ILE 15 3HG2 ILE 15 4.889 0.303 15.565
129 1HD1 ILE 15 1HD1 ILE 15 5.141 2.250 11.597
130 2HD1 ILE 15 2HD1 ILE 15 6.489 2.269 12.734
131 3HD1 ILE 15 3HD1 ILE 15 4.839 2.472 13.320
132 H LYS 16 H LYS 16 1.751 -0.967 13.080
133 HA LYS 16 HA LYS 16 0.515 -2.606 15.182
134 1HB LYS 16 2HB LYS 16 0.461 -0.123 15.715
135 2HB LYS 16 1HB LYS 16 -0.565 0.074 14.301
136 1HG LYS 16 2HG LYS 16 -2.255 -0.205 15.728
137 2HG LYS 16 1HG LYS 16 -1.848 -1.920 15.645
138 1HD LYS 16 2HD LYS 16 -0.467 -1.733 17.617
139 2HD LYS 16 1HD LYS 16 -0.713 0.015 17.661
140 1HE LYS 16 2HE LYS 16 -2.754 -0.167 18.594
141 2HE LYS 16 1HE LYS 16 -3.175 -1.586 17.637
142 1HZ LYS 16 1HZ LYS 16 -1.144 -1.982 19.676
143 2HZ LYS 16 2HZ LYS 16 -2.425 -2.984 19.216
144 3HZ LYS 16 3HZ LYS 16 -2.705 -1.671 20.245
145 H ALA 17 H ALA 17 -0.797 -4.078 14.307
146 HA ALA 17 HA ALA 17 -1.376 -4.004 11.507
147 1HB ALA 17 1HB ALA 17 -2.778 -5.993 13.167
148 2HB ALA 17 2HB ALA 17 -1.016 -6.020 13.255
149 3HB ALA 17 3HB ALA 17 -1.825 -6.205 11.699
150 H ILE 18 H ILE 18 -3.010 -3.071 10.559
151 HA ILE 18 HA ILE 18 -5.646 -3.030 11.797
152 HB ILE 18 HB ILE 18 -4.405 -0.485 10.748
153 1HG1 ILE 18 2HG1 ILE 18 -3.388 -1.219 12.904
154 2HG1 ILE 18 1HG1 ILE 18 -4.281 0.293 13.037
155 1HG2 ILE 18 1HG2 ILE 18 -7.093 -1.235 11.788
156 2HG2 ILE 18 2HG2 ILE 18 -6.658 -0.208 10.422
157 3HG2 ILE 18 3HG2 ILE 18 -6.489 0.398 12.071
158 1HD1 ILE 18 1HD1 ILE 18 -5.651 -0.553 14.560
159 2HD1 ILE 18 2HD1 ILE 18 -4.535 -1.915 14.663
160 3HD1 ILE 18 3HD1 ILE 18 -5.944 -2.006 13.606
161 H ASP 19 H ASP 19 -7.343 -2.476 10.241
162 HA ASP 19 HA ASP 19 -6.886 -3.680 7.713
163 1HB ASP 19 2HB ASP 19 -9.172 -2.470 9.137
164 2HB ASP 19 1HB ASP 19 -9.261 -2.384 7.380
165 H GLY 20 H GLY 20 -8.023 -2.300 5.753
166 1HA GLY 20 2HA GLY 20 -6.059 -0.375 5.052
167 2HA GLY 20 1HA GLY 20 -7.531 -0.717 4.155
168 H ASP 21 H ASP 21 -6.409 0.919 7.101
169 HA ASP 21 HA ASP 21 -8.056 3.219 6.432
170 1HB ASP 21 2HB ASP 21 -9.395 1.618 7.915
171 2HB ASP 21 1HB ASP 21 -8.253 2.021 9.193
172 H THR 22 H THR 22 -5.946 1.805 8.929
173 HA THR 22 HA THR 22 -4.143 4.051 8.696
174 HB THR 22 HB THR 22 -5.577 5.058 10.273
175 HG1 THR 22 1HG THR 22 -4.219 5.323 11.933
176 1HG2 THR 22 1HG2 THR 22 -5.784 2.347 11.485
177 2HG2 THR 22 2HG2 THR 22 -7.052 3.505 11.089
178 3HG2 THR 22 3HG2 THR 22 -6.017 3.777 12.490
179 H VAL 23 H VAL 23 -2.348 2.930 8.353
180 HA VAL 23 HA VAL 23 -1.513 0.995 10.398
181 HB VAL 23 HB VAL 23 -0.291 -0.222 8.484
182 1HG1 VAL 23 1HG1 VAL 23 -3.195 -0.683 8.173
183 2HG1 VAL 23 2HG1 VAL 23 -2.546 -0.776 9.809
184 3HG1 VAL 23 3HG1 VAL 23 -1.896 -1.818 8.543
185 1HG2 VAL 23 1HG2 VAL 23 -0.557 1.182 6.637
186 2HG2 VAL 23 2HG2 VAL 23 -2.275 1.428 6.955
187 3HG2 VAL 23 3HG2 VAL 23 -1.703 -0.125 6.345
188 H LYS 24 H LYS 24 0.198 1.842 11.358
189 HA LYS 24 HA LYS 24 1.796 3.857 10.081
190 1HB LYS 24 2HB LYS 24 3.121 3.666 12.285
191 2HB LYS 24 1HB LYS 24 1.481 4.295 12.339
192 1HG LYS 24 2HG LYS 24 1.615 1.403 12.677
193 2HG LYS 24 1HG LYS 24 2.493 2.299 13.918
194 1HD LYS 24 2HD LYS 24 0.044 3.642 13.528
195 2HD LYS 24 1HD LYS 24 -0.331 1.922 13.616
196 1HE LYS 24 2HE LYS 24 -0.419 2.848 15.831
197 2HE LYS 24 1HE LYS 24 0.987 1.791 15.711
198 1HZ LYS 24 1HZ LYS 24 2.405 3.503 15.959
199 2HZ LYS 24 2HZ LYS 24 1.085 4.250 16.706
200 3HZ LYS 24 3HZ LYS 24 1.445 4.591 15.089
201 H LEU 25 H LEU 25 3.832 3.755 9.344
202 HA LEU 25 HA LEU 25 5.174 1.144 9.351
203 1HB LEU 25 2HB LEU 25 6.189 2.421 7.147
204 2HB LEU 25 1HB LEU 25 4.936 1.201 7.116
205 HG LEU 25 HG LEU 25 4.250 4.110 7.364
206 1HD1 LEU 25 1HD1 LEU 25 4.624 4.533 5.204
207 2HD1 LEU 25 2HD1 LEU 25 4.003 2.961 4.698
208 3HD1 LEU 25 3HD1 LEU 25 5.675 3.118 5.238
209 1HD2 LEU 25 1HD2 LEU 25 2.655 2.068 7.742
210 2HD2 LEU 25 2HD2 LEU 25 2.643 2.013 5.980
211 3HD2 LEU 25 3HD2 LEU 25 2.109 3.466 6.820
212 H MET 26 H MET 26 7.160 1.137 10.204
213 HA MET 26 HA MET 26 8.267 3.541 11.269
214 1HB MET 26 2HB MET 26 10.134 2.088 11.995
215 2HB MET 26 1HB MET 26 8.560 1.451 12.455
216 1HG MET 26 2HG MET 26 9.021 -0.456 11.447
217 2HG MET 26 1HG MET 26 9.222 0.387 9.913
218 1HE MET 26 1HE MET 26 10.934 -1.383 12.896
219 2HE MET 26 2HE MET 26 11.219 0.305 13.323
220 3HE MET 26 3HE MET 26 12.572 -0.731 12.867
221 H TYR 27 H TYR 27 8.914 4.989 9.764
222 HA TYR 27 HA TYR 27 10.927 4.083 7.813
223 1HB TYR 27 2HB TYR 27 8.857 4.861 6.737
224 2HB TYR 27 1HB TYR 27 9.001 6.405 7.572
225 HD1 TYR 27 1HD TYR 27 9.880 4.539 4.659
226 HD2 TYR 27 2HD TYR 27 11.080 7.820 7.088
227 HE1 TYR 27 1HE TYR 27 11.236 5.410 2.803
228 HE2 TYR 27 2HE TYR 27 12.438 8.700 5.240
229 HH TYR 27 HH TYR 27 13.573 7.249 2.934
230 H LYS 28 H LYS 28 12.899 4.688 8.388
231 HA LYS 28 HA LYS 28 14.648 5.907 9.181
232 1HB LYS 28 2HB LYS 28 13.380 7.573 7.544
233 2HB LYS 28 1HB LYS 28 13.093 8.446 9.044
234 1HG LYS 28 2HG LYS 28 15.748 7.932 9.239
235 2HG LYS 28 1HG LYS 28 15.557 8.112 7.495
236 1HD LYS 28 2HD LYS 28 15.767 10.309 7.908
237 2HD LYS 28 1HD LYS 28 14.085 10.207 8.431
238 1HE LYS 28 2HE LYS 28 16.039 9.470 10.488
239 2HE LYS 28 1HE LYS 28 16.151 11.146 9.948
240 1HZ LYS 28 1HZ LYS 28 14.197 11.665 10.889
241 2HZ LYS 28 2HZ LYS 28 14.469 10.291 11.838
242 3HZ LYS 28 3HZ LYS 28 13.465 10.195 10.480
243 H GLY 29 H GLY 29 12.552 4.926 11.013
244 1HA GLY 29 2HA GLY 29 12.464 4.903 13.335
245 2HA GLY 29 1HA GLY 29 13.453 6.354 13.361
246 H GLN 30 H GLN 30 10.675 6.426 11.332
247 HA GLN 30 HA GLN 30 9.138 7.825 13.408
248 1HB GLN 30 2HB GLN 30 9.692 8.784 10.601
249 2HB GLN 30 1HB GLN 30 8.433 9.463 11.622
250 1HG GLN 30 2HG GLN 30 10.947 9.388 13.020
251 2HG GLN 30 1HG GLN 30 11.106 10.235 11.482
252 1HE2 GLN 30 1HE2 GLN 30 8.857 11.556 11.139
253 2HE2 GLN 30 2HE2 GLN 30 8.551 12.659 12.432
254 HA PRO 31 HA PRO 31 6.008 5.056 11.827
255 1HB PRO 31 2HB PRO 31 3.964 5.874 13.387
256 2HB PRO 31 1HB PRO 31 5.302 4.907 14.020
257 1HG PRO 31 2HG PRO 31 4.851 7.861 14.197
258 2HG PRO 31 1HG PRO 31 5.408 6.739 15.449
259 1HD PRO 31 2HD PRO 31 7.090 8.339 14.028
260 2HD PRO 31 1HD PRO 31 7.574 6.763 14.682
261 H MET 32 H MET 32 4.906 5.279 9.988
262 HA MET 32 HA MET 32 3.585 7.857 9.444
263 1HB MET 32 2HB MET 32 4.951 5.960 7.535
264 2HB MET 32 1HB MET 32 3.960 7.314 7.019
265 1HG MET 32 2HG MET 32 6.316 7.688 8.828
266 2HG MET 32 1HG MET 32 6.486 7.632 7.074
267 1HE MET 32 1HE MET 32 6.909 11.420 7.927
268 2HE MET 32 2HE MET 32 7.734 9.877 7.706
269 3HE MET 32 3HE MET 32 7.083 10.311 9.287
270 H THR 33 H THR 33 1.461 7.615 9.679
271 HA THR 33 HA THR 33 0.118 5.123 9.453
272 HB THR 33 HB THR 33 -1.133 7.870 9.456
273 HG1 THR 33 1HG THR 33 0.202 7.770 11.227
274 1HG2 THR 33 1HG2 THR 33 -2.147 5.168 10.274
275 2HG2 THR 33 2HG2 THR 33 -2.802 6.252 9.048
276 3HG2 THR 33 3HG2 THR 33 -2.913 6.680 10.755
277 H PHE 34 H PHE 34 -1.617 4.622 7.996
278 HA PHE 34 HA PHE 34 -1.288 5.812 5.321
279 1HB PHE 34 2HB PHE 34 -1.287 3.000 6.216
280 2HB PHE 34 1HB PHE 34 -2.248 3.324 4.779
281 HD1 PHE 34 1HD PHE 34 -0.948 2.206 3.170
282 HD2 PHE 34 2HD PHE 34 0.865 5.072 5.741
283 HE1 PHE 34 1HE PHE 34 1.093 2.146 1.797
284 HE2 PHE 34 2HE PHE 34 2.905 5.018 4.370
285 HZ PHE 34 HZ PHE 34 3.021 3.553 2.396
286 H ARG 35 H ARG 35 -3.211 5.691 3.933
287 HA ARG 35 HA ARG 35 -5.689 5.771 5.521
288 1HB ARG 35 2HB ARG 35 -4.542 7.833 4.069
289 2HB ARG 35 1HB ARG 35 -5.788 7.221 2.991
290 1HG ARG 35 2HG ARG 35 -7.400 7.426 4.912
291 2HG ARG 35 1HG ARG 35 -6.127 8.287 5.780
292 1HD ARG 35 2HD ARG 35 -7.033 10.113 4.839
293 2HD ARG 35 1HD ARG 35 -6.130 9.609 3.411
294 HE ARG 35 HE ARG 35 -8.686 8.375 3.498
295 1HH1 ARG 35 1HH1 ARG 35 -7.096 11.395 2.775
296 2HH1 ARG 35 2HH1 ARG 35 -8.319 11.917 1.664
297 1HH2 ARG 35 1HH2 ARG 35 -10.297 9.060 2.040
298 2HH2 ARG 35 2HH2 ARG 35 -10.136 10.592 1.249
299 H LEU 36 H LEU 36 -7.582 4.947 4.618
300 HA LEU 36 HA LEU 36 -7.446 2.575 3.257
301 1HB LEU 36 2HB LEU 36 -9.414 3.605 4.503
302 2HB LEU 36 1HB LEU 36 -9.789 4.446 3.012
303 HG LEU 36 HG LEU 36 -9.475 1.494 2.867
304 1HD1 LEU 36 1HD1 LEU 36 -12.190 2.326 3.543
305 2HD1 LEU 36 2HD1 LEU 36 -11.044 2.492 4.873
306 3HD1 LEU 36 3HD1 LEU 36 -11.260 0.929 4.085
307 1HD2 LEU 36 1HD2 LEU 36 -10.157 2.061 0.820
308 2HD2 LEU 36 2HD2 LEU 36 -10.669 3.665 1.340
309 3HD2 LEU 36 3HD2 LEU 36 -11.753 2.288 1.536
310 H LEU 37 H LEU 37 -6.856 2.057 1.276
311 HA LEU 37 HA LEU 37 -6.168 3.767 -0.760
312 1HB LEU 37 2HB LEU 37 -6.498 1.781 -2.286
313 2HB LEU 37 1HB LEU 37 -5.433 1.537 -0.912
314 HG LEU 37 HG LEU 37 -7.358 0.443 0.280
315 1HD1 LEU 37 1HD1 LEU 37 -9.344 0.974 -0.656
316 2HD1 LEU 37 2HD1 LEU 37 -9.013 -0.467 -1.617
317 3HD1 LEU 37 3HD1 LEU 37 -8.665 1.132 -2.277
318 1HD2 LEU 37 1HD2 LEU 37 -5.759 -1.028 -0.560
319 2HD2 LEU 37 2HD2 LEU 37 -6.171 -0.672 -2.236
320 3HD2 LEU 37 3HD2 LEU 37 -7.271 -1.627 -1.242
321 H LEU 38 H LEU 38 -7.185 3.946 -2.948
322 HA LEU 38 HA LEU 38 -9.331 5.482 -3.119
323 1HB LEU 38 2HB LEU 38 -7.923 4.669 -5.021
324 2HB LEU 38 1HB LEU 38 -8.919 3.227 -5.073
325 HG LEU 38 HG LEU 38 -10.905 4.733 -5.476
326 1HD1 LEU 38 1HD1 LEU 38 -9.972 6.950 -6.610
327 2HD1 LEU 38 2HD1 LEU 38 -8.727 6.735 -5.381
328 3HD1 LEU 38 3HD1 LEU 38 -10.419 6.873 -4.906
329 1HD2 LEU 38 1HD2 LEU 38 -8.672 4.195 -7.331
330 2HD2 LEU 38 2HD2 LEU 38 -9.886 5.352 -7.873
331 3HD2 LEU 38 3HD2 LEU 38 -10.368 3.718 -7.423
332 H VAL 39 H VAL 39 -11.576 5.265 -3.679
333 HA VAL 39 HA VAL 39 -13.001 3.600 -1.936
334 HB VAL 39 HB VAL 39 -14.124 4.908 -4.412
335 1HG1 VAL 39 1HG1 VAL 39 -15.646 3.358 -3.336
336 2HG1 VAL 39 2HG1 VAL 39 -16.186 5.015 -3.073
337 3HG1 VAL 39 3HG1 VAL 39 -15.374 4.136 -1.778
338 1HG2 VAL 39 1HG2 VAL 39 -14.693 6.648 -2.440
339 2HG2 VAL 39 2HG2 VAL 39 -13.281 6.789 -3.488
340 3HG2 VAL 39 3HG2 VAL 39 -13.123 6.061 -1.889
341 H ASP 40 H ASP 40 -13.886 1.653 -2.103
342 HA ASP 40 HA ASP 40 -14.034 0.333 -4.717
343 1HB ASP 40 2HB ASP 40 -13.192 -1.778 -3.606
344 2HB ASP 40 1HB ASP 40 -11.982 -0.518 -3.834
345 H THR 41 H THR 41 -15.373 -1.701 -4.585
346 HA THR 41 HA THR 41 -17.818 -1.089 -3.226
347 HB THR 41 HB THR 41 -17.021 -3.508 -4.852
348 HG1 THR 41 1HG THR 41 -18.315 -2.420 -6.444
349 1HG2 THR 41 1HG2 THR 41 -19.629 -3.468 -5.188
350 2HG2 THR 41 2HG2 THR 41 -19.589 -2.747 -3.577
351 3HG2 THR 41 3HG2 THR 41 -18.883 -4.342 -3.848
352 HA PRO 42 HA PRO 42 -16.568 -3.539 0.348
353 1HB PRO 42 2HB PRO 42 -18.244 -2.442 2.106
354 2HB PRO 42 1HB PRO 42 -16.850 -1.542 1.496
355 1HG PRO 42 2HG PRO 42 -19.726 -1.341 0.710
356 2HG PRO 42 1HG PRO 42 -18.533 -0.050 0.935
357 1HD PRO 42 2HD PRO 42 -19.272 -1.134 -1.508
358 2HD PRO 42 1HD PRO 42 -17.769 -0.245 -1.199
359 H GLU 43 H GLU 43 -17.639 -5.073 1.775
360 HA GLU 43 HA GLU 43 -20.275 -5.955 0.812
361 1HB GLU 43 2HB GLU 43 -18.104 -7.288 0.071
362 2HB GLU 43 1HB GLU 43 -18.287 -8.007 1.666
363 1HG GLU 43 2HG GLU 43 -20.827 -8.155 0.663
364 2HG GLU 43 1HG GLU 43 -19.833 -8.416 -0.771
365 H THR 44 H THR 44 -17.890 -6.086 3.435
366 HA THR 44 HA THR 44 -19.501 -7.367 5.335
367 HB THR 44 HB THR 44 -17.111 -7.131 5.660
368 HG1 THR 44 1HG THR 44 -17.896 -7.329 7.622
369 1HG2 THR 44 1HG2 THR 44 -17.397 -4.243 6.339
370 2HG2 THR 44 2HG2 THR 44 -17.082 -4.740 4.677
371 3HG2 THR 44 3HG2 THR 44 -15.947 -5.170 5.956
372 H LYS 45 H LYS 45 -21.534 -6.644 5.621
373 HA LYS 45 HA LYS 45 -23.293 -5.264 6.088
374 1HB LYS 45 2HB LYS 45 -22.168 -5.608 8.285
375 2HB LYS 45 1HB LYS 45 -21.315 -4.090 8.041
376 1HG LYS 45 2HG LYS 45 -24.161 -3.753 7.695
377 2HG LYS 45 1HG LYS 45 -23.782 -4.455 9.267
378 1HD LYS 45 2HD LYS 45 -21.898 -2.496 9.080
379 2HD LYS 45 1HD LYS 45 -23.254 -1.762 8.222
380 1HE LYS 45 2HE LYS 45 -23.816 -1.116 10.321
381 2HE LYS 45 1HE LYS 45 -24.569 -2.711 10.342
382 1HZ LYS 45 1HZ LYS 45 -22.908 -3.574 11.655
383 2HZ LYS 45 2HZ LYS 45 -23.028 -2.004 12.271
384 3HZ LYS 45 3HZ LYS 45 -21.773 -2.401 11.209
385 H HIS 46 H HIS 46 -21.249 -4.186 4.079
386 HA HIS 46 HA HIS 46 -22.082 -1.370 4.274
387 1HB HIS 46 2HB HIS 46 -19.445 -2.570 3.679
388 2HB HIS 46 1HB HIS 46 -19.913 -1.205 2.672
389 HD1 HIS 46 1HD HIS 46 -18.015 -1.796 5.527
390 HD2 HIS 46 2HD HIS 46 -20.993 0.961 4.632
391 HE1 HIS 46 1HE HIS 46 -17.704 0.086 7.168
392 HE2 HIS 46 2HE HIS 46 -19.563 1.708 6.655
393 HA PRO 47 HA PRO 47 -24.320 -2.238 0.510
394 1HB PRO 47 2HB PRO 47 -24.069 0.693 0.109
395 2HB PRO 47 1HB PRO 47 -25.517 -0.320 0.131
396 1HG PRO 47 2HG PRO 47 -24.940 1.288 2.180
397 2HG PRO 47 1HG PRO 47 -25.645 -0.319 2.444
398 1HD PRO 47 2HD PRO 47 -22.818 0.594 2.790
399 2HD PRO 47 1HD PRO 47 -23.770 -0.535 3.777
400 H LYS 48 H LYS 48 -23.909 -2.324 -1.705
401 HA LYS 48 HA LYS 48 -21.210 -2.335 -2.496
402 1HB LYS 48 2HB LYS 48 -23.798 -2.497 -4.021
403 2HB LYS 48 1HB LYS 48 -22.248 -2.505 -4.848
404 1HG LYS 48 2HG LYS 48 -22.439 -4.728 -4.631
405 2HG LYS 48 1HG LYS 48 -21.812 -4.423 -3.010
406 1HD LYS 48 2HD LYS 48 -24.613 -4.014 -2.927
407 2HD LYS 48 1HD LYS 48 -24.328 -5.531 -3.782
408 1HE LYS 48 2HE LYS 48 -22.710 -5.141 -1.359
409 2HE LYS 48 1HE LYS 48 -24.444 -5.277 -1.081
410 1HZ LYS 48 1HZ LYS 48 -23.030 -7.400 -1.116
411 2HZ LYS 48 2HZ LYS 48 -23.051 -7.226 -2.799
412 3HZ LYS 48 3HZ LYS 48 -24.502 -7.404 -1.950
413 H LYS 49 H LYS 49 -20.367 -1.117 -4.429
414 HA LYS 49 HA LYS 49 -21.201 1.705 -4.272
415 1HB LYS 49 2HB LYS 49 -18.514 0.432 -4.271
416 2HB LYS 49 1HB LYS 49 -18.682 1.957 -5.127
417 1HG LYS 49 2HG LYS 49 -19.784 1.800 -2.380
418 2HG LYS 49 1HG LYS 49 -18.029 1.835 -2.565
419 1HD LYS 49 2HD LYS 49 -18.344 4.071 -2.551
420 2HD LYS 49 1HD LYS 49 -18.729 3.817 -4.254
421 1HE LYS 49 2HE LYS 49 -21.136 3.338 -3.127
422 2HE LYS 49 1HE LYS 49 -20.483 4.518 -1.992
423 1HZ LYS 49 1HZ LYS 49 -20.652 6.160 -3.485
424 2HZ LYS 49 2HZ LYS 49 -21.747 5.141 -4.274
425 3HZ LYS 49 3HZ LYS 49 -20.133 5.201 -4.780
426 H GLY 50 H GLY 50 -18.934 0.113 -6.495
427 1HA GLY 50 2HA GLY 50 -20.839 0.374 -8.688
428 2HA GLY 50 1HA GLY 50 -19.407 1.387 -8.781
429 H VAL 51 H VAL 51 -17.447 -0.298 -7.852
430 HA VAL 51 HA VAL 51 -16.981 -1.920 -10.142
431 HB VAL 51 HB VAL 51 -14.925 -2.641 -8.957
432 1HG1 VAL 51 1HG1 VAL 51 -15.449 -0.254 -10.099
433 2HG1 VAL 51 2HG1 VAL 51 -13.860 -0.730 -9.502
434 3HG1 VAL 51 3HG1 VAL 51 -14.914 0.268 -8.501
435 1HG2 VAL 51 1HG2 VAL 51 -14.371 -1.829 -6.788
436 2HG2 VAL 51 2HG2 VAL 51 -15.968 -2.568 -6.676
437 3HG2 VAL 51 3HG2 VAL 51 -15.810 -0.812 -6.735
438 H GLU 52 H GLU 52 -16.198 -4.241 -9.865
439 HA GLU 52 HA GLU 52 -18.174 -5.689 -8.235
440 1HB GLU 52 2HB GLU 52 -17.878 -5.865 -10.891
441 2HB GLU 52 1HB GLU 52 -16.691 -7.069 -10.409
442 1HG GLU 52 2HG GLU 52 -18.282 -8.558 -10.053
443 2HG GLU 52 1HG GLU 52 -19.095 -7.474 -8.924
444 H LYS 53 H LYS 53 -17.424 -7.930 -7.572
445 HA LYS 53 HA LYS 53 -15.225 -7.712 -5.855
446 1HB LYS 53 2HB LYS 53 -17.216 -9.683 -6.501
447 2HB LYS 53 1HB LYS 53 -15.646 -10.461 -6.362
448 1HG LYS 53 2HG LYS 53 -15.537 -8.978 -4.162
449 2HG LYS 53 1HG LYS 53 -17.291 -9.118 -4.301
450 1HD LYS 53 2HD LYS 53 -17.199 -11.485 -4.204
451 2HD LYS 53 1HD LYS 53 -15.448 -11.494 -4.429
452 1HE LYS 53 2HE LYS 53 -16.255 -11.921 -2.079
453 2HE LYS 53 1HE LYS 53 -15.072 -10.626 -2.260
454 1HZ LYS 53 1HZ LYS 53 -16.561 -9.063 -1.669
455 2HZ LYS 53 2HZ LYS 53 -17.330 -10.357 -0.897
456 3HZ LYS 53 3HZ LYS 53 -17.866 -9.839 -2.415
457 H TYR 54 H TYR 54 -13.389 -7.065 -6.979
458 HA TYR 54 HA TYR 54 -12.142 -9.182 -8.593
459 1HB TYR 54 2HB TYR 54 -12.896 -6.565 -9.478
460 2HB TYR 54 1HB TYR 54 -11.139 -6.681 -9.491
461 HD1 TYR 54 1HD TYR 54 -13.905 -7.045 -11.484
462 HD2 TYR 54 2HD TYR 54 -10.349 -9.136 -10.444
463 HE1 TYR 54 1HE TYR 54 -14.010 -8.271 -13.614
464 HE2 TYR 54 2HE TYR 54 -10.443 -10.367 -12.570
465 HH TYR 54 HH TYR 54 -11.446 -9.999 -14.867
466 H GLY 55 H GLY 55 -11.929 -8.132 -5.729
467 1HA GLY 55 2HA GLY 55 -9.234 -8.625 -5.308
468 2HA GLY 55 1HA GLY 55 -9.390 -6.883 -5.477
469 HA PRO 56 HA PRO 56 -11.913 -7.800 -1.540
470 1HB PRO 56 2HB PRO 56 -12.482 -10.318 -0.809
471 2HB PRO 56 1HB PRO 56 -13.443 -9.467 -2.026
472 1HG PRO 56 2HG PRO 56 -11.279 -11.502 -2.404
473 2HG PRO 56 1HG PRO 56 -12.835 -11.352 -3.242
474 1HD PRO 56 2HD PRO 56 -10.453 -10.470 -4.275
475 2HD PRO 56 1HD PRO 56 -12.032 -9.786 -4.706
476 H GLU 57 H GLU 57 -9.334 -10.074 -2.233
477 HA GLU 57 HA GLU 57 -8.531 -10.592 0.418
478 1HB GLU 57 2HB GLU 57 -7.874 -11.829 -1.728
479 2HB GLU 57 1HB GLU 57 -6.671 -10.566 -1.948
480 1HG GLU 57 2HG GLU 57 -5.314 -11.853 -0.752
481 2HG GLU 57 1HG GLU 57 -6.261 -11.357 0.649
482 H ALA 58 H ALA 58 -8.243 -7.782 -1.487
483 HA ALA 58 HA ALA 58 -5.844 -6.651 -0.778
484 1HB ALA 58 1HB ALA 58 -8.147 -4.816 -0.664
485 2HB ALA 58 2HB ALA 58 -8.000 -5.780 -2.135
486 3HB ALA 58 3HB ALA 58 -6.672 -4.735 -1.628
487 H SER 59 H SER 59 -8.733 -7.010 1.174
488 HA SER 59 HA SER 59 -7.629 -5.410 3.334
489 1HB SER 59 2HB SER 59 -10.074 -7.004 3.816
490 2HB SER 59 1HB SER 59 -9.745 -5.307 4.163
491 HG SER 59 HG SER 59 -10.523 -4.762 2.273
492 H ALA 60 H ALA 60 -7.864 -8.730 2.394
493 HA ALA 60 HA ALA 60 -7.464 -9.832 5.010
494 1HB ALA 60 1HB ALA 60 -8.383 -10.872 2.705
495 2HB ALA 60 2HB ALA 60 -7.755 -11.846 4.034
496 3HB ALA 60 3HB ALA 60 -6.718 -11.454 2.662
497 H PHE 61 H PHE 61 -5.409 -8.726 2.422
498 HA PHE 61 HA PHE 61 -3.034 -10.044 3.030
499 1HB PHE 61 2HB PHE 61 -3.703 -7.443 1.721
500 2HB PHE 61 1HB PHE 61 -2.023 -7.772 2.130
501 HD1 PHE 61 1HD PHE 61 -1.029 -9.982 1.273
502 HD2 PHE 61 2HD PHE 61 -4.610 -8.259 -0.248
503 HE1 PHE 61 1HE PHE 61 -0.789 -11.308 -0.786
504 HE2 PHE 61 2HE PHE 61 -4.378 -9.583 -2.308
505 HZ PHE 61 HZ PHE 61 -2.465 -11.111 -2.578
506 H THR 62 H THR 62 -4.254 -6.943 4.261
507 HA THR 62 HA THR 62 -2.059 -6.394 5.939
508 HB THR 62 HB THR 62 -3.440 -4.564 5.425
509 HG1 THR 62 1HG THR 62 -2.808 -4.442 7.560
510 1HG2 THR 62 1HG2 THR 62 -5.847 -4.488 6.194
511 2HG2 THR 62 2HG2 THR 62 -5.744 -6.241 6.357
512 3HG2 THR 62 3HG2 THR 62 -5.499 -5.487 4.781
513 H LYS 63 H LYS 63 -4.558 -8.685 6.237
514 HA LYS 63 HA LYS 63 -4.458 -8.765 9.137
515 1HB LYS 63 2HB LYS 63 -6.526 -9.187 7.621
516 2HB LYS 63 1HB LYS 63 -5.850 -10.799 7.429
517 1HG LYS 63 2HG LYS 63 -6.533 -11.440 9.448
518 2HG LYS 63 1HG LYS 63 -5.957 -9.956 10.208
519 1HD LYS 63 2HD LYS 63 -8.021 -8.858 9.119
520 2HD LYS 63 1HD LYS 63 -8.609 -10.511 8.920
521 1HE LYS 63 2HE LYS 63 -9.523 -9.925 10.955
522 2HE LYS 63 1HE LYS 63 -8.037 -10.737 11.445
523 1HZ LYS 63 1HZ LYS 63 -7.132 -8.825 12.191
524 2HZ LYS 63 2HZ LYS 63 -8.750 -8.362 12.359
525 3HZ LYS 63 3HZ LYS 63 -7.865 -7.864 11.007
526 H LYS 64 H LYS 64 -4.074 -11.304 6.653
527 HA LYS 64 HA LYS 64 -2.399 -12.821 8.474
528 1HB LYS 64 2HB LYS 64 -3.516 -13.442 5.742
529 2HB LYS 64 1HB LYS 64 -2.473 -14.538 6.636
530 1HG LYS 64 2HG LYS 64 -4.111 -15.166 8.041
531 2HG LYS 64 1HG LYS 64 -4.815 -13.550 8.111
532 1HD LYS 64 2HD LYS 64 -6.378 -14.128 6.640
533 2HD LYS 64 1HD LYS 64 -5.144 -14.609 5.473
534 1HE LYS 64 2HE LYS 64 -4.996 -16.807 6.607
535 2HE LYS 64 1HE LYS 64 -6.319 -16.316 7.666
536 1HZ LYS 64 1HZ LYS 64 -7.198 -17.623 5.891
537 2HZ LYS 64 2HZ LYS 64 -6.434 -16.670 4.722
538 3HZ LYS 64 3HZ LYS 64 -7.693 -16.023 5.647
539 H MET 65 H MET 65 -2.086 -11.973 5.025
540 HA MET 65 HA MET 65 0.586 -12.567 4.731
541 1HB MET 65 2HB MET 65 -1.424 -11.180 3.236
542 2HB MET 65 1HB MET 65 0.084 -10.283 3.131
543 1HG MET 65 2HG MET 65 0.150 -11.732 1.318
544 2HG MET 65 1HG MET 65 1.166 -12.512 2.529
545 1HE MET 65 1HE MET 65 1.147 -14.906 1.686
546 2HE MET 65 2HE MET 65 0.370 -14.313 0.219
547 3HE MET 65 3HE MET 65 -0.275 -15.731 1.046
548 H TRP 66 H TRP 66 -0.804 -9.904 6.422
549 HA TRP 66 HA TRP 66 1.734 -8.466 6.434
550 1HB TRP 66 2HB TRP 66 -0.287 -7.172 5.956
551 2HB TRP 66 1HB TRP 66 -0.964 -7.656 7.504
552 HD1 TRP 66 HD TRP 66 1.103 -5.007 5.925
553 HE1 TRP 66 1HE TRP 66 2.000 -3.393 7.716
554 HE3 TRP 66 3HE TRP 66 -0.021 -7.731 10.104
555 HZ2 TRP 66 2HZ TRP 66 2.206 -3.292 10.536
556 HZ3 TRP 66 3HZ TRP 66 0.560 -6.805 12.307
557 HH2 TRP 66 HH TRP 66 1.652 -4.631 12.516
558 H GLU 67 H GLU 67 -0.510 -10.093 8.617
559 HA GLU 67 HA GLU 67 1.205 -9.498 10.901
560 1HB GLU 67 2HB GLU 67 -1.420 -9.477 10.818
561 2HB GLU 67 1HB GLU 67 -1.240 -11.204 11.095
562 1HG GLU 67 2HG GLU 67 0.185 -10.613 13.089
563 2HG GLU 67 1HG GLU 67 -0.343 -8.947 12.859
564 H ASN 68 H ASN 68 -0.123 -12.379 9.274
565 HA ASN 68 HA ASN 68 1.488 -14.154 10.863
566 1HB ASN 68 2HB ASN 68 -0.292 -14.602 8.466
567 2HB ASN 68 1HB ASN 68 0.585 -15.900 9.272
568 1HD2 ASN 68 1HD2 ASN 68 -2.096 -16.057 9.098
569 2HD2 ASN 68 2HD2 ASN 68 -2.821 -15.803 10.645
570 H ALA 69 H ALA 69 1.775 -12.601 7.757
571 HA ALA 69 HA ALA 69 4.209 -14.163 7.212
572 1HB ALA 69 1HB ALA 69 2.493 -12.554 5.326
573 2HB ALA 69 2HB ALA 69 2.590 -14.311 5.430
574 3HB ALA 69 3HB ALA 69 3.985 -13.383 4.882
575 H LYS 70 H LYS 70 6.121 -13.088 6.567
576 HA LYS 70 HA LYS 70 6.353 -10.408 7.709
577 1HB LYS 70 2HB LYS 70 8.378 -12.517 6.983
578 2HB LYS 70 1HB LYS 70 8.846 -10.878 7.412
579 1HG LYS 70 2HG LYS 70 7.101 -12.486 9.231
580 2HG LYS 70 1HG LYS 70 8.852 -12.703 9.229
581 1HD LYS 70 2HD LYS 70 9.113 -10.279 9.648
582 2HD LYS 70 1HD LYS 70 7.357 -10.133 9.744
583 1HE LYS 70 2HE LYS 70 7.250 -11.114 11.787
584 2HE LYS 70 1HE LYS 70 8.611 -12.188 11.461
585 1HZ LYS 70 1HZ LYS 70 10.087 -10.703 12.251
586 2HZ LYS 70 2HZ LYS 70 8.752 -10.113 13.106
587 3HZ LYS 70 3HZ LYS 70 9.238 -9.357 11.674
588 H LYS 71 H LYS 71 5.633 -9.020 6.152
589 HA LYS 71 HA LYS 71 7.433 -8.393 4.032
590 1HB LYS 71 2HB LYS 71 5.639 -8.608 2.239
591 2HB LYS 71 1HB LYS 71 6.406 -10.088 2.758
592 1HG LYS 71 2HG LYS 71 4.044 -9.471 4.321
593 2HG LYS 71 1HG LYS 71 3.695 -9.603 2.597
594 1HD LYS 71 2HD LYS 71 5.117 -11.665 4.281
595 2HD LYS 71 1HD LYS 71 3.450 -11.761 3.712
596 1HE LYS 71 2HE LYS 71 4.076 -12.489 1.697
597 2HE LYS 71 1HE LYS 71 5.332 -11.259 1.556
598 1HZ LYS 71 1HZ LYS 71 6.819 -12.625 2.820
599 2HZ LYS 71 2HZ LYS 71 6.200 -13.547 1.545
600 3HZ LYS 71 3HZ LYS 71 5.610 -13.771 3.115
601 H ILE 72 H ILE 72 7.482 -6.304 4.696
602 HA ILE 72 HA ILE 72 5.005 -4.773 4.366
603 HB ILE 72 HB ILE 72 5.899 -3.358 6.373
604 1HG1 ILE 72 2HG1 ILE 72 7.956 -4.837 6.572
605 2HG1 ILE 72 1HG1 ILE 72 7.081 -4.521 8.064
606 1HG2 ILE 72 1HG2 ILE 72 4.345 -4.426 7.801
607 2HG2 ILE 72 2HG2 ILE 72 4.544 -5.971 6.977
608 3HG2 ILE 72 3HG2 ILE 72 3.741 -4.633 6.157
609 1HD1 ILE 72 1HD1 ILE 72 7.377 -6.742 8.316
610 2HD1 ILE 72 2HD1 ILE 72 7.466 -7.042 6.581
611 3HD1 ILE 72 3HD1 ILE 72 5.900 -6.811 7.357
612 H GLU 73 H GLU 73 5.524 -3.560 2.640
613 HA GLU 73 HA GLU 73 7.974 -1.933 2.837
614 1HB GLU 73 2HB GLU 73 6.858 -3.166 0.312
615 2HB GLU 73 1HB GLU 73 8.256 -2.104 0.404
616 1HG GLU 73 2HG GLU 73 8.819 -4.135 2.205
617 2HG GLU 73 1HG GLU 73 8.062 -4.953 0.838
618 H VAL 74 H VAL 74 7.883 -0.025 1.278
619 HA VAL 74 HA VAL 74 5.170 1.135 1.338
620 HB VAL 74 HB VAL 74 7.767 2.676 1.410
621 1HG1 VAL 74 1HG1 VAL 74 6.425 4.567 1.966
622 2HG1 VAL 74 2HG1 VAL 74 4.979 3.569 2.121
623 3HG1 VAL 74 3HG1 VAL 74 5.716 3.814 0.537
624 1HG2 VAL 74 1HG2 VAL 74 6.022 1.690 3.650
625 2HG2 VAL 74 2HG2 VAL 74 7.097 3.075 3.835
626 3HG2 VAL 74 3HG2 VAL 74 7.761 1.490 3.441
627 H GLU 75 H GLU 75 4.476 2.362 -0.449
628 HA GLU 75 HA GLU 75 6.063 1.914 -2.888
629 1HB GLU 75 2HB GLU 75 3.596 0.996 -2.470
630 2HB GLU 75 1HB GLU 75 3.172 2.597 -3.057
631 1HG GLU 75 2HG GLU 75 4.709 2.087 -5.028
632 2HG GLU 75 1HG GLU 75 4.641 0.413 -4.483
633 H PHE 76 H PHE 76 3.462 4.186 -1.973
634 HA PHE 76 HA PHE 76 5.067 6.329 -3.197
635 1HB PHE 76 2HB PHE 76 2.295 5.587 -3.443
636 2HB PHE 76 1HB PHE 76 2.420 7.233 -2.833
637 HD1 PHE 76 1HD PHE 76 4.822 8.212 -4.183
638 HD2 PHE 76 2HD PHE 76 1.650 5.784 -5.651
639 HE1 PHE 76 1HE PHE 76 5.262 9.023 -6.463
640 HE2 PHE 76 2HE PHE 76 2.086 6.589 -7.935
641 HZ PHE 76 HZ PHE 76 3.894 8.211 -8.343
642 H ASP 77 H ASP 77 5.989 7.692 -1.844
643 HA ASP 77 HA ASP 77 4.827 8.068 0.829
644 1HB ASP 77 2HB ASP 77 7.315 7.336 0.352
645 2HB ASP 77 1HB ASP 77 7.553 9.060 0.086
646 H LYS 78 H LYS 78 3.272 9.615 0.352
647 HA LYS 78 HA LYS 78 3.666 11.875 -1.254
648 1HB LYS 78 2HB LYS 78 1.751 11.415 1.037
649 2HB LYS 78 1HB LYS 78 1.680 12.804 -0.039
650 1HG LYS 78 2HG LYS 78 1.729 10.197 -1.385
651 2HG LYS 78 1HG LYS 78 0.301 10.506 -0.396
652 1HD LYS 78 2HD LYS 78 -0.523 11.932 -1.897
653 2HD LYS 78 1HD LYS 78 0.998 12.824 -1.976
654 1HE LYS 78 2HE LYS 78 1.828 10.897 -3.447
655 2HE LYS 78 1HE LYS 78 0.132 10.440 -3.584
656 1HZ LYS 78 1HZ LYS 78 0.767 11.830 -5.426
657 2HZ LYS 78 2HZ LYS 78 1.319 13.042 -4.384
658 3HZ LYS 78 3HZ LYS 78 -0.329 12.672 -4.450
659 H GLY 79 H GLY 79 3.018 12.285 2.205
660 1HA GLY 79 2HA GLY 79 4.388 13.318 3.814
661 2HA GLY 79 1HA GLY 79 5.506 13.771 2.538
662 H GLN 80 H GLN 80 3.308 14.870 0.873
663 HA GLN 80 HA GLN 80 2.932 17.378 2.365
664 1HB GLN 80 2HB GLN 80 3.702 16.779 -0.410
665 2HB GLN 80 1HB GLN 80 2.490 18.044 -0.251
666 1HG GLN 80 2HG GLN 80 4.185 18.913 1.590
667 2HG GLN 80 1HG GLN 80 5.328 18.012 0.596
668 1HE2 GLN 80 1HE2 GLN 80 6.300 19.196 -0.870
669 2HE2 GLN 80 2HE2 GLN 80 5.639 20.569 -1.682
670 H ARG 81 H ARG 81 1.371 15.040 0.237
671 HA ARG 81 HA ARG 81 -1.148 16.409 0.220
672 1HB ARG 81 2HB ARG 81 -0.031 14.482 -1.353
673 2HB ARG 81 1HB ARG 81 -1.143 13.525 -0.386
674 1HG ARG 81 2HG ARG 81 -2.981 15.013 -1.060
675 2HG ARG 81 1HG ARG 81 -1.852 15.919 -2.071
676 1HD ARG 81 2HD ARG 81 -1.408 13.378 -2.922
677 2HD ARG 81 1HD ARG 81 -3.121 13.307 -2.518
678 HE ARG 81 HE ARG 81 -1.939 14.647 -4.737
679 1HH1 ARG 81 1HH1 ARG 81 -4.603 14.779 -2.488
680 2HH1 ARG 81 2HH1 ARG 81 -5.632 15.661 -3.566
681 1HH2 ARG 81 1HH2 ARG 81 -3.290 15.809 -6.155
682 2HH2 ARG 81 2HH2 ARG 81 -4.887 16.246 -5.648
683 H THR 82 H THR 82 -0.892 16.537 2.713
684 HA THR 82 HA THR 82 -1.797 14.155 4.106
685 HB THR 82 HB THR 82 -1.394 15.334 6.115
686 HG1 THR 82 1HG THR 82 -1.121 17.588 6.150
687 1HG2 THR 82 1HG2 THR 82 0.820 15.978 6.012
688 2HG2 THR 82 2HG2 THR 82 0.655 16.657 4.394
689 3HG2 THR 82 3HG2 THR 82 0.657 14.909 4.620
690 H ASP 83 H ASP 83 -3.748 14.039 5.314
691 HA ASP 83 HA ASP 83 -5.829 15.888 4.345
692 1HB ASP 83 2HB ASP 83 -6.029 13.515 3.567
693 2HB ASP 83 1HB ASP 83 -6.218 13.029 5.249
694 H LYS 84 H LYS 84 -4.998 13.786 7.115
695 HA LYS 84 HA LYS 84 -6.486 15.654 8.839
696 1HB LYS 84 2HB LYS 84 -6.214 12.728 8.807
697 2HB LYS 84 1HB LYS 84 -6.046 13.451 10.402
698 1HG LYS 84 2HG LYS 84 -8.243 13.619 10.563
699 2HG LYS 84 1HG LYS 84 -8.277 14.657 9.138
700 1HD LYS 84 2HD LYS 84 -8.058 12.337 7.885
701 2HD LYS 84 1HD LYS 84 -8.779 11.734 9.378
702 1HE LYS 84 2HE LYS 84 -10.204 14.061 8.569
703 2HE LYS 84 1HE LYS 84 -10.054 12.991 7.176
704 1HZ LYS 84 1HZ LYS 84 -11.533 12.619 9.649
705 2HZ LYS 84 2HZ LYS 84 -10.746 11.245 9.052
706 3HZ LYS 84 3HZ LYS 84 -11.872 12.060 8.088
707 H TYR 85 H TYR 85 -3.753 13.381 9.181
708 HA TYR 85 HA TYR 85 -2.234 15.528 10.488
709 1HB TYR 85 2HB TYR 85 -3.222 13.114 11.719
710 2HB TYR 85 1HB TYR 85 -1.462 13.135 11.754
711 HD1 TYR 85 1HD TYR 85 -0.473 14.096 13.598
712 HD2 TYR 85 2HD TYR 85 -4.303 15.490 12.378
713 HE1 TYR 85 1HE TYR 85 -0.525 15.620 15.528
714 HE2 TYR 85 2HE TYR 85 -4.366 17.018 14.304
715 HH TYR 85 HH TYR 85 -1.696 17.815 16.109
716 H GLY 86 H GLY 86 -2.279 13.811 7.848
717 1HA GLY 86 2HA GLY 86 -0.080 14.019 6.622
718 2HA GLY 86 1HA GLY 86 0.581 13.076 7.948
719 H ARG 87 H ARG 87 -2.464 11.909 7.435
720 HA ARG 87 HA ARG 87 -1.421 9.778 5.697
721 1HB ARG 87 2HB ARG 87 -3.135 8.334 6.685
722 2HB ARG 87 1HB ARG 87 -2.095 9.025 7.924
723 1HG ARG 87 2HG ARG 87 -3.952 10.827 8.113
724 2HG ARG 87 1HG ARG 87 -4.954 9.623 7.302
725 1HD ARG 87 2HD ARG 87 -3.417 8.463 9.466
726 2HD ARG 87 1HD ARG 87 -4.424 9.795 10.026
727 HE ARG 87 HE ARG 87 -5.864 7.992 8.349
728 1HH1 ARG 87 1HH1 ARG 87 -4.688 8.464 11.600
729 2HH1 ARG 87 2HH1 ARG 87 -5.906 7.466 12.319
730 1HH2 ARG 87 1HH2 ARG 87 -7.468 6.679 9.294
731 2HH2 ARG 87 2HH2 ARG 87 -7.485 6.452 11.010
732 H GLY 88 H GLY 88 -1.922 10.430 3.666
733 1HA GLY 88 2HA GLY 88 -4.765 11.036 3.125
734 2HA GLY 88 1HA GLY 88 -3.433 11.727 2.209
735 H LEU 89 H LEU 89 -2.238 10.367 0.782
736 HA LEU 89 HA LEU 89 -3.835 8.102 -0.188
737 1HB LEU 89 2HB LEU 89 -3.260 10.051 -1.705
738 2HB LEU 89 1HB LEU 89 -1.595 9.507 -1.632
739 HG LEU 89 HG LEU 89 -2.308 7.326 -2.594
740 1HD1 LEU 89 1HD1 LEU 89 -4.607 7.548 -3.812
741 2HD1 LEU 89 2HD1 LEU 89 -4.957 8.693 -2.517
742 3HD1 LEU 89 3HD1 LEU 89 -4.539 7.024 -2.130
743 1HD2 LEU 89 1HD2 LEU 89 -2.614 9.920 -4.029
744 2HD2 LEU 89 2HD2 LEU 89 -3.000 8.421 -4.873
745 3HD2 LEU 89 3HD2 LEU 89 -1.385 8.668 -4.209
746 H ALA 90 H ALA 90 -3.158 6.320 0.891
747 HA ALA 90 HA ALA 90 -0.452 5.415 0.376
748 1HB ALA 90 1HB ALA 90 -1.375 5.375 3.225
749 2HB ALA 90 2HB ALA 90 -0.495 6.752 2.563
750 3HB ALA 90 3HB ALA 90 0.251 5.156 2.581
751 H TYR 91 H TYR 91 -0.301 3.248 0.196
752 HA TYR 91 HA TYR 91 -2.460 1.550 1.198
753 1HB TYR 91 2HB TYR 91 -1.876 0.524 -1.357
754 2HB TYR 91 1HB TYR 91 -3.373 1.290 -0.834
755 HD1 TYR 91 1HD TYR 91 -0.430 1.594 -2.895
756 HD2 TYR 91 2HD TYR 91 -3.654 3.762 -1.163
757 HE1 TYR 91 1HE TYR 91 -0.030 3.436 -4.474
758 HE2 TYR 91 2HE TYR 91 -3.269 5.608 -2.736
759 HH TYR 91 HH TYR 91 -0.994 6.399 -4.125
760 H ILE 92 H ILE 92 -1.600 -0.129 2.227
761 HA ILE 92 HA ILE 92 1.208 -0.771 1.823
762 HB ILE 92 HB ILE 92 0.959 -2.230 3.784
763 1HG1 ILE 92 2HG1 ILE 92 -1.740 -1.225 4.434
764 2HG1 ILE 92 1HG1 ILE 92 -1.676 -2.391 3.115
765 1HG2 ILE 92 1HG2 ILE 92 0.674 -0.499 5.422
766 2HG2 ILE 92 2HG2 ILE 92 -0.244 0.486 4.285
767 3HG2 ILE 92 3HG2 ILE 92 1.472 0.191 4.009
768 1HD1 ILE 92 1HD1 ILE 92 -1.614 -2.869 5.895
769 2HD1 ILE 92 2HD1 ILE 92 -0.055 -3.358 5.232
770 3HD1 ILE 92 3HD1 ILE 92 -1.546 -4.037 4.577
771 H TYR 93 H TYR 93 1.989 -2.855 1.347
772 HA TYR 93 HA TYR 93 0.031 -4.801 0.374
773 1HB TYR 93 2HB TYR 93 1.797 -5.204 -1.541
774 2HB TYR 93 1HB TYR 93 0.531 -3.997 -1.715
775 HD1 TYR 93 1HD TYR 93 3.607 -3.642 0.326
776 HD2 TYR 93 2HD TYR 93 1.579 -2.549 -3.249
777 HE1 TYR 93 1HE TYR 93 5.327 -1.946 -0.129
778 HE2 TYR 93 2HE TYR 93 3.291 -0.848 -3.710
779 HH TYR 93 HH TYR 93 5.759 -0.504 -3.069
780 H ALA 94 H ALA 94 1.114 -6.927 -0.153
781 HA ALA 94 HA ALA 94 2.918 -7.567 2.046
782 1HB ALA 94 1HB ALA 94 2.370 -9.966 1.163
783 2HB ALA 94 2HB ALA 94 1.046 -9.139 0.341
784 3HB ALA 94 3HB ALA 94 1.179 -9.062 2.098
785 H ASP 95 H ASP 95 4.968 -7.100 1.463
786 HA ASP 95 HA ASP 95 7.028 -7.553 0.590
787 1HB ASP 95 2HB ASP 95 5.695 -9.884 0.061
788 2HB ASP 95 1HB ASP 95 6.170 -9.373 -1.556
789 H GLY 96 H GLY 96 4.936 -5.691 -0.529
790 1HA GLY 96 2HA GLY 96 4.652 -4.268 -2.327
791 2HA GLY 96 1HA GLY 96 6.408 -4.295 -2.356
792 H LYS 97 H LYS 97 3.859 -6.633 -3.236
793 HA LYS 97 HA LYS 97 5.354 -7.350 -5.616
794 1HB LYS 97 2HB LYS 97 3.686 -8.746 -3.906
795 2HB LYS 97 1HB LYS 97 2.698 -8.531 -5.344
796 1HG LYS 97 2HG LYS 97 5.450 -9.405 -5.860
797 2HG LYS 97 1HG LYS 97 4.454 -10.554 -4.966
798 1HD LYS 97 2HD LYS 97 3.290 -9.255 -7.377
799 2HD LYS 97 1HD LYS 97 4.500 -10.521 -7.611
800 1HE LYS 97 2HE LYS 97 2.899 -11.672 -5.752
801 2HE LYS 97 1HE LYS 97 1.727 -10.698 -6.640
802 1HZ LYS 97 1HZ LYS 97 3.474 -12.849 -7.676
803 2HZ LYS 97 2HZ LYS 97 2.720 -11.740 -8.704
804 3HZ LYS 97 3HZ LYS 97 1.786 -12.754 -7.725
805 H MET 98 H MET 98 5.212 -5.783 -7.134
806 HA MET 98 HA MET 98 2.635 -4.577 -7.750
807 1HB MET 98 2HB MET 98 5.369 -3.776 -7.980
808 2HB MET 98 1HB MET 98 4.642 -3.733 -9.581
809 1HG MET 98 2HG MET 98 3.562 -2.356 -7.133
810 2HG MET 98 1HG MET 98 4.474 -1.587 -8.429
811 1HE MET 98 1HE MET 98 1.534 -2.004 -6.836
812 2HE MET 98 2HE MET 98 0.606 -3.185 -7.761
813 3HE MET 98 3HE MET 98 0.275 -1.463 -7.946
814 H VAL 99 H VAL 99 1.464 -4.951 -9.563
815 HA VAL 99 HA VAL 99 2.390 -7.140 -11.291
816 HB VAL 99 HB VAL 99 -0.078 -7.169 -12.007
817 1HG1 VAL 99 1HG1 VAL 99 0.236 -7.903 -9.129
818 2HG1 VAL 99 2HG1 VAL 99 1.223 -8.704 -10.353
819 3HG1 VAL 99 3HG1 VAL 99 -0.535 -8.796 -10.440
820 1HG2 VAL 99 1HG2 VAL 99 -0.391 -5.672 -9.406
821 2HG2 VAL 99 2HG2 VAL 99 -1.681 -6.263 -10.453
822 3HG2 VAL 99 3HG2 VAL 99 -0.623 -4.965 -11.004
823 H ASN 100 H ASN 100 3.623 -6.014 -12.774
824 HA ASN 100 HA ASN 100 2.219 -4.809 -14.928
825 1HB ASN 100 2HB ASN 100 3.390 -2.585 -14.801
826 2HB ASN 100 1HB ASN 100 2.151 -2.837 -13.575
827 1HD2 ASN 100 1HD2 ASN 100 5.057 -1.547 -14.015
828 2HD2 ASN 100 2HD2 ASN 100 5.746 -1.753 -12.445
829 H GLU 101 H GLU 101 5.333 -5.200 -13.298
830 HA GLU 101 HA GLU 101 7.380 -5.842 -14.050
831 1HB GLU 101 2HB GLU 101 5.785 -6.831 -16.421
832 2HB GLU 101 1HB GLU 101 7.473 -7.216 -16.117
833 1HG GLU 101 2HG GLU 101 6.787 -8.256 -13.968
834 2HG GLU 101 1HG GLU 101 5.106 -7.985 -14.428
835 H ALA 102 H ALA 102 8.649 -4.145 -14.425
836 HA ALA 102 HA ALA 102 8.467 -2.842 -17.059
837 1HB ALA 102 1HB ALA 102 9.296 -0.751 -15.780
838 2HB ALA 102 2HB ALA 102 8.663 -1.574 -14.355
839 3HB ALA 102 3HB ALA 102 7.588 -1.182 -15.697
840 H LEU 103 H LEU 103 10.647 -2.518 -14.265
841 HA LEU 103 HA LEU 103 12.908 -2.681 -14.070
842 1HB LEU 103 2HB LEU 103 12.588 -4.686 -16.304
843 2HB LEU 103 1HB LEU 103 14.018 -4.494 -15.309
844 HG LEU 103 HG LEU 103 12.251 -4.942 -13.360
845 1HD1 LEU 103 1HD1 LEU 103 10.244 -5.340 -14.320
846 2HD1 LEU 103 2HD1 LEU 103 10.905 -6.967 -14.476
847 3HD1 LEU 103 3HD1 LEU 103 10.953 -5.859 -15.848
848 1HD2 LEU 103 1HD2 LEU 103 12.793 -7.495 -13.952
849 2HD2 LEU 103 2HD2 LEU 103 13.990 -6.387 -13.282
850 3HD2 LEU 103 3HD2 LEU 103 13.951 -6.699 -15.017
851 H VAL 104 H VAL 104 13.887 -0.842 -14.639
852 HA VAL 104 HA VAL 104 14.099 -0.131 -17.467
853 HB VAL 104 HB VAL 104 14.952 1.517 -15.087
854 1HG1 VAL 104 1HG1 VAL 104 14.100 2.771 -17.611
855 2HG1 VAL 104 2HG1 VAL 104 15.614 1.870 -17.676
856 3HG1 VAL 104 3HG1 VAL 104 15.421 3.191 -16.523
857 1HG2 VAL 104 1HG2 VAL 104 12.288 1.122 -16.347
858 2HG2 VAL 104 2HG2 VAL 104 12.727 2.745 -15.815
859 3HG2 VAL 104 3HG2 VAL 104 12.708 1.413 -14.660
860 H ARG 105 H ARG 105 16.303 0.103 -14.671
861 HA ARG 105 HA ARG 105 18.330 -1.500 -15.780
862 1HB ARG 105 2HB ARG 105 18.349 0.556 -17.316
863 2HB ARG 105 1HB ARG 105 19.010 1.429 -15.941
864 1HG ARG 105 2HG ARG 105 21.036 0.473 -16.135
865 2HG ARG 105 1HG ARG 105 20.372 -1.091 -16.615
866 1HD ARG 105 2HD ARG 105 19.732 0.404 -18.773
867 2HD ARG 105 1HD ARG 105 21.218 1.202 -18.261
868 HE ARG 105 HE ARG 105 22.400 -0.637 -18.941
869 1HH1 ARG 105 1HH1 ARG 105 19.021 -1.481 -18.732
870 2HH1 ARG 105 2HH1 ARG 105 19.235 -3.034 -19.469
871 1HH2 ARG 105 1HH2 ARG 105 22.684 -2.679 -19.910
872 2HH2 ARG 105 2HH2 ARG 105 21.313 -3.713 -20.137
873 H GLN 106 H GLN 106 17.845 1.450 -13.851
874 HA GLN 106 HA GLN 106 19.279 0.133 -11.647
875 1HB GLN 106 2HB GLN 106 20.398 2.165 -13.045
876 2HB GLN 106 1HB GLN 106 19.529 3.074 -11.817
877 1HG GLN 106 2HG GLN 106 21.591 0.936 -11.344
878 2HG GLN 106 1HG GLN 106 21.790 2.671 -11.100
879 1HE2 GLN 106 1HE2 GLN 106 20.544 -0.274 -9.829
880 2HE2 GLN 106 2HE2 GLN 106 20.043 0.343 -8.295
881 H GLY 107 H GLY 107 17.080 2.769 -12.564
882 1HA GLY 107 2HA GLY 107 14.886 2.413 -11.227
883 2HA GLY 107 1HA GLY 107 15.943 2.709 -9.854
884 H LEU 108 H LEU 108 15.862 4.269 -13.043
885 HA LEU 108 HA LEU 108 14.983 6.757 -11.766
886 1HB LEU 108 2HB LEU 108 17.592 6.227 -13.013
887 2HB LEU 108 1HB LEU 108 16.802 7.685 -13.582
888 HG LEU 108 HG LEU 108 16.515 8.160 -11.005
889 1HD1 LEU 108 1HD1 LEU 108 18.851 6.261 -11.114
890 2HD1 LEU 108 2HD1 LEU 108 17.370 6.087 -10.171
891 3HD1 LEU 108 3HD1 LEU 108 18.524 7.360 -9.773
892 1HD2 LEU 108 1HD2 LEU 108 17.692 9.776 -12.095
893 2HD2 LEU 108 2HD2 LEU 108 18.791 8.623 -12.853
894 3HD2 LEU 108 3HD2 LEU 108 19.004 9.061 -11.157
895 H ALA 109 H ALA 109 15.872 5.283 -14.888
896 HA ALA 109 HA ALA 109 14.895 5.356 -16.940
897 1HB ALA 109 1HB ALA 109 12.782 5.106 -15.047
898 2HB ALA 109 2HB ALA 109 12.849 4.526 -16.711
899 3HB ALA 109 3HB ALA 109 12.236 6.143 -16.366
900 H LYS 110 H LYS 110 16.115 7.197 -17.555
901 HA LYS 110 HA LYS 110 14.466 9.468 -18.233
902 1HB LYS 110 2HB LYS 110 16.206 9.562 -15.949
903 2HB LYS 110 1HB LYS 110 16.795 10.675 -17.176
904 1HG LYS 110 2HG LYS 110 13.900 10.764 -16.656
905 2HG LYS 110 1HG LYS 110 14.941 11.307 -15.339
906 1HD LYS 110 2HD LYS 110 16.120 12.747 -17.074
907 2HD LYS 110 1HD LYS 110 14.765 12.381 -18.144
908 1HE LYS 110 2HE LYS 110 13.212 13.389 -16.624
909 2HE LYS 110 1HE LYS 110 14.464 13.586 -15.399
910 1HZ LYS 110 1HZ LYS 110 14.522 14.909 -18.055
911 2HZ LYS 110 2HZ LYS 110 15.563 15.192 -16.754
912 3HZ LYS 110 3HZ LYS 110 13.936 15.641 -16.647
Start of MODEL 8
1 1H ALA 1 1HT ALA 1 1.091 10.611 -24.557
2 2H ALA 1 2HT ALA 1 1.858 9.550 -25.667
3 3H ALA 1 3HT ALA 1 2.182 11.236 -25.721
4 HA ALA 1 HA ALA 1 3.876 9.729 -24.672
5 1HB ALA 1 1HB ALA 1 2.905 12.023 -22.988
6 2HB ALA 1 2HB ALA 1 3.706 12.247 -24.542
7 3HB ALA 1 3HB ALA 1 4.560 11.459 -23.216
8 H THR 2 H THR 2 4.224 8.198 -23.195
9 HA THR 2 HA THR 2 2.155 7.760 -21.145
10 HB THR 2 HB THR 2 4.101 5.661 -22.066
11 HG1 THR 2 1HG THR 2 1.568 6.199 -23.219
12 1HG2 THR 2 1HG2 THR 2 1.401 5.600 -20.764
13 2HG2 THR 2 2HG2 THR 2 2.924 4.930 -20.179
14 3HG2 THR 2 3HG2 THR 2 2.107 4.190 -21.556
15 H SER 3 H SER 3 2.972 8.945 -19.463
16 HA SER 3 HA SER 3 5.723 8.395 -18.603
17 1HB SER 3 2HB SER 3 5.248 10.749 -18.823
18 2HB SER 3 1HB SER 3 3.789 10.594 -17.845
19 HG SER 3 HG SER 3 5.703 11.413 -16.735
20 H THR 4 H THR 4 5.964 6.849 -17.142
21 HA THR 4 HA THR 4 3.779 6.330 -15.246
22 HB THR 4 HB THR 4 5.156 4.168 -14.864
23 HG1 THR 4 1HG THR 4 7.015 4.673 -15.950
24 1HG2 THR 4 1HG2 THR 4 3.006 4.221 -16.074
25 2HG2 THR 4 2HG2 THR 4 4.134 3.013 -16.692
26 3HG2 THR 4 3HG2 THR 4 3.894 4.524 -17.568
27 H LYS 5 H LYS 5 4.023 7.112 -13.267
28 HA LYS 5 HA LYS 5 6.686 7.818 -12.310
29 1HB LYS 5 2HB LYS 5 4.317 9.141 -12.144
30 2HB LYS 5 1HB LYS 5 4.354 8.338 -10.581
31 1HG LYS 5 2HG LYS 5 5.742 9.869 -9.800
32 2HG LYS 5 1HG LYS 5 6.915 9.476 -11.060
33 1HD LYS 5 2HD LYS 5 5.161 10.954 -12.482
34 2HD LYS 5 1HD LYS 5 4.978 11.697 -10.891
35 1HE LYS 5 2HE LYS 5 6.703 12.789 -12.296
36 2HE LYS 5 1HE LYS 5 7.334 12.157 -10.776
37 1HZ LYS 5 1HZ LYS 5 8.552 10.584 -11.827
38 2HZ LYS 5 2HZ LYS 5 8.518 11.720 -13.081
39 3HZ LYS 5 3HZ LYS 5 7.458 10.402 -13.104
40 H LYS 6 H LYS 6 7.789 6.324 -11.240
41 HA LYS 6 HA LYS 6 6.312 4.497 -9.460
42 1HB LYS 6 2HB LYS 6 8.926 4.007 -10.899
43 2HB LYS 6 1HB LYS 6 8.131 2.877 -9.808
44 1HG LYS 6 2HG LYS 6 6.296 2.610 -11.317
45 2HG LYS 6 1HG LYS 6 6.901 3.903 -12.356
46 1HD LYS 6 2HD LYS 6 7.482 1.835 -13.389
47 2HD LYS 6 1HD LYS 6 8.963 2.519 -12.717
48 1HE LYS 6 2HE LYS 6 9.253 0.785 -11.341
49 2HE LYS 6 1HE LYS 6 7.570 0.816 -10.821
50 1HZ LYS 6 1HZ LYS 6 8.783 -0.637 -13.080
51 2HZ LYS 6 2HZ LYS 6 7.136 -0.255 -13.104
52 3HZ LYS 6 3HZ LYS 6 7.761 -1.219 -11.862
53 H LEU 7 H LEU 7 7.014 4.221 -7.386
54 HA LEU 7 HA LEU 7 9.060 6.113 -6.470
55 1HB LEU 7 2HB LEU 7 6.506 5.549 -5.536
56 2HB LEU 7 1HB LEU 7 7.558 4.743 -4.389
57 HG LEU 7 HG LEU 7 6.959 7.011 -3.665
58 1HD1 LEU 7 1HD1 LEU 7 8.976 7.374 -2.730
59 2HD1 LEU 7 2HD1 LEU 7 9.821 7.336 -4.278
60 3HD1 LEU 7 3HD1 LEU 7 9.368 5.828 -3.483
61 1HD2 LEU 7 1HD2 LEU 7 7.677 8.956 -4.844
62 2HD2 LEU 7 2HD2 LEU 7 6.781 7.945 -5.978
63 3HD2 LEU 7 3HD2 LEU 7 8.544 7.986 -6.033
64 H HIS 8 H HIS 8 10.669 5.469 -4.983
65 HA HIS 8 HA HIS 8 11.196 2.570 -4.942
66 1HB HIS 8 2HB HIS 8 12.715 4.051 -6.402
67 2HB HIS 8 1HB HIS 8 13.359 4.665 -4.883
68 HD1 HIS 8 1HD HIS 8 12.515 1.062 -5.726
69 HD2 HIS 8 2HD HIS 8 15.791 3.446 -4.801
70 HE1 HIS 8 1HE HIS 8 14.456 -0.521 -5.495
71 HE2 HIS 8 2HE HIS 8 16.444 0.953 -5.027
72 H LYS 9 H LYS 9 10.240 2.293 -2.918
73 HA LYS 9 HA LYS 9 11.711 3.523 -0.681
74 1HB LYS 9 2HB LYS 9 9.108 3.984 -1.167
75 2HB LYS 9 1HB LYS 9 8.960 2.517 -0.209
76 1HG LYS 9 2HG LYS 9 8.771 4.360 1.271
77 2HG LYS 9 1HG LYS 9 10.351 3.623 1.549
78 1HD LYS 9 2HD LYS 9 11.022 5.788 1.427
79 2HD LYS 9 1HD LYS 9 11.046 5.423 -0.299
80 1HE LYS 9 2HE LYS 9 9.667 7.152 -0.569
81 2HE LYS 9 1HE LYS 9 8.423 6.165 0.195
82 1HZ LYS 9 1HZ LYS 9 8.347 7.889 1.615
83 2HZ LYS 9 2HZ LYS 9 9.914 8.415 1.258
84 3HZ LYS 9 3HZ LYS 9 9.680 7.130 2.334
85 H GLU 10 H GLU 10 11.860 2.217 1.264
86 HA GLU 10 HA GLU 10 12.035 -0.643 0.612
87 1HB GLU 10 2HB GLU 10 13.339 0.725 2.960
88 2HB GLU 10 1HB GLU 10 13.739 -0.834 2.253
89 1HG GLU 10 2HG GLU 10 15.214 0.101 0.901
90 2HG GLU 10 1HG GLU 10 13.994 1.201 0.264
91 HA PRO 11 HA PRO 11 8.924 -1.589 3.592
92 1HB PRO 11 2HB PRO 11 9.600 -4.065 4.378
93 2HB PRO 11 1HB PRO 11 9.066 -3.728 2.727
94 1HG PRO 11 2HG PRO 11 11.840 -4.105 3.784
95 2HG PRO 11 1HG PRO 11 11.120 -4.720 2.285
96 1HD PRO 11 2HD PRO 11 12.730 -2.501 2.418
97 2HD PRO 11 1HD PRO 11 11.511 -2.768 1.156
98 H ALA 12 H ALA 12 8.443 -1.864 5.819
99 HA ALA 12 HA ALA 12 10.734 -1.402 7.614
100 1HB ALA 12 1HB ALA 12 8.130 -0.009 7.389
101 2HB ALA 12 2HB ALA 12 9.723 0.621 7.804
102 3HB ALA 12 3HB ALA 12 8.779 -0.254 9.009
103 H THR 13 H THR 13 7.390 -1.811 8.630
104 HA THR 13 HA THR 13 7.302 -4.538 9.100
105 HB THR 13 HB THR 13 7.682 -4.048 11.778
106 HG1 THR 13 1HG THR 13 9.434 -2.814 12.041
107 1HG2 THR 13 1HG2 THR 13 10.151 -4.874 10.479
108 2HG2 THR 13 2HG2 THR 13 8.731 -5.768 9.936
109 3HG2 THR 13 3HG2 THR 13 9.140 -5.719 11.650
110 H LEU 14 H LEU 14 5.613 -5.152 10.709
111 HA LEU 14 HA LEU 14 3.476 -3.175 10.643
112 1HB LEU 14 2HB LEU 14 2.035 -5.046 11.350
113 2HB LEU 14 1HB LEU 14 2.925 -5.392 9.879
114 HG LEU 14 HG LEU 14 4.573 -6.401 11.863
115 1HD1 LEU 14 1HD1 LEU 14 2.312 -6.008 13.230
116 2HD1 LEU 14 2HD1 LEU 14 3.394 -7.368 13.533
117 3HD1 LEU 14 3HD1 LEU 14 1.954 -7.591 12.540
118 1HD2 LEU 14 1HD2 LEU 14 2.471 -7.963 10.379
119 2HD2 LEU 14 2HD2 LEU 14 4.048 -8.524 10.935
120 3HD2 LEU 14 3HD2 LEU 14 3.942 -7.349 9.624
121 H ILE 15 H ILE 15 2.503 -2.281 12.419
122 HA ILE 15 HA ILE 15 3.649 -2.977 15.042
123 HB ILE 15 HB ILE 15 2.739 -0.184 14.462
124 1HG1 ILE 15 2HG1 ILE 15 5.513 -1.268 13.933
125 2HG1 ILE 15 1HG1 ILE 15 4.372 -0.730 12.703
126 1HG2 ILE 15 1HG2 ILE 15 4.833 -0.014 16.147
127 2HG2 ILE 15 2HG2 ILE 15 4.221 -1.615 16.559
128 3HG2 ILE 15 3HG2 ILE 15 3.161 -0.210 16.671
129 1HD1 ILE 15 1HD1 ILE 15 5.282 1.111 14.879
130 2HD1 ILE 15 2HD1 ILE 15 4.599 1.503 13.300
131 3HD1 ILE 15 3HD1 ILE 15 6.239 0.866 13.417
132 H LYS 16 H LYS 16 1.072 -0.712 14.075
133 HA LYS 16 HA LYS 16 -0.920 -2.438 15.326
134 1HB LYS 16 2HB LYS 16 -0.220 0.335 16.272
135 2HB LYS 16 1HB LYS 16 -1.801 -0.376 16.574
136 1HG LYS 16 2HG LYS 16 -0.989 -1.891 18.077
137 2HG LYS 16 1HG LYS 16 0.611 -1.936 17.335
138 1HD LYS 16 2HD LYS 16 1.235 -0.655 19.067
139 2HD LYS 16 1HD LYS 16 0.455 0.657 18.183
140 1HE LYS 16 2HE LYS 16 -1.533 0.453 19.446
141 2HE LYS 16 1HE LYS 16 -1.031 -1.096 20.123
142 1HZ LYS 16 1HZ LYS 16 -0.052 1.609 20.785
143 2HZ LYS 16 2HZ LYS 16 0.885 0.242 21.125
144 3HZ LYS 16 3HZ LYS 16 -0.644 0.411 21.824
145 H ALA 17 H ALA 17 -2.915 -2.268 14.434
146 HA ALA 17 HA ALA 17 -3.346 -0.112 12.471
147 1HB ALA 17 1HB ALA 17 -3.915 -3.052 12.172
148 2HB ALA 17 2HB ALA 17 -2.883 -2.034 11.168
149 3HB ALA 17 3HB ALA 17 -4.634 -1.823 11.131
150 H ILE 18 H ILE 18 -4.837 1.150 13.405
151 HA ILE 18 HA ILE 18 -6.683 0.464 15.332
152 HB ILE 18 HB ILE 18 -6.421 2.747 15.069
153 1HG1 ILE 18 2HG1 ILE 18 -8.950 2.700 13.507
154 2HG1 ILE 18 1HG1 ILE 18 -8.926 1.802 15.023
155 1HG2 ILE 18 1HG2 ILE 18 -6.140 2.135 12.298
156 2HG2 ILE 18 2HG2 ILE 18 -5.666 3.591 13.171
157 3HG2 ILE 18 3HG2 ILE 18 -7.286 3.461 12.486
158 1HD1 ILE 18 1HD1 ILE 18 -8.389 3.776 16.253
159 2HD1 ILE 18 2HD1 ILE 18 -9.775 4.121 15.219
160 3HD1 ILE 18 3HD1 ILE 18 -8.171 4.701 14.768
161 H ASP 19 H ASP 19 -7.848 1.272 12.056
162 HA ASP 19 HA ASP 19 -9.720 -0.987 12.290
163 1HB ASP 19 2HB ASP 19 -10.186 1.830 11.748
164 2HB ASP 19 1HB ASP 19 -10.835 0.811 10.466
165 H GLY 20 H GLY 20 -9.029 1.155 9.551
166 1HA GLY 20 2HA GLY 20 -7.373 -0.664 8.149
167 2HA GLY 20 1HA GLY 20 -9.039 -0.855 7.626
168 H ASP 21 H ASP 21 -7.623 2.191 8.646
169 HA ASP 21 HA ASP 21 -7.781 3.128 5.857
170 1HB ASP 21 2HB ASP 21 -9.492 3.963 7.714
171 2HB ASP 21 1HB ASP 21 -8.165 5.055 8.100
172 H THR 22 H THR 22 -6.109 3.335 8.945
173 HA THR 22 HA THR 22 -3.708 4.204 7.549
174 HB THR 22 HB THR 22 -4.473 6.340 8.171
175 HG1 THR 22 1HG THR 22 -2.322 5.851 8.911
176 1HG2 THR 22 1HG2 THR 22 -5.043 5.408 10.967
177 2HG2 THR 22 2HG2 THR 22 -6.274 5.542 9.713
178 3HG2 THR 22 3HG2 THR 22 -5.403 6.978 10.250
179 H VAL 23 H VAL 23 -1.847 3.436 8.443
180 HA VAL 23 HA VAL 23 -1.954 2.219 11.100
181 HB VAL 23 HB VAL 23 -0.925 0.702 8.701
182 1HG1 VAL 23 1HG1 VAL 23 -0.089 0.410 11.217
183 2HG1 VAL 23 2HG1 VAL 23 -0.269 -0.952 10.112
184 3HG1 VAL 23 3HG1 VAL 23 -1.533 -0.600 11.290
185 1HG2 VAL 23 1HG2 VAL 23 -3.500 0.390 10.237
186 2HG2 VAL 23 2HG2 VAL 23 -2.879 -0.779 9.071
187 3HG2 VAL 23 3HG2 VAL 23 -3.323 0.844 8.543
188 H LYS 24 H LYS 24 -0.176 2.614 12.240
189 HA LYS 24 HA LYS 24 1.982 4.090 11.050
190 1HB LYS 24 2HB LYS 24 2.880 4.138 13.368
191 2HB LYS 24 1HB LYS 24 1.236 4.747 13.239
192 1HG LYS 24 2HG LYS 24 0.941 2.034 13.770
193 2HG LYS 24 1HG LYS 24 2.275 2.555 14.799
194 1HD LYS 24 2HD LYS 24 0.533 4.591 15.171
195 2HD LYS 24 1HD LYS 24 -0.585 3.253 14.903
196 1HE LYS 24 2HE LYS 24 -0.289 3.106 17.172
197 2HE LYS 24 1HE LYS 24 0.979 2.017 16.608
198 1HZ LYS 24 1HZ LYS 24 1.199 4.605 17.908
199 2HZ LYS 24 2HZ LYS 24 2.292 4.330 16.646
200 3HZ LYS 24 3HZ LYS 24 2.238 3.271 17.963
201 H LEU 25 H LEU 25 4.103 3.478 10.817
202 HA LEU 25 HA LEU 25 4.806 0.695 11.418
203 1HB LEU 25 2HB LEU 25 6.021 0.673 9.177
204 2HB LEU 25 1HB LEU 25 4.277 0.495 9.151
205 HG LEU 25 HG LEU 25 4.927 3.277 8.927
206 1HD1 LEU 25 1HD1 LEU 25 7.070 2.080 8.025
207 2HD1 LEU 25 2HD1 LEU 25 6.356 3.428 7.140
208 3HD1 LEU 25 3HD1 LEU 25 6.054 1.772 6.616
209 1HD2 LEU 25 1HD2 LEU 25 2.845 2.326 8.181
210 2HD2 LEU 25 2HD2 LEU 25 3.689 1.277 7.042
211 3HD2 LEU 25 3HD2 LEU 25 3.690 3.023 6.798
212 H MET 26 H MET 26 7.202 0.329 11.233
213 HA MET 26 HA MET 26 8.573 2.529 12.526
214 1HB MET 26 2HB MET 26 9.408 -0.305 11.902
215 2HB MET 26 1HB MET 26 10.453 0.859 12.704
216 1HG MET 26 2HG MET 26 7.835 -0.221 13.715
217 2HG MET 26 1HG MET 26 9.445 -0.570 14.340
218 1HE MET 26 1HE MET 26 8.682 0.670 17.209
219 2HE MET 26 2HE MET 26 7.546 -0.167 16.152
220 3HE MET 26 3HE MET 26 7.135 1.418 16.810
221 H TYR 27 H TYR 27 9.118 4.096 11.093
222 HA TYR 27 HA TYR 27 10.722 3.278 8.759
223 1HB TYR 27 2HB TYR 27 8.508 4.430 8.304
224 2HB TYR 27 1HB TYR 27 9.204 5.874 9.032
225 HD1 TYR 27 1HD TYR 27 8.827 3.991 6.035
226 HD2 TYR 27 2HD TYR 27 11.382 6.776 7.989
227 HE1 TYR 27 1HE TYR 27 9.810 4.602 3.865
228 HE2 TYR 27 2HE TYR 27 12.372 7.394 5.825
229 HH TYR 27 HH TYR 27 12.651 6.240 3.529
230 H LYS 28 H LYS 28 12.748 3.358 9.647
231 HA LYS 28 HA LYS 28 14.696 4.257 10.405
232 1HB LYS 28 2HB LYS 28 13.331 6.626 9.176
233 2HB LYS 28 1HB LYS 28 14.854 6.839 10.030
234 1HG LYS 28 2HG LYS 28 14.899 4.642 8.113
235 2HG LYS 28 1HG LYS 28 14.578 6.214 7.381
236 1HD LYS 28 2HD LYS 28 16.578 7.066 8.695
237 2HD LYS 28 1HD LYS 28 16.951 5.375 9.029
238 1HE LYS 28 2HE LYS 28 16.418 5.988 6.208
239 2HE LYS 28 1HE LYS 28 17.852 6.768 6.874
240 1HZ LYS 28 1HZ LYS 28 18.328 4.589 5.897
241 2HZ LYS 28 2HZ LYS 28 17.290 3.856 7.015
242 3HZ LYS 28 3HZ LYS 28 18.695 4.633 7.548
243 H GLY 29 H GLY 29 12.429 3.986 12.241
244 1HA GLY 29 2HA GLY 29 12.436 4.296 14.572
245 2HA GLY 29 1HA GLY 29 13.492 5.684 14.362
246 H GLN 30 H GLN 30 11.405 6.439 12.135
247 HA GLN 30 HA GLN 30 9.703 7.938 13.988
248 1HB GLN 30 2HB GLN 30 10.594 8.361 11.161
249 2HB GLN 30 1HB GLN 30 9.122 9.138 11.726
250 1HG GLN 30 2HG GLN 30 11.339 9.488 13.565
251 2HG GLN 30 1HG GLN 30 11.684 10.119 11.955
252 1HE2 GLN 30 1HE2 GLN 30 11.259 11.521 14.490
253 2HE2 GLN 30 2HE2 GLN 30 9.952 12.617 14.211
254 HA PRO 31 HA PRO 31 6.211 5.443 12.862
255 1HB PRO 31 2HB PRO 31 4.228 6.989 13.814
256 2HB PRO 31 1HB PRO 31 5.348 6.143 14.888
257 1HG PRO 31 2HG PRO 31 5.347 9.010 14.030
258 2HG PRO 31 1HG PRO 31 5.640 8.325 15.639
259 1HD PRO 31 2HD PRO 31 7.634 9.126 13.948
260 2HD PRO 31 1HD PRO 31 7.835 7.856 15.172
261 H MET 32 H MET 32 5.060 5.192 11.039
262 HA MET 32 HA MET 32 4.273 7.596 9.534
263 1HB MET 32 2HB MET 32 5.599 5.094 8.499
264 2HB MET 32 1HB MET 32 4.738 6.206 7.447
265 1HG MET 32 2HG MET 32 6.731 7.459 9.193
266 2HG MET 32 1HG MET 32 7.383 6.332 8.005
267 1HE MET 32 1HE MET 32 8.598 8.575 7.842
268 2HE MET 32 2HE MET 32 8.056 9.959 6.893
269 3HE MET 32 3HE MET 32 8.604 8.492 6.081
270 H THR 33 H THR 33 2.122 7.647 9.588
271 HA THR 33 HA THR 33 0.607 5.154 9.574
272 HB THR 33 HB THR 33 -1.192 7.282 9.768
273 HG1 THR 33 1HG THR 33 0.473 8.731 10.154
274 1HG2 THR 33 1HG2 THR 33 -1.852 6.035 11.461
275 2HG2 THR 33 2HG2 THR 33 -0.425 6.507 12.382
276 3HG2 THR 33 3HG2 THR 33 -0.374 5.083 11.342
277 H PHE 34 H PHE 34 0.856 4.586 7.395
278 HA PHE 34 HA PHE 34 -0.938 6.037 5.584
279 1HB PHE 34 2HB PHE 34 1.695 4.904 4.624
280 2HB PHE 34 1HB PHE 34 0.588 5.951 3.748
281 HD1 PHE 34 1HD PHE 34 2.500 6.044 6.964
282 HD2 PHE 34 2HD PHE 34 1.311 8.098 3.436
283 HE1 PHE 34 1HE PHE 34 3.812 8.004 7.661
284 HE2 PHE 34 2HE PHE 34 2.623 10.055 4.125
285 HZ PHE 34 HZ PHE 34 3.874 10.011 6.244
286 H ARG 35 H ARG 35 -2.532 4.537 5.349
287 HA ARG 35 HA ARG 35 -1.727 1.859 4.463
288 1HB ARG 35 2HB ARG 35 -2.294 2.063 7.003
289 2HB ARG 35 1HB ARG 35 -3.959 2.105 6.440
290 1HG ARG 35 2HG ARG 35 -3.711 -0.129 6.801
291 2HG ARG 35 1HG ARG 35 -3.222 -0.037 5.108
292 1HD ARG 35 2HD ARG 35 -0.886 0.464 6.511
293 2HD ARG 35 1HD ARG 35 -1.685 -0.795 7.451
294 HE ARG 35 HE ARG 35 -1.856 -1.712 4.910
295 1HH1 ARG 35 1HH1 ARG 35 0.793 -0.578 6.878
296 2HH1 ARG 35 2HH1 ARG 35 1.967 -1.589 6.103
297 1HH2 ARG 35 1HH2 ARG 35 -0.316 -3.043 3.890
298 2HH2 ARG 35 2HH2 ARG 35 1.337 -2.989 4.405
299 H LEU 36 H LEU 36 -2.818 1.165 2.758
300 HA LEU 36 HA LEU 36 -5.586 1.986 2.349
301 1HB LEU 36 2HB LEU 36 -3.825 3.469 1.088
302 2HB LEU 36 1HB LEU 36 -3.762 2.106 -0.011
303 HG LEU 36 HG LEU 36 -6.316 2.343 -0.161
304 1HD1 LEU 36 1HD1 LEU 36 -5.580 4.705 1.453
305 2HD1 LEU 36 2HD1 LEU 36 -7.081 3.780 1.406
306 3HD1 LEU 36 3HD1 LEU 36 -6.739 4.968 0.148
307 1HD2 LEU 36 1HD2 LEU 36 -6.019 3.450 -2.100
308 2HD2 LEU 36 2HD2 LEU 36 -4.311 3.247 -1.712
309 3HD2 LEU 36 3HD2 LEU 36 -5.125 4.765 -1.340
310 H LEU 37 H LEU 37 -6.616 0.083 2.249
311 HA LEU 37 HA LEU 37 -5.631 -1.918 0.361
312 1HB LEU 37 2HB LEU 37 -5.985 -3.733 2.003
313 2HB LEU 37 1HB LEU 37 -4.666 -2.657 2.424
314 HG LEU 37 HG LEU 37 -7.130 -1.768 3.648
315 1HD1 LEU 37 1HD1 LEU 37 -6.502 -4.650 3.777
316 2HD1 LEU 37 2HD1 LEU 37 -8.040 -3.809 3.976
317 3HD1 LEU 37 3HD1 LEU 37 -6.882 -3.855 5.305
318 1HD2 LEU 37 1HD2 LEU 37 -4.734 -1.218 4.239
319 2HD2 LEU 37 2HD2 LEU 37 -4.640 -2.824 4.962
320 3HD2 LEU 37 3HD2 LEU 37 -5.788 -1.641 5.589
321 H LEU 38 H LEU 38 -7.192 -3.344 -0.421
322 HA LEU 38 HA LEU 38 -9.935 -3.113 0.490
323 1HB LEU 38 2HB LEU 38 -10.735 -2.638 -1.847
324 2HB LEU 38 1HB LEU 38 -9.959 -1.296 -1.030
325 HG LEU 38 HG LEU 38 -8.120 -2.898 -2.654
326 1HD1 LEU 38 1HD1 LEU 38 -10.365 -2.913 -3.913
327 2HD1 LEU 38 2HD1 LEU 38 -8.917 -2.391 -4.775
328 3HD1 LEU 38 3HD1 LEU 38 -10.061 -1.194 -4.168
329 1HD2 LEU 38 1HD2 LEU 38 -7.061 -0.923 -2.882
330 2HD2 LEU 38 2HD2 LEU 38 -8.070 -0.458 -1.512
331 3HD2 LEU 38 3HD2 LEU 38 -8.558 -0.030 -3.152
332 H VAL 39 H VAL 39 -9.993 -5.277 0.925
333 HA VAL 39 HA VAL 39 -9.226 -7.161 -1.179
334 HB VAL 39 HB VAL 39 -9.511 -8.904 0.540
335 1HG1 VAL 39 1HG1 VAL 39 -7.664 -6.605 0.896
336 2HG1 VAL 39 2HG1 VAL 39 -7.316 -8.287 0.492
337 3HG1 VAL 39 3HG1 VAL 39 -7.705 -7.842 2.153
338 1HG2 VAL 39 1HG2 VAL 39 -10.855 -6.763 1.927
339 2HG2 VAL 39 2HG2 VAL 39 -9.572 -7.452 2.924
340 3HG2 VAL 39 3HG2 VAL 39 -10.840 -8.493 2.276
341 H ASP 40 H ASP 40 -10.688 -7.984 -2.498
342 HA ASP 40 HA ASP 40 -13.420 -8.423 -1.530
343 1HB ASP 40 2HB ASP 40 -12.833 -7.237 -4.246
344 2HB ASP 40 1HB ASP 40 -14.409 -7.469 -3.497
345 H THR 41 H THR 41 -13.213 -10.631 -1.470
346 HA THR 41 HA THR 41 -13.277 -11.982 -4.017
347 HB THR 41 HB THR 41 -11.458 -13.620 -2.846
348 HG1 THR 41 1HG THR 41 -11.172 -11.909 -1.216
349 1HG2 THR 41 1HG2 THR 41 -11.529 -12.129 -5.130
350 2HG2 THR 41 2HG2 THR 41 -10.217 -13.205 -4.646
351 3HG2 THR 41 3HG2 THR 41 -10.118 -11.479 -4.296
352 HA PRO 42 HA PRO 42 -16.285 -14.151 -1.483
353 1HB PRO 42 2HB PRO 42 -16.217 -16.035 -3.776
354 2HB PRO 42 1HB PRO 42 -17.595 -15.219 -3.030
355 1HG PRO 42 2HG PRO 42 -16.661 -14.440 -5.404
356 2HG PRO 42 1HG PRO 42 -17.250 -13.261 -4.216
357 1HD PRO 42 2HD PRO 42 -14.442 -13.972 -4.953
358 2HD PRO 42 1HD PRO 42 -15.137 -12.389 -4.553
359 H GLU 43 H GLU 43 -16.516 -16.295 -0.539
360 HA GLU 43 HA GLU 43 -13.919 -17.656 -0.314
361 1HB GLU 43 2HB GLU 43 -15.255 -16.590 1.699
362 2HB GLU 43 1HB GLU 43 -16.135 -18.110 1.636
363 1HG GLU 43 2HG GLU 43 -14.427 -18.399 3.225
364 2HG GLU 43 1HG GLU 43 -13.912 -19.275 1.785
365 H THR 44 H THR 44 -16.657 -18.023 -2.008
366 HA THR 44 HA THR 44 -16.734 -20.948 -1.671
367 HB THR 44 HB THR 44 -18.879 -19.814 -1.258
368 HG1 THR 44 1HG THR 44 -19.296 -21.757 -2.048
369 1HG2 THR 44 1HG2 THR 44 -18.854 -19.007 -4.152
370 2HG2 THR 44 2HG2 THR 44 -18.527 -17.903 -2.816
371 3HG2 THR 44 3HG2 THR 44 -20.103 -18.684 -2.951
372 H LYS 45 H LYS 45 -15.729 -22.076 -3.197
373 HA LYS 45 HA LYS 45 -14.812 -22.699 -5.183
374 1HB LYS 45 2HB LYS 45 -17.094 -20.984 -6.164
375 2HB LYS 45 1HB LYS 45 -16.041 -21.863 -7.261
376 1HG LYS 45 2HG LYS 45 -17.783 -23.327 -7.036
377 2HG LYS 45 1HG LYS 45 -16.676 -23.915 -5.795
378 1HD LYS 45 2HD LYS 45 -17.971 -22.336 -4.216
379 2HD LYS 45 1HD LYS 45 -19.205 -22.338 -5.476
380 1HE LYS 45 2HE LYS 45 -19.983 -24.259 -4.678
381 2HE LYS 45 1HE LYS 45 -18.444 -25.024 -5.069
382 1HZ LYS 45 1HZ LYS 45 -17.845 -23.789 -2.778
383 2HZ LYS 45 2HZ LYS 45 -18.385 -25.389 -2.870
384 3HZ LYS 45 3HZ LYS 45 -19.476 -24.149 -2.509
385 H HIS 46 H HIS 46 -14.746 -20.885 -7.611
386 HA HIS 46 HA HIS 46 -12.278 -19.620 -7.004
387 1HB HIS 46 2HB HIS 46 -12.500 -18.682 -9.332
388 2HB HIS 46 1HB HIS 46 -12.596 -20.436 -9.228
389 HD1 HIS 46 1HD HIS 46 -13.742 -19.696 -11.703
390 HD2 HIS 46 2HD HIS 46 -15.981 -19.244 -8.232
391 HE1 HIS 46 1HE HIS 46 -16.137 -19.589 -12.459
392 HE2 HIS 46 2HE HIS 46 -17.479 -19.406 -10.335
393 HA PRO 47 HA PRO 47 -14.165 -15.924 -5.283
394 1HB PRO 47 2HB PRO 47 -11.825 -14.580 -4.866
395 2HB PRO 47 1HB PRO 47 -12.444 -15.826 -3.776
396 1HG PRO 47 2HG PRO 47 -10.367 -16.046 -5.921
397 2HG PRO 47 1HG PRO 47 -10.365 -16.732 -4.284
398 1HD PRO 47 2HD PRO 47 -10.977 -18.210 -6.451
399 2HD PRO 47 1HD PRO 47 -11.758 -18.478 -4.880
400 H LYS 48 H LYS 48 -15.207 -14.871 -6.895
401 HA LYS 48 HA LYS 48 -13.567 -13.142 -8.621
402 1HB LYS 48 2HB LYS 48 -15.298 -13.438 -10.397
403 2HB LYS 48 1HB LYS 48 -14.389 -14.899 -10.038
404 1HG LYS 48 2HG LYS 48 -16.224 -16.011 -9.463
405 2HG LYS 48 1HG LYS 48 -16.787 -14.699 -8.427
406 1HD LYS 48 2HD LYS 48 -18.006 -13.712 -10.107
407 2HD LYS 48 1HD LYS 48 -16.985 -14.380 -11.383
408 1HE LYS 48 2HE LYS 48 -18.613 -16.225 -9.697
409 2HE LYS 48 1HE LYS 48 -19.407 -15.304 -10.973
410 1HZ LYS 48 1HZ LYS 48 -16.953 -16.731 -11.665
411 2HZ LYS 48 2HZ LYS 48 -18.338 -16.453 -12.593
412 3HZ LYS 48 3HZ LYS 48 -18.344 -17.660 -11.409
413 H LYS 49 H LYS 49 -13.863 -11.279 -7.468
414 HA LYS 49 HA LYS 49 -14.902 -9.461 -6.559
415 1HB LYS 49 2HB LYS 49 -15.590 -9.542 -9.102
416 2HB LYS 49 1HB LYS 49 -17.190 -9.856 -8.444
417 1HG LYS 49 2HG LYS 49 -17.455 -7.668 -8.235
418 2HG LYS 49 1HG LYS 49 -16.217 -7.693 -6.978
419 1HD LYS 49 2HD LYS 49 -15.102 -6.281 -8.316
420 2HD LYS 49 1HD LYS 49 -14.712 -7.718 -9.263
421 1HE LYS 49 2HE LYS 49 -15.643 -6.595 -10.966
422 2HE LYS 49 1HE LYS 49 -17.173 -7.073 -10.233
423 1HZ LYS 49 1HZ LYS 49 -15.749 -4.523 -9.698
424 2HZ LYS 49 2HZ LYS 49 -17.248 -4.977 -9.060
425 3HZ LYS 49 3HZ LYS 49 -17.087 -4.696 -10.721
426 H GLY 50 H GLY 50 -15.475 -10.088 -4.510
427 1HA GLY 50 2HA GLY 50 -18.245 -11.075 -4.201
428 2HA GLY 50 1HA GLY 50 -16.928 -11.615 -3.171
429 H VAL 51 H VAL 51 -16.498 -10.515 -1.352
430 HA VAL 51 HA VAL 51 -18.310 -8.496 -0.494
431 HB VAL 51 HB VAL 51 -16.909 -8.381 1.540
432 1HG1 VAL 51 1HG1 VAL 51 -18.438 -9.996 1.930
433 2HG1 VAL 51 2HG1 VAL 51 -17.020 -11.047 1.876
434 3HG1 VAL 51 3HG1 VAL 51 -18.046 -10.875 0.451
435 1HG2 VAL 51 1HG2 VAL 51 -15.147 -10.434 1.433
436 2HG2 VAL 51 2HG2 VAL 51 -14.717 -8.745 1.160
437 3HG2 VAL 51 3HG2 VAL 51 -15.024 -9.810 -0.212
438 H GLU 52 H GLU 52 -17.934 -6.323 -0.041
439 HA GLU 52 HA GLU 52 -15.751 -5.132 -1.594
440 1HB GLU 52 2HB GLU 52 -18.340 -3.989 -0.542
441 2HB GLU 52 1HB GLU 52 -17.092 -3.011 -1.299
442 1HG GLU 52 2HG GLU 52 -17.489 -3.864 -3.384
443 2HG GLU 52 1HG GLU 52 -18.133 -5.382 -2.760
444 H LYS 53 H LYS 53 -15.174 -2.832 -0.579
445 HA LYS 53 HA LYS 53 -13.916 -3.448 1.943
446 1HB LYS 53 2HB LYS 53 -13.193 -1.908 -0.196
447 2HB LYS 53 1HB LYS 53 -13.737 -0.684 0.945
448 1HG LYS 53 2HG LYS 53 -11.766 -2.813 1.708
449 2HG LYS 53 1HG LYS 53 -11.274 -1.285 0.974
450 1HD LYS 53 2HD LYS 53 -12.762 -0.259 2.878
451 2HD LYS 53 1HD LYS 53 -12.464 -1.813 3.659
452 1HE LYS 53 2HE LYS 53 -10.775 -0.330 4.419
453 2HE LYS 53 1HE LYS 53 -10.012 -1.421 3.264
454 1HZ LYS 53 1HZ LYS 53 -10.925 1.347 2.692
455 2HZ LYS 53 2HZ LYS 53 -10.211 0.300 1.572
456 3HZ LYS 53 3HZ LYS 53 -9.318 0.855 2.896
457 H TYR 54 H TYR 54 -15.577 -3.577 3.448
458 HA TYR 54 HA TYR 54 -17.363 -1.312 3.798
459 1HB TYR 54 2HB TYR 54 -17.397 -4.099 4.497
460 2HB TYR 54 1HB TYR 54 -17.650 -3.134 5.948
461 HD1 TYR 54 1HD TYR 54 -19.502 -4.998 4.046
462 HD2 TYR 54 2HD TYR 54 -19.146 -0.832 4.828
463 HE1 TYR 54 1HE TYR 54 -21.858 -4.686 3.418
464 HE2 TYR 54 2HE TYR 54 -21.501 -0.507 4.204
465 HH TYR 54 HH TYR 54 -23.328 -2.889 2.618
466 H GLY 55 H GLY 55 -14.540 -2.731 5.304
467 1HA GLY 55 2HA GLY 55 -13.171 -0.914 6.427
468 2HA GLY 55 1HA GLY 55 -14.624 -0.628 7.373
469 HA PRO 56 HA PRO 56 -13.425 -3.428 10.540
470 1HB PRO 56 2HB PRO 56 -15.990 -4.882 10.097
471 2HB PRO 56 1HB PRO 56 -15.314 -4.219 11.590
472 1HG PRO 56 2HG PRO 56 -17.312 -2.981 10.344
473 2HG PRO 56 1HG PRO 56 -15.999 -2.058 11.098
474 1HD PRO 56 2HD PRO 56 -16.496 -2.638 8.212
475 2HD PRO 56 1HD PRO 56 -15.830 -1.178 8.973
476 H GLU 57 H GLU 57 -14.705 -4.778 7.560
477 HA GLU 57 HA GLU 57 -13.835 -7.441 7.972
478 1HB GLU 57 2HB GLU 57 -15.543 -6.641 6.281
479 2HB GLU 57 1HB GLU 57 -14.194 -6.078 5.303
480 1HG GLU 57 2HG GLU 57 -13.725 -8.787 6.064
481 2HG GLU 57 1HG GLU 57 -15.344 -8.645 5.381
482 H ALA 58 H ALA 58 -12.316 -4.587 6.593
483 HA ALA 58 HA ALA 58 -10.036 -5.956 5.555
484 1HB ALA 58 1HB ALA 58 -10.832 -3.119 5.927
485 2HB ALA 58 2HB ALA 58 -10.289 -3.964 4.475
486 3HB ALA 58 3HB ALA 58 -9.119 -3.477 5.702
487 H SER 59 H SER 59 -10.847 -4.451 8.610
488 HA SER 59 HA SER 59 -8.283 -4.237 9.710
489 1HB SER 59 2HB SER 59 -10.621 -3.415 10.586
490 2HB SER 59 1HB SER 59 -10.628 -4.964 11.429
491 HG SER 59 HG SER 59 -9.317 -4.119 12.818
492 H ALA 60 H ALA 60 -10.428 -6.969 9.362
493 HA ALA 60 HA ALA 60 -8.835 -8.663 11.092
494 1HB ALA 60 1HB ALA 60 -10.462 -10.344 10.719
495 2HB ALA 60 2HB ALA 60 -11.082 -9.522 9.285
496 3HB ALA 60 3HB ALA 60 -11.342 -8.823 10.883
497 H PHE 61 H PHE 61 -9.202 -8.004 7.685
498 HA PHE 61 HA PHE 61 -8.000 -10.301 6.629
499 1HB PHE 61 2HB PHE 61 -9.150 -8.129 5.530
500 2HB PHE 61 1HB PHE 61 -7.457 -7.723 5.269
501 HD1 PHE 61 1HD PHE 61 -6.006 -9.310 3.989
502 HD2 PHE 61 2HD PHE 61 -10.236 -9.733 4.202
503 HE1 PHE 61 1HE PHE 61 -5.957 -10.773 2.010
504 HE2 PHE 61 2HE PHE 61 -10.193 -11.197 2.225
505 HZ PHE 61 HZ PHE 61 -8.051 -11.719 1.125
506 H THR 62 H THR 62 -6.567 -7.193 7.584
507 HA THR 62 HA THR 62 -3.931 -7.741 6.848
508 HB THR 62 HB THR 62 -3.373 -6.063 8.709
509 HG1 THR 62 1HG THR 62 -5.220 -4.951 9.499
510 1HG2 THR 62 1HG2 THR 62 -3.674 -5.342 6.399
511 2HG2 THR 62 2HG2 THR 62 -4.311 -4.160 7.542
512 3HG2 THR 62 3HG2 THR 62 -5.412 -5.222 6.665
513 H LYS 63 H LYS 63 -5.539 -8.210 9.989
514 HA LYS 63 HA LYS 63 -3.396 -9.241 11.413
515 1HB LYS 63 2HB LYS 63 -6.265 -9.126 11.707
516 2HB LYS 63 1HB LYS 63 -5.654 -10.668 12.285
517 1HG LYS 63 2HG LYS 63 -4.630 -9.750 14.061
518 2HG LYS 63 1HG LYS 63 -4.144 -8.306 13.169
519 1HD LYS 63 2HD LYS 63 -5.702 -7.581 14.797
520 2HD LYS 63 1HD LYS 63 -6.570 -7.592 13.261
521 1HE LYS 63 2HE LYS 63 -6.877 -10.158 14.383
522 2HE LYS 63 1HE LYS 63 -7.156 -9.001 15.686
523 1HZ LYS 63 1HZ LYS 63 -9.047 -9.748 13.999
524 2HZ LYS 63 2HZ LYS 63 -8.439 -8.428 13.134
525 3HZ LYS 63 3HZ LYS 63 -9.016 -8.213 14.710
526 H LYS 64 H LYS 64 -5.185 -10.679 8.846
527 HA LYS 64 HA LYS 64 -4.351 -13.380 9.508
528 1HB LYS 64 2HB LYS 64 -6.597 -12.715 8.438
529 2HB LYS 64 1HB LYS 64 -5.684 -12.528 6.947
530 1HG LYS 64 2HG LYS 64 -4.859 -14.959 7.568
531 2HG LYS 64 1HG LYS 64 -6.385 -14.987 8.454
532 1HD LYS 64 2HD LYS 64 -7.627 -15.024 6.569
533 2HD LYS 64 1HD LYS 64 -6.537 -13.931 5.710
534 1HE LYS 64 2HE LYS 64 -5.889 -16.816 6.285
535 2HE LYS 64 1HE LYS 64 -6.663 -16.273 4.798
536 1HZ LYS 64 1HZ LYS 64 -4.226 -16.523 4.620
537 2HZ LYS 64 2HZ LYS 64 -4.033 -15.288 5.760
538 3HZ LYS 64 3HZ LYS 64 -4.758 -14.955 4.268
539 H MET 65 H MET 65 -3.982 -11.242 6.677
540 HA MET 65 HA MET 65 -1.662 -12.772 5.823
541 1HB MET 65 2HB MET 65 -3.586 -10.973 4.560
542 2HB MET 65 1HB MET 65 -1.929 -10.669 4.053
543 1HG MET 65 2HG MET 65 -1.681 -12.970 3.360
544 2HG MET 65 1HG MET 65 -3.300 -13.346 3.951
545 1HE MET 65 1HE MET 65 -5.250 -13.175 0.910
546 2HE MET 65 2HE MET 65 -4.990 -13.736 2.562
547 3HE MET 65 3HE MET 65 -3.964 -14.331 1.256
548 H TRP 66 H TRP 66 -2.378 -9.317 6.409
549 HA TRP 66 HA TRP 66 0.207 -8.370 6.193
550 1HB TRP 66 2HB TRP 66 -1.769 -6.915 6.345
551 2HB TRP 66 1HB TRP 66 -1.947 -7.339 8.044
552 HD1 TRP 66 HD TRP 66 0.976 -5.912 5.897
553 HE1 TRP 66 1HE TRP 66 2.060 -3.993 7.233
554 HE3 TRP 66 3HE TRP 66 -1.962 -6.077 10.077
555 HZ2 TRP 66 2HZ TRP 66 1.709 -2.721 9.729
556 HZ3 TRP 66 3HZ TRP 66 -1.523 -4.475 11.892
557 HH2 TRP 66 HH TRP 66 0.275 -2.833 11.721
558 H GLU 67 H GLU 67 -1.206 -10.193 8.778
559 HA GLU 67 HA GLU 67 0.986 -9.534 10.587
560 1HB GLU 67 2HB GLU 67 -1.725 -10.341 10.924
561 2HB GLU 67 1HB GLU 67 -0.696 -11.544 11.690
562 1HG GLU 67 2HG GLU 67 -0.336 -8.613 12.199
563 2HG GLU 67 1HG GLU 67 -1.505 -9.579 13.100
564 H ASN 68 H ASN 68 -0.424 -12.437 9.066
565 HA ASN 68 HA ASN 68 1.714 -14.112 10.018
566 1HB ASN 68 2HB ASN 68 -0.840 -14.627 9.276
567 2HB ASN 68 1HB ASN 68 0.017 -15.102 7.812
568 1HD2 ASN 68 1HD2 ASN 68 0.235 -15.475 11.332
569 2HD2 ASN 68 2HD2 ASN 68 0.717 -17.134 11.297
570 H ALA 69 H ALA 69 1.033 -12.323 7.113
571 HA ALA 69 HA ALA 69 3.349 -13.553 5.788
572 1HB ALA 69 1HB ALA 69 2.458 -12.394 3.736
573 2HB ALA 69 2HB ALA 69 1.029 -11.986 4.685
574 3HB ALA 69 3HB ALA 69 1.438 -13.675 4.392
575 H LYS 70 H LYS 70 4.955 -12.232 4.830
576 HA LYS 70 HA LYS 70 5.330 -9.721 6.267
577 1HB LYS 70 2HB LYS 70 7.075 -11.791 5.199
578 2HB LYS 70 1HB LYS 70 7.620 -10.175 4.767
579 1HG LYS 70 2HG LYS 70 6.831 -10.501 7.575
580 2HG LYS 70 1HG LYS 70 8.238 -11.444 7.075
581 1HD LYS 70 2HD LYS 70 9.314 -9.425 6.240
582 2HD LYS 70 1HD LYS 70 7.894 -8.471 6.676
583 1HE LYS 70 2HE LYS 70 8.242 -8.918 9.010
584 2HE LYS 70 1HE LYS 70 9.545 -10.048 8.643
585 1HZ LYS 70 1HZ LYS 70 10.790 -8.233 9.075
586 2HZ LYS 70 2HZ LYS 70 9.566 -7.138 8.671
587 3HZ LYS 70 3HZ LYS 70 10.473 -7.880 7.450
588 H LYS 71 H LYS 71 4.065 -8.254 5.167
589 HA LYS 71 HA LYS 71 5.141 -7.391 2.587
590 1HB LYS 71 2HB LYS 71 2.692 -6.942 1.890
591 2HB LYS 71 1HB LYS 71 3.309 -8.584 1.750
592 1HG LYS 71 2HG LYS 71 1.949 -7.801 4.269
593 2HG LYS 71 1HG LYS 71 0.962 -8.049 2.826
594 1HD LYS 71 2HD LYS 71 2.929 -10.051 3.933
595 2HD LYS 71 1HD LYS 71 1.187 -10.091 4.208
596 1HE LYS 71 2HE LYS 71 1.816 -9.849 1.393
597 2HE LYS 71 1HE LYS 71 2.581 -11.268 2.105
598 1HZ LYS 71 1HZ LYS 71 0.625 -12.260 1.862
599 2HZ LYS 71 2HZ LYS 71 -0.167 -10.812 1.493
600 3HZ LYS 71 3HZ LYS 71 0.033 -11.278 3.106
601 H ILE 72 H ILE 72 6.000 -5.556 3.473
602 HA ILE 72 HA ILE 72 4.069 -3.558 4.420
603 HB ILE 72 HB ILE 72 5.008 -4.544 6.419
604 1HG1 ILE 72 2HG1 ILE 72 6.591 -2.284 6.883
605 2HG1 ILE 72 1HG1 ILE 72 5.428 -1.762 5.669
606 1HG2 ILE 72 1HG2 ILE 72 7.755 -3.707 6.068
607 2HG2 ILE 72 2HG2 ILE 72 7.258 -4.872 4.837
608 3HG2 ILE 72 3HG2 ILE 72 7.103 -5.274 6.551
609 1HD1 ILE 72 1HD1 ILE 72 4.557 -3.190 8.150
610 2HD1 ILE 72 2HD1 ILE 72 3.613 -2.168 7.067
611 3HD1 ILE 72 3HD1 ILE 72 4.825 -1.448 8.124
612 H GLU 73 H GLU 73 4.276 -2.114 2.732
613 HA GLU 73 HA GLU 73 6.620 -0.524 2.677
614 1HB GLU 73 2HB GLU 73 6.721 -2.757 0.977
615 2HB GLU 73 1HB GLU 73 6.421 -1.371 -0.064
616 1HG GLU 73 2HG GLU 73 8.369 -0.375 1.497
617 2HG GLU 73 1HG GLU 73 8.800 -2.085 1.512
618 H VAL 74 H VAL 74 6.504 0.990 0.600
619 HA VAL 74 HA VAL 74 3.676 1.752 0.269
620 HB VAL 74 HB VAL 74 4.825 3.308 1.789
621 1HG1 VAL 74 1HG1 VAL 74 6.640 3.855 -0.556
622 2HG1 VAL 74 2HG1 VAL 74 7.097 3.053 0.946
623 3HG1 VAL 74 3HG1 VAL 74 6.619 4.752 0.962
624 1HG2 VAL 74 1HG2 VAL 74 3.092 3.967 -0.060
625 2HG2 VAL 74 2HG2 VAL 74 4.462 4.845 -0.740
626 3HG2 VAL 74 3HG2 VAL 74 3.901 5.212 0.892
627 H GLU 75 H GLU 75 3.123 2.799 -1.704
628 HA GLU 75 HA GLU 75 4.891 2.026 -3.905
629 1HB GLU 75 2HB GLU 75 2.523 1.191 -3.825
630 2HB GLU 75 1HB GLU 75 1.986 2.848 -4.054
631 1HG GLU 75 2HG GLU 75 1.937 2.154 -6.210
632 2HG GLU 75 1HG GLU 75 3.615 2.692 -6.138
633 H PHE 76 H PHE 76 2.682 4.285 -5.036
634 HA PHE 76 HA PHE 76 4.746 6.370 -4.958
635 1HB PHE 76 2HB PHE 76 3.702 7.265 -6.989
636 2HB PHE 76 1HB PHE 76 4.165 5.582 -7.206
637 HD1 PHE 76 1HD PHE 76 2.503 3.855 -7.459
638 HD2 PHE 76 2HD PHE 76 1.369 7.913 -6.863
639 HE1 PHE 76 1HE PHE 76 0.208 3.312 -8.160
640 HE2 PHE 76 2HE PHE 76 -0.929 7.377 -7.560
641 HZ PHE 76 HZ PHE 76 -1.512 5.074 -8.210
642 H ASP 77 H ASP 77 4.332 8.321 -4.094
643 HA ASP 77 HA ASP 77 1.919 8.653 -2.565
644 1HB ASP 77 2HB ASP 77 2.977 10.853 -1.932
645 2HB ASP 77 1HB ASP 77 3.947 9.431 -1.560
646 H LYS 78 H LYS 78 0.093 9.440 -3.354
647 HA LYS 78 HA LYS 78 0.094 10.923 -5.849
648 1HB LYS 78 2HB LYS 78 -2.428 10.813 -5.523
649 2HB LYS 78 1HB LYS 78 -1.598 9.280 -5.744
650 1HG LYS 78 2HG LYS 78 -2.160 8.540 -3.709
651 2HG LYS 78 1HG LYS 78 -1.865 10.104 -2.949
652 1HD LYS 78 2HD LYS 78 -4.028 10.689 -3.063
653 2HD LYS 78 1HD LYS 78 -4.192 10.092 -4.715
654 1HE LYS 78 2HE LYS 78 -4.519 7.850 -3.943
655 2HE LYS 78 1HE LYS 78 -4.130 8.311 -2.286
656 1HZ LYS 78 1HZ LYS 78 -6.300 9.819 -3.432
657 2HZ LYS 78 2HZ LYS 78 -6.196 9.041 -1.934
658 3HZ LYS 78 3HZ LYS 78 -6.621 8.162 -3.315
659 H GLY 79 H GLY 79 -0.519 11.468 -2.437
660 1HA GLY 79 2HA GLY 79 -0.852 13.394 -1.234
661 2HA GLY 79 1HA GLY 79 -0.005 14.209 -2.539
662 H GLN 80 H GLN 80 -2.976 12.465 -3.086
663 HA GLN 80 HA GLN 80 -4.244 14.956 -3.911
664 1HB GLN 80 2HB GLN 80 -4.803 12.051 -4.381
665 2HB GLN 80 1HB GLN 80 -6.079 13.236 -4.628
666 1HG GLN 80 2HG GLN 80 -4.677 14.414 -6.241
667 2HG GLN 80 1HG GLN 80 -3.397 13.228 -5.993
668 1HE2 GLN 80 1HE2 GLN 80 -3.779 13.179 -8.409
669 2HE2 GLN 80 2HE2 GLN 80 -4.912 12.009 -8.987
670 H ARG 81 H ARG 81 -5.347 12.072 -2.114
671 HA ARG 81 HA ARG 81 -7.560 13.310 -0.935
672 1HB ARG 81 2HB ARG 81 -6.686 10.770 -1.037
673 2HB ARG 81 1HB ARG 81 -6.198 11.172 0.604
674 1HG ARG 81 2HG ARG 81 -8.988 11.647 -0.394
675 2HG ARG 81 1HG ARG 81 -8.480 10.105 0.299
676 1HD ARG 81 2HD ARG 81 -8.548 10.907 2.384
677 2HD ARG 81 1HD ARG 81 -7.699 12.384 1.932
678 HE ARG 81 HE ARG 81 -10.413 12.384 1.047
679 1HH1 ARG 81 1HH1 ARG 81 -8.362 12.939 3.816
680 2HH1 ARG 81 2HH1 ARG 81 -9.478 14.020 4.582
681 1HH2 ARG 81 1HH2 ARG 81 -11.880 13.804 2.053
682 2HH2 ARG 81 2HH2 ARG 81 -11.475 14.511 3.581
683 H THR 82 H THR 82 -4.369 12.614 0.501
684 HA THR 82 HA THR 82 -4.911 14.083 2.879
685 HB THR 82 HB THR 82 -3.257 12.250 2.778
686 HG1 THR 82 1HG THR 82 -3.080 13.959 4.352
687 1HG2 THR 82 1HG2 THR 82 -2.311 13.362 0.500
688 2HG2 THR 82 2HG2 THR 82 -1.435 12.196 1.490
689 3HG2 THR 82 3HG2 THR 82 -1.124 13.922 1.679
690 H ASP 83 H ASP 83 -4.953 16.209 3.114
691 HA ASP 83 HA ASP 83 -3.436 17.868 1.207
692 1HB ASP 83 2HB ASP 83 -5.988 18.000 1.169
693 2HB ASP 83 1HB ASP 83 -5.867 18.778 2.744
694 H LYS 84 H LYS 84 -4.687 17.822 4.539
695 HA LYS 84 HA LYS 84 -2.538 19.659 5.319
696 1HB LYS 84 2HB LYS 84 -3.821 19.942 7.416
697 2HB LYS 84 1HB LYS 84 -4.754 20.371 5.989
698 1HG LYS 84 2HG LYS 84 -5.892 18.210 6.085
699 2HG LYS 84 1HG LYS 84 -4.960 17.787 7.523
700 1HD LYS 84 2HD LYS 84 -6.239 19.056 8.869
701 2HD LYS 84 1HD LYS 84 -6.346 20.366 7.692
702 1HE LYS 84 2HE LYS 84 -7.909 17.790 7.563
703 2HE LYS 84 1HE LYS 84 -8.533 19.319 8.183
704 1HZ LYS 84 1HZ LYS 84 -7.987 20.272 5.945
705 2HZ LYS 84 2HZ LYS 84 -9.245 19.142 5.956
706 3HZ LYS 84 3HZ LYS 84 -7.710 18.693 5.406
707 H TYR 85 H TYR 85 -3.738 16.418 5.777
708 HA TYR 85 HA TYR 85 -2.178 15.783 8.064
709 1HB TYR 85 2HB TYR 85 -4.103 14.479 6.440
710 2HB TYR 85 1HB TYR 85 -2.672 13.455 6.462
711 HD1 TYR 85 1HD TYR 85 -5.686 13.718 7.924
712 HD2 TYR 85 2HD TYR 85 -1.593 13.614 9.075
713 HE1 TYR 85 1HE TYR 85 -6.338 12.876 10.141
714 HE2 TYR 85 2HE TYR 85 -2.233 12.771 11.295
715 HH TYR 85 HH TYR 85 -5.307 12.912 12.499
716 H GLY 86 H GLY 86 -1.624 15.618 4.594
717 1HA GLY 86 2HA GLY 86 0.320 15.408 3.402
718 2HA GLY 86 1HA GLY 86 1.188 15.667 4.908
719 H ARG 87 H ARG 87 -1.100 13.058 4.689
720 HA ARG 87 HA ARG 87 1.166 11.188 4.472
721 1HB ARG 87 2HB ARG 87 -1.211 10.196 5.904
722 2HB ARG 87 1HB ARG 87 0.496 9.981 6.266
723 1HG ARG 87 2HG ARG 87 0.357 12.502 6.962
724 2HG ARG 87 1HG ARG 87 -1.364 12.146 7.114
725 1HD ARG 87 2HD ARG 87 -0.712 11.592 9.219
726 2HD ARG 87 1HD ARG 87 -0.414 10.044 8.432
727 HE ARG 87 HE ARG 87 1.946 11.311 8.152
728 1HH1 ARG 87 1HH1 ARG 87 -0.116 10.761 10.915
729 2HH1 ARG 87 2HH1 ARG 87 1.194 10.731 12.044
730 1HH2 ARG 87 1HH2 ARG 87 3.672 11.270 9.638
731 2HH2 ARG 87 2HH2 ARG 87 3.345 11.019 11.320
732 H GLY 88 H GLY 88 0.988 10.607 2.372
733 1HA GLY 88 2HA GLY 88 -1.425 10.139 0.985
734 2HA GLY 88 1HA GLY 88 0.156 9.518 0.517
735 H LEU 89 H LEU 89 -2.899 8.623 1.445
736 HA LEU 89 HA LEU 89 -2.229 6.359 3.059
737 1HB LEU 89 2HB LEU 89 -4.802 6.895 1.586
738 2HB LEU 89 1HB LEU 89 -4.570 5.795 2.932
739 HG LEU 89 HG LEU 89 -3.825 8.584 3.500
740 1HD1 LEU 89 1HD1 LEU 89 -5.640 9.425 2.451
741 2HD1 LEU 89 2HD1 LEU 89 -6.454 8.868 3.914
742 3HD1 LEU 89 3HD1 LEU 89 -6.495 7.881 2.452
743 1HD2 LEU 89 1HD2 LEU 89 -5.827 7.126 5.097
744 2HD2 LEU 89 2HD2 LEU 89 -4.384 8.005 5.605
745 3HD2 LEU 89 3HD2 LEU 89 -4.240 6.366 4.974
746 H ALA 90 H ALA 90 -0.891 4.948 2.051
747 HA ALA 90 HA ALA 90 -2.038 3.030 0.358
748 1HB ALA 90 1HB ALA 90 -0.186 4.978 -0.996
749 2HB ALA 90 2HB ALA 90 -1.850 4.588 -1.431
750 3HB ALA 90 3HB ALA 90 -0.577 3.386 -1.649
751 H TYR 91 H TYR 91 -1.136 1.278 1.201
752 HA TYR 91 HA TYR 91 1.768 1.086 1.286
753 1HB TYR 91 2HB TYR 91 0.152 1.415 3.643
754 2HB TYR 91 1HB TYR 91 0.941 -0.159 3.672
755 HD1 TYR 91 1HD TYR 91 3.151 -0.324 4.390
756 HD2 TYR 91 2HD TYR 91 1.669 3.453 3.115
757 HE1 TYR 91 1HE TYR 91 5.249 0.736 5.111
758 HE2 TYR 91 2HE TYR 91 3.761 4.524 3.832
759 HH TYR 91 HH TYR 91 6.068 3.949 4.268
760 H ILE 92 H ILE 92 1.749 -0.492 -0.328
761 HA ILE 92 HA ILE 92 0.898 -3.113 0.596
762 HB ILE 92 HB ILE 92 -0.168 -3.569 -1.685
763 1HG1 ILE 92 2HG1 ILE 92 -0.713 -0.609 -1.675
764 2HG1 ILE 92 1HG1 ILE 92 0.672 -1.272 -2.538
765 1HG2 ILE 92 1HG2 ILE 92 -2.354 -2.799 -0.910
766 2HG2 ILE 92 2HG2 ILE 92 -1.569 -1.745 0.266
767 3HG2 ILE 92 3HG2 ILE 92 -1.415 -3.496 0.409
768 1HD1 ILE 92 1HD1 ILE 92 -2.012 -1.074 -3.393
769 2HD1 ILE 92 2HD1 ILE 92 -1.617 -2.787 -3.247
770 3HD1 ILE 92 3HD1 ILE 92 -0.626 -1.737 -4.260
771 H TYR 93 H TYR 93 2.756 -4.190 0.449
772 HA TYR 93 HA TYR 93 3.969 -4.506 -2.162
773 1HB TYR 93 2HB TYR 93 5.087 -2.733 -0.247
774 2HB TYR 93 1HB TYR 93 6.158 -4.124 -0.380
775 HD1 TYR 93 1HD TYR 93 7.006 -4.767 -2.686
776 HD2 TYR 93 2HD TYR 93 5.051 -1.070 -1.907
777 HE1 TYR 93 1HE TYR 93 7.945 -3.840 -4.760
778 HE2 TYR 93 2HE TYR 93 5.984 -0.134 -3.979
779 HH TYR 93 HH TYR 93 8.482 -1.240 -5.538
780 H ALA 94 H ALA 94 5.787 -6.188 -2.017
781 HA ALA 94 HA ALA 94 5.096 -8.174 0.048
782 1HB ALA 94 1HB ALA 94 6.104 -9.176 -2.538
783 2HB ALA 94 2HB ALA 94 4.484 -8.478 -2.549
784 3HB ALA 94 3HB ALA 94 4.856 -9.824 -1.474
785 H ASP 95 H ASP 95 6.764 -8.179 1.423
786 HA ASP 95 HA ASP 95 8.888 -8.248 2.248
787 1HB ASP 95 2HB ASP 95 8.681 -10.468 1.044
788 2HB ASP 95 1HB ASP 95 9.558 -9.735 -0.296
789 H GLY 96 H GLY 96 8.144 -6.026 0.418
790 1HA GLY 96 2HA GLY 96 9.259 -4.097 -0.212
791 2HA GLY 96 1HA GLY 96 10.777 -4.887 0.181
792 H LYS 97 H LYS 97 8.797 -6.710 -1.897
793 HA LYS 97 HA LYS 97 10.084 -5.615 -4.294
794 1HB LYS 97 2HB LYS 97 10.178 -8.479 -3.355
795 2HB LYS 97 1HB LYS 97 10.445 -8.034 -5.036
796 1HG LYS 97 2HG LYS 97 12.109 -6.358 -3.531
797 2HG LYS 97 1HG LYS 97 12.264 -7.965 -2.820
798 1HD LYS 97 2HD LYS 97 13.798 -8.250 -4.453
799 2HD LYS 97 1HD LYS 97 12.377 -8.582 -5.446
800 1HE LYS 97 2HE LYS 97 13.559 -5.833 -5.126
801 2HE LYS 97 1HE LYS 97 14.040 -6.944 -6.407
802 1HZ LYS 97 1HZ LYS 97 12.124 -6.629 -7.516
803 2HZ LYS 97 2HZ LYS 97 12.070 -5.174 -6.653
804 3HZ LYS 97 3HZ LYS 97 11.183 -6.511 -6.114
805 H MET 98 H MET 98 8.969 -5.990 -6.236
806 HA MET 98 HA MET 98 6.125 -6.356 -5.890
807 1HB MET 98 2HB MET 98 7.660 -4.818 -7.575
808 2HB MET 98 1HB MET 98 7.118 -6.111 -8.638
809 1HG MET 98 2HG MET 98 4.826 -5.617 -8.180
810 2HG MET 98 1HG MET 98 5.276 -4.460 -6.929
811 1HE MET 98 1HE MET 98 4.311 -1.568 -8.981
812 2HE MET 98 2HE MET 98 4.202 -2.512 -7.497
813 3HE MET 98 3HE MET 98 3.292 -3.005 -8.924
814 H VAL 99 H VAL 99 5.327 -8.349 -5.802
815 HA VAL 99 HA VAL 99 4.874 -10.523 -6.290
816 HB VAL 99 HB VAL 99 6.089 -9.931 -8.993
817 1HG1 VAL 99 1HG1 VAL 99 4.310 -11.667 -9.648
818 2HG1 VAL 99 2HG1 VAL 99 4.293 -12.087 -7.936
819 3HG1 VAL 99 3HG1 VAL 99 5.784 -12.239 -8.867
820 1HG2 VAL 99 1HG2 VAL 99 4.250 -8.803 -9.624
821 2HG2 VAL 99 2HG2 VAL 99 4.033 -8.534 -7.894
822 3HG2 VAL 99 3HG2 VAL 99 3.170 -9.844 -8.698
823 H ASN 100 H ASN 100 6.849 -10.613 -4.711
824 HA ASN 100 HA ASN 100 8.708 -11.718 -4.010
825 1HB ASN 100 2HB ASN 100 7.283 -13.468 -5.693
826 2HB ASN 100 1HB ASN 100 8.976 -13.647 -6.143
827 1HD2 ASN 100 1HD2 ASN 100 7.138 -15.475 -4.763
828 2HD2 ASN 100 2HD2 ASN 100 7.913 -15.878 -3.272
829 H GLU 101 H GLU 101 10.800 -12.958 -5.267
830 HA GLU 101 HA GLU 101 12.058 -10.695 -6.633
831 1HB GLU 101 2HB GLU 101 13.313 -13.173 -5.437
832 2HB GLU 101 1HB GLU 101 14.182 -11.793 -6.094
833 1HG GLU 101 2HG GLU 101 12.746 -10.486 -4.308
834 2HG GLU 101 1HG GLU 101 12.709 -12.070 -3.534
835 H ALA 102 H ALA 102 11.655 -14.210 -6.960
836 HA ALA 102 HA ALA 102 12.490 -13.990 -9.770
837 1HB ALA 102 1HB ALA 102 13.387 -16.056 -9.644
838 2HB ALA 102 2HB ALA 102 12.107 -16.667 -8.595
839 3HB ALA 102 3HB ALA 102 13.420 -15.704 -7.917
840 H LEU 103 H LEU 103 11.156 -14.586 -11.415
841 HA LEU 103 HA LEU 103 8.450 -15.494 -10.679
842 1HB LEU 103 2HB LEU 103 9.014 -13.031 -11.662
843 2HB LEU 103 1HB LEU 103 8.746 -13.911 -13.154
844 HG LEU 103 HG LEU 103 6.757 -13.883 -10.889
845 1HD1 LEU 103 1HD1 LEU 103 7.228 -11.944 -13.094
846 2HD1 LEU 103 2HD1 LEU 103 6.669 -11.669 -11.443
847 3HD1 LEU 103 3HD1 LEU 103 5.565 -12.329 -12.649
848 1HD2 LEU 103 1HD2 LEU 103 6.398 -14.526 -13.810
849 2HD2 LEU 103 2HD2 LEU 103 5.217 -14.724 -12.514
850 3HD2 LEU 103 3HD2 LEU 103 6.660 -15.738 -12.555
851 H VAL 104 H VAL 104 10.299 -15.028 -13.694
852 HA VAL 104 HA VAL 104 10.678 -16.396 -15.473
853 HB VAL 104 HB VAL 104 10.354 -18.685 -13.534
854 1HG1 VAL 104 1HG1 VAL 104 11.831 -19.875 -15.033
855 2HG1 VAL 104 2HG1 VAL 104 12.003 -18.444 -16.047
856 3HG1 VAL 104 3HG1 VAL 104 10.445 -19.261 -15.935
857 1HG2 VAL 104 1HG2 VAL 104 11.996 -17.615 -12.404
858 2HG2 VAL 104 2HG2 VAL 104 12.478 -16.651 -13.801
859 3HG2 VAL 104 3HG2 VAL 104 13.015 -18.326 -13.656
860 H ARG 105 H ARG 105 9.010 -16.225 -16.850
861 HA ARG 105 HA ARG 105 6.982 -18.295 -16.795
862 1HB ARG 105 2HB ARG 105 5.176 -16.515 -17.174
863 2HB ARG 105 1HB ARG 105 5.754 -16.749 -15.530
864 1HG ARG 105 2HG ARG 105 7.161 -14.788 -15.710
865 2HG ARG 105 1HG ARG 105 6.684 -14.577 -17.397
866 1HD ARG 105 2HD ARG 105 4.394 -14.175 -16.740
867 2HD ARG 105 1HD ARG 105 4.787 -14.512 -15.055
868 HE ARG 105 HE ARG 105 6.446 -12.472 -15.661
869 1HH1 ARG 105 1HH1 ARG 105 3.008 -12.927 -16.052
870 2HH1 ARG 105 2HH1 ARG 105 2.641 -11.242 -15.892
871 1HH2 ARG 105 1HH2 ARG 105 5.965 -10.256 -15.451
872 2HH2 ARG 105 2HH2 ARG 105 4.319 -9.726 -15.552
873 H GLN 106 H GLN 106 8.190 -15.364 -18.385
874 HA GLN 106 HA GLN 106 8.433 -16.675 -20.893
875 1HB GLN 106 2HB GLN 106 5.876 -15.954 -20.475
876 2HB GLN 106 1HB GLN 106 6.490 -14.446 -21.139
877 1HG GLN 106 2HG GLN 106 7.402 -15.829 -23.056
878 2HG GLN 106 1HG GLN 106 6.418 -17.152 -22.432
879 1HE2 GLN 106 1HE2 GLN 106 6.032 -13.681 -23.089
880 2HE2 GLN 106 2HE2 GLN 106 4.515 -13.831 -23.902
881 H GLY 107 H GLY 107 10.080 -15.139 -19.141
882 1HA GLY 107 2HA GLY 107 10.600 -12.758 -20.814
883 2HA GLY 107 1HA GLY 107 10.971 -12.848 -19.098
884 H LEU 108 H LEU 108 13.110 -12.793 -18.891
885 HA LEU 108 HA LEU 108 14.871 -13.873 -20.882
886 1HB LEU 108 2HB LEU 108 15.177 -12.425 -18.303
887 2HB LEU 108 1HB LEU 108 16.544 -13.368 -18.867
888 HG LEU 108 HG LEU 108 16.066 -12.022 -21.116
889 1HD1 LEU 108 1HD1 LEU 108 14.095 -10.900 -19.949
890 2HD1 LEU 108 2HD1 LEU 108 15.231 -9.857 -20.805
891 3HD1 LEU 108 3HD1 LEU 108 15.304 -9.987 -19.047
892 1HD2 LEU 108 1HD2 LEU 108 18.079 -12.093 -19.445
893 2HD2 LEU 108 2HD2 LEU 108 17.465 -10.512 -18.960
894 3HD2 LEU 108 3HD2 LEU 108 17.946 -10.796 -20.632
895 H ALA 109 H ALA 109 13.361 -15.074 -18.036
896 HA ALA 109 HA ALA 109 13.372 -17.123 -17.046
897 1HB ALA 109 1HB ALA 109 13.372 -17.935 -19.396
898 2HB ALA 109 2HB ALA 109 14.162 -19.033 -18.264
899 3HB ALA 109 3HB ALA 109 15.133 -18.012 -19.326
900 H LYS 110 H LYS 110 14.449 -16.673 -15.183
901 HA LYS 110 HA LYS 110 17.336 -16.509 -15.130
902 1HB LYS 110 2HB LYS 110 15.282 -15.497 -13.543
903 2HB LYS 110 1HB LYS 110 16.050 -16.712 -12.529
904 1HG LYS 110 2HG LYS 110 18.193 -15.631 -12.788
905 2HG LYS 110 1HG LYS 110 17.497 -14.460 -13.910
906 1HD LYS 110 2HD LYS 110 17.281 -13.182 -12.070
907 2HD LYS 110 1HD LYS 110 15.849 -14.171 -11.775
908 1HE LYS 110 2HE LYS 110 17.252 -15.710 -10.427
909 2HE LYS 110 1HE LYS 110 18.612 -14.609 -10.648
910 1HZ LYS 110 1HZ LYS 110 16.223 -14.304 -8.993
911 2HZ LYS 110 2HZ LYS 110 16.860 -12.906 -9.698
912 3HZ LYS 110 3HZ LYS 110 17.822 -13.850 -8.677
Start of MODEL 9
1 1H ALA 1 1HT ALA 1 3.294 10.244 -25.551
2 2H ALA 1 2HT ALA 1 4.473 10.190 -26.796
3 3H ALA 1 3HT ALA 1 4.310 11.596 -25.827
4 HA ALA 1 HA ALA 1 4.947 8.994 -24.658
5 1HB ALA 1 1HB ALA 1 7.166 10.860 -25.203
6 2HB ALA 1 2HB ALA 1 6.521 9.988 -26.593
7 3HB ALA 1 3HB ALA 1 7.135 9.096 -25.201
8 H THR 2 H THR 2 4.254 9.377 -22.640
9 HA THR 2 HA THR 2 5.206 11.835 -21.321
10 HB THR 2 HB THR 2 3.180 12.013 -20.081
11 HG1 THR 2 1HG THR 2 2.526 9.494 -21.197
12 1HG2 THR 2 1HG2 THR 2 1.662 11.331 -22.420
13 2HG2 THR 2 2HG2 THR 2 3.138 12.193 -22.858
14 3HG2 THR 2 3HG2 THR 2 2.000 12.913 -21.717
15 H SER 3 H SER 3 6.142 11.608 -19.351
16 HA SER 3 HA SER 3 6.377 8.859 -18.317
17 1HB SER 3 2HB SER 3 8.328 11.011 -17.591
18 2HB SER 3 1HB SER 3 8.577 9.269 -17.708
19 HG SER 3 HG SER 3 9.296 9.648 -19.633
20 H THR 4 H THR 4 6.113 8.463 -16.141
21 HA THR 4 HA THR 4 4.944 10.676 -14.589
22 HB THR 4 HB THR 4 3.940 8.693 -13.245
23 HG1 THR 4 1HG THR 4 3.641 6.839 -14.557
24 1HG2 THR 4 1HG2 THR 4 3.033 9.983 -15.653
25 2HG2 THR 4 2HG2 THR 4 2.128 9.505 -14.218
26 3HG2 THR 4 3HG2 THR 4 2.394 8.345 -15.519
27 H LYS 5 H LYS 5 5.386 10.765 -12.323
28 HA LYS 5 HA LYS 5 8.065 10.517 -11.637
29 1HB LYS 5 2HB LYS 5 5.881 11.667 -10.485
30 2HB LYS 5 1HB LYS 5 6.172 10.327 -9.385
31 1HG LYS 5 2HG LYS 5 7.325 12.231 -8.550
32 2HG LYS 5 1HG LYS 5 8.530 11.100 -9.172
33 1HD LYS 5 2HD LYS 5 9.204 12.518 -10.782
34 2HD LYS 5 1HD LYS 5 7.559 13.045 -11.141
35 1HE LYS 5 2HE LYS 5 7.823 14.898 -9.940
36 2HE LYS 5 1HE LYS 5 8.371 13.975 -8.541
37 1HZ LYS 5 1HZ LYS 5 9.924 15.349 -10.584
38 2HZ LYS 5 2HZ LYS 5 10.546 13.872 -10.044
39 3HZ LYS 5 3HZ LYS 5 10.256 15.119 -8.941
40 H LYS 6 H LYS 6 9.220 9.083 -10.326
41 HA LYS 6 HA LYS 6 8.009 6.408 -10.077
42 1HB LYS 6 2HB LYS 6 10.863 7.219 -10.632
43 2HB LYS 6 1HB LYS 6 10.398 5.583 -10.187
44 1HG LYS 6 2HG LYS 6 9.202 5.261 -12.173
45 2HG LYS 6 1HG LYS 6 9.172 6.987 -12.535
46 1HD LYS 6 2HD LYS 6 11.686 6.867 -12.726
47 2HD LYS 6 1HD LYS 6 11.526 5.112 -12.654
48 1HE LYS 6 2HE LYS 6 9.686 5.820 -14.572
49 2HE LYS 6 1HE LYS 6 11.005 6.955 -14.855
50 1HZ LYS 6 1HZ LYS 6 11.006 4.024 -15.054
51 2HZ LYS 6 2HZ LYS 6 12.450 4.825 -14.685
52 3HZ LYS 6 3HZ LYS 6 11.636 5.173 -16.126
53 H LEU 7 H LEU 7 7.413 6.152 -8.019
54 HA LEU 7 HA LEU 7 8.681 7.431 -5.823
55 1HB LEU 7 2HB LEU 7 7.207 6.057 -4.438
56 2HB LEU 7 1HB LEU 7 6.334 6.829 -5.748
57 HG LEU 7 HG LEU 7 7.039 4.360 -6.803
58 1HD1 LEU 7 1HD1 LEU 7 6.129 2.784 -5.084
59 2HD1 LEU 7 2HD1 LEU 7 6.282 4.085 -3.903
60 3HD1 LEU 7 3HD1 LEU 7 7.717 3.453 -4.709
61 1HD2 LEU 7 1HD2 LEU 7 4.665 3.887 -6.674
62 2HD2 LEU 7 2HD2 LEU 7 4.927 5.577 -7.106
63 3HD2 LEU 7 3HD2 LEU 7 4.458 5.152 -5.460
64 H HIS 8 H HIS 8 9.736 6.382 -4.025
65 HA HIS 8 HA HIS 8 11.600 4.336 -4.934
66 1HB HIS 8 2HB HIS 8 12.208 6.499 -3.626
67 2HB HIS 8 1HB HIS 8 11.652 5.611 -2.212
68 HD1 HIS 8 1HD HIS 8 14.353 5.592 -4.826
69 HD2 HIS 8 2HD HIS 8 13.385 3.660 -1.277
70 HE1 HIS 8 1HE HIS 8 16.402 4.280 -4.195
71 HE2 HIS 8 2HE HIS 8 15.819 3.177 -2.006
72 H LYS 9 H LYS 9 12.110 2.488 -3.549
73 HA LYS 9 HA LYS 9 9.697 1.493 -2.191
74 1HB LYS 9 2HB LYS 9 10.596 -0.778 -2.680
75 2HB LYS 9 1HB LYS 9 10.217 0.158 -4.118
76 1HG LYS 9 2HG LYS 9 12.917 0.677 -3.487
77 2HG LYS 9 1HG LYS 9 12.676 -1.067 -3.370
78 1HD LYS 9 2HD LYS 9 11.315 -0.390 -5.672
79 2HD LYS 9 1HD LYS 9 12.731 0.661 -5.715
80 1HE LYS 9 2HE LYS 9 14.106 -1.042 -6.168
81 2HE LYS 9 1HE LYS 9 13.377 -2.066 -4.932
82 1HZ LYS 9 1HZ LYS 9 12.729 -1.837 -7.776
83 2HZ LYS 9 2HZ LYS 9 11.464 -2.179 -6.707
84 3HZ LYS 9 3HZ LYS 9 12.800 -3.211 -6.791
85 H GLU 10 H GLU 10 9.797 1.314 -0.071
86 HA GLU 10 HA GLU 10 12.327 0.565 1.203
87 1HB GLU 10 2HB GLU 10 10.670 2.995 1.775
88 2HB GLU 10 1HB GLU 10 11.568 2.230 3.079
89 1HG GLU 10 2HG GLU 10 13.617 2.748 2.150
90 2HG GLU 10 1HG GLU 10 12.949 2.941 0.531
91 HA PRO 11 HA PRO 11 9.381 -2.119 3.207
92 1HB PRO 11 2HB PRO 11 11.071 -3.660 4.553
93 2HB PRO 11 1HB PRO 11 11.008 -3.712 2.788
94 1HG PRO 11 2HG PRO 11 12.965 -2.303 4.564
95 2HG PRO 11 1HG PRO 11 13.269 -3.246 3.093
96 1HD PRO 11 2HD PRO 11 13.116 -0.494 3.170
97 2HD PRO 11 1HD PRO 11 12.809 -1.473 1.722
98 H ALA 12 H ALA 12 8.575 -2.610 5.301
99 HA ALA 12 HA ALA 12 9.463 -0.730 7.387
100 1HB ALA 12 1HB ALA 12 6.676 -1.824 7.048
101 2HB ALA 12 2HB ALA 12 7.212 -0.277 6.396
102 3HB ALA 12 3HB ALA 12 7.201 -0.542 8.140
103 H THR 13 H THR 13 7.193 -2.482 8.888
104 HA THR 13 HA THR 13 8.191 -5.033 9.267
105 HB THR 13 HB THR 13 9.194 -4.228 11.709
106 HG1 THR 13 1HG THR 13 9.331 -2.083 11.098
107 1HG2 THR 13 1HG2 THR 13 10.791 -5.588 11.033
108 2HG2 THR 13 2HG2 THR 13 11.385 -4.347 9.931
109 3HG2 THR 13 3HG2 THR 13 10.177 -5.509 9.381
110 H LEU 14 H LEU 14 7.737 -2.917 12.061
111 HA LEU 14 HA LEU 14 5.378 -4.459 12.784
112 1HB LEU 14 2HB LEU 14 5.547 -3.087 14.913
113 2HB LEU 14 1HB LEU 14 6.853 -4.208 14.585
114 HG LEU 14 HG LEU 14 7.371 -1.529 13.537
115 1HD1 LEU 14 1HD1 LEU 14 7.603 -1.634 16.484
116 2HD1 LEU 14 2HD1 LEU 14 5.997 -1.349 15.816
117 3HD1 LEU 14 3HD1 LEU 14 7.325 -0.262 15.412
118 1HD2 LEU 14 1HD2 LEU 14 8.855 -3.382 15.399
119 2HD2 LEU 14 2HD2 LEU 14 9.509 -1.901 14.698
120 3HD2 LEU 14 3HD2 LEU 14 9.070 -3.254 13.653
121 H ILE 15 H ILE 15 3.474 -3.818 12.051
122 HA ILE 15 HA ILE 15 2.885 -0.933 12.019
123 HB ILE 15 HB ILE 15 1.662 -2.883 10.084
124 1HG1 ILE 15 2HG1 ILE 15 3.293 -1.613 8.457
125 2HG1 ILE 15 1HG1 ILE 15 4.248 -1.382 9.917
126 1HG2 ILE 15 1HG2 ILE 15 0.368 -0.919 10.311
127 2HG2 ILE 15 2HG2 ILE 15 1.279 -0.739 8.812
128 3HG2 ILE 15 3HG2 ILE 15 1.796 0.115 10.266
129 1HD1 ILE 15 1HD1 ILE 15 5.158 -3.307 9.121
130 2HD1 ILE 15 2HD1 ILE 15 3.644 -3.865 8.415
131 3HD1 ILE 15 3HD1 ILE 15 3.894 -3.973 10.154
132 H LYS 16 H LYS 16 0.592 -0.401 12.224
133 HA LYS 16 HA LYS 16 -0.848 -2.406 13.835
134 1HB LYS 16 2HB LYS 16 -0.359 0.477 14.226
135 2HB LYS 16 1HB LYS 16 -2.011 -0.040 14.531
136 1HG LYS 16 2HG LYS 16 0.111 -1.693 15.740
137 2HG LYS 16 1HG LYS 16 -0.082 -0.063 16.386
138 1HD LYS 16 2HD LYS 16 -2.588 -1.544 15.985
139 2HD LYS 16 1HD LYS 16 -1.509 -2.225 17.203
140 1HE LYS 16 2HE LYS 16 -2.335 0.671 17.127
141 2HE LYS 16 1HE LYS 16 -3.179 -0.560 18.064
142 1HZ LYS 16 1HZ LYS 16 -0.369 0.331 18.398
143 2HZ LYS 16 2HZ LYS 16 -1.026 -1.013 19.189
144 3HZ LYS 16 3HZ LYS 16 -1.646 0.531 19.491
145 H ALA 17 H ALA 17 -2.670 -3.147 12.970
146 HA ALA 17 HA ALA 17 -3.965 -1.545 10.864
147 1HB ALA 17 1HB ALA 17 -4.978 -3.973 10.410
148 2HB ALA 17 2HB ALA 17 -3.448 -4.443 11.152
149 3HB ALA 17 3HB ALA 17 -3.453 -3.428 9.710
150 H ILE 18 H ILE 18 -5.900 -0.740 11.292
151 HA ILE 18 HA ILE 18 -7.512 -2.027 13.393
152 HB ILE 18 HB ILE 18 -6.978 -0.001 14.369
153 1HG1 ILE 18 2HG1 ILE 18 -9.342 1.163 13.007
154 2HG1 ILE 18 1HG1 ILE 18 -9.571 -0.412 13.761
155 1HG2 ILE 18 1HG2 ILE 18 -5.867 1.439 13.087
156 2HG2 ILE 18 2HG2 ILE 18 -7.445 2.134 12.715
157 3HG2 ILE 18 3HG2 ILE 18 -6.726 0.947 11.629
158 1HD1 ILE 18 1HD1 ILE 18 -9.536 0.445 15.818
159 2HD1 ILE 18 2HD1 ILE 18 -9.826 1.987 15.012
160 3HD1 ILE 18 3HD1 ILE 18 -8.184 1.517 15.455
161 H ASP 19 H ASP 19 -8.586 0.596 11.273
162 HA ASP 19 HA ASP 19 -10.464 -1.301 10.034
163 1HB ASP 19 2HB ASP 19 -10.870 1.388 11.221
164 2HB ASP 19 1HB ASP 19 -11.759 1.042 9.740
165 H GLY 20 H GLY 20 -7.794 -0.480 9.096
166 1HA GLY 20 2HA GLY 20 -6.792 0.066 7.102
167 2HA GLY 20 1HA GLY 20 -8.377 -0.130 6.369
168 H ASP 21 H ASP 21 -6.859 2.192 8.607
169 HA ASP 21 HA ASP 21 -7.405 4.351 6.734
170 1HB ASP 21 2HB ASP 21 -8.583 4.197 9.508
171 2HB ASP 21 1HB ASP 21 -8.417 5.714 8.630
172 H THR 22 H THR 22 -6.131 3.425 9.912
173 HA THR 22 HA THR 22 -3.859 5.223 9.424
174 HB THR 22 HB THR 22 -3.833 5.879 11.771
175 HG1 THR 22 1HG THR 22 -4.741 4.444 13.020
176 1HG2 THR 22 1HG2 THR 22 -5.499 7.433 11.740
177 2HG2 THR 22 2HG2 THR 22 -6.686 6.314 11.073
178 3HG2 THR 22 3HG2 THR 22 -5.439 6.998 10.031
179 H VAL 23 H VAL 23 -2.229 3.859 9.087
180 HA VAL 23 HA VAL 23 -1.746 1.759 11.091
181 HB VAL 23 HB VAL 23 -0.768 0.343 9.317
182 1HG1 VAL 23 1HG1 VAL 23 -3.368 0.572 10.004
183 2HG1 VAL 23 2HG1 VAL 23 -2.742 -0.659 8.907
184 3HG1 VAL 23 3HG1 VAL 23 -3.475 0.810 8.260
185 1HG2 VAL 23 1HG2 VAL 23 -0.133 1.512 7.494
186 2HG2 VAL 23 2HG2 VAL 23 -1.416 2.707 7.678
187 3HG2 VAL 23 3HG2 VAL 23 -1.767 1.141 6.946
188 H LYS 24 H LYS 24 0.018 2.309 12.188
189 HA LYS 24 HA LYS 24 2.042 3.989 10.951
190 1HB LYS 24 2HB LYS 24 3.035 3.951 13.287
191 2HB LYS 24 1HB LYS 24 1.456 4.705 13.119
192 1HG LYS 24 2HG LYS 24 0.362 2.852 14.099
193 2HG LYS 24 1HG LYS 24 1.810 1.850 13.988
194 1HD LYS 24 2HD LYS 24 1.948 4.386 15.544
195 2HD LYS 24 1HD LYS 24 1.108 3.005 16.254
196 1HE LYS 24 2HE LYS 24 3.100 1.631 15.964
197 2HE LYS 24 1HE LYS 24 3.940 2.989 15.217
198 1HZ LYS 24 1HZ LYS 24 4.509 2.690 17.572
199 2HZ LYS 24 2HZ LYS 24 2.896 2.970 17.997
200 3HZ LYS 24 3HZ LYS 24 3.806 4.199 17.274
201 H LEU 25 H LEU 25 3.449 2.936 9.702
202 HA LEU 25 HA LEU 25 4.608 0.421 10.689
203 1HB LEU 25 2HB LEU 25 5.177 -0.103 8.418
204 2HB LEU 25 1HB LEU 25 3.482 0.341 8.480
205 HG LEU 25 HG LEU 25 5.518 2.411 7.753
206 1HD1 LEU 25 1HD1 LEU 25 4.469 1.376 5.365
207 2HD1 LEU 25 2HD1 LEU 25 5.055 -0.010 6.285
208 3HD1 LEU 25 3HD1 LEU 25 6.142 1.330 5.921
209 1HD2 LEU 25 1HD2 LEU 25 3.304 2.743 6.195
210 2HD2 LEU 25 2HD2 LEU 25 3.584 3.543 7.742
211 3HD2 LEU 25 3HD2 LEU 25 2.610 2.074 7.671
212 H MET 26 H MET 26 6.945 0.103 10.100
213 HA MET 26 HA MET 26 8.444 2.369 11.028
214 1HB MET 26 2HB MET 26 8.886 -0.093 11.563
215 2HB MET 26 1HB MET 26 9.603 -0.198 9.961
216 1HG MET 26 2HG MET 26 11.483 0.795 10.613
217 2HG MET 26 1HG MET 26 10.619 2.042 11.510
218 1HE MET 26 1HE MET 26 10.003 2.098 13.689
219 2HE MET 26 2HE MET 26 10.656 1.133 15.012
220 3HE MET 26 3HE MET 26 9.204 0.599 14.165
221 H TYR 27 H TYR 27 8.566 4.001 9.573
222 HA TYR 27 HA TYR 27 9.653 3.351 6.912
223 1HB TYR 27 2HB TYR 27 7.389 4.339 6.847
224 2HB TYR 27 1HB TYR 27 7.987 5.746 7.720
225 HD1 TYR 27 1HD TYR 27 9.685 7.234 6.611
226 HD2 TYR 27 2HD TYR 27 7.640 4.156 4.503
227 HE1 TYR 27 1HE TYR 27 10.289 8.301 4.481
228 HE2 TYR 27 2HE TYR 27 8.239 5.216 2.367
229 HH TYR 27 HH TYR 27 9.521 8.369 2.172
230 H LYS 28 H LYS 28 11.811 3.579 7.184
231 HA LYS 28 HA LYS 28 13.831 4.588 7.458
232 1HB LYS 28 2HB LYS 28 12.013 6.925 7.016
233 2HB LYS 28 1HB LYS 28 13.684 7.211 7.481
234 1HG LYS 28 2HG LYS 28 14.024 5.440 5.469
235 2HG LYS 28 1HG LYS 28 12.561 6.271 4.938
236 1HD LYS 28 2HD LYS 28 14.346 8.252 5.875
237 2HD LYS 28 1HD LYS 28 15.277 7.164 4.843
238 1HE LYS 28 2HE LYS 28 14.472 8.342 3.127
239 2HE LYS 28 1HE LYS 28 12.944 7.517 3.428
240 1HZ LYS 28 1HZ LYS 28 12.177 9.603 3.615
241 2HZ LYS 28 2HZ LYS 28 13.696 10.264 3.954
242 3HZ LYS 28 3HZ LYS 28 12.805 9.522 5.184
243 H GLY 29 H GLY 29 12.248 3.820 9.782
244 1HA GLY 29 2HA GLY 29 12.674 3.842 12.055
245 2HA GLY 29 1HA GLY 29 13.851 5.118 11.785
246 H GLN 30 H GLN 30 10.621 5.504 10.584
247 HA GLN 30 HA GLN 30 9.854 7.111 12.902
248 1HB GLN 30 2HB GLN 30 9.828 8.161 10.069
249 2HB GLN 30 1HB GLN 30 9.198 9.001 11.479
250 1HG GLN 30 2HG GLN 30 11.660 8.629 12.356
251 2HG GLN 30 1HG GLN 30 12.003 8.548 10.629
252 1HE2 GLN 30 1HE2 GLN 30 12.988 10.432 10.258
253 2HE2 GLN 30 2HE2 GLN 30 12.311 11.987 10.586
254 HA PRO 31 HA PRO 31 6.113 4.779 12.042
255 1HB PRO 31 2HB PRO 31 4.935 6.707 13.959
256 2HB PRO 31 1HB PRO 31 4.944 4.942 14.002
257 1HG PRO 31 2HG PRO 31 6.481 6.369 15.655
258 2HG PRO 31 1HG PRO 31 7.048 4.841 14.955
259 1HD PRO 31 2HD PRO 31 7.735 7.649 14.187
260 2HD PRO 31 1HD PRO 31 8.777 6.213 14.264
261 H MET 32 H MET 32 4.653 5.085 10.477
262 HA MET 32 HA MET 32 3.651 7.800 9.976
263 1HB MET 32 2HB MET 32 4.891 5.911 7.990
264 2HB MET 32 1HB MET 32 3.776 7.172 7.485
265 1HG MET 32 2HG MET 32 5.302 8.809 8.656
266 2HG MET 32 1HG MET 32 6.461 7.487 8.784
267 1HE MET 32 1HE MET 32 5.834 10.436 7.353
268 2HE MET 32 2HE MET 32 4.780 10.051 5.991
269 3HE MET 32 3HE MET 32 6.476 10.450 5.710
270 H THR 33 H THR 33 1.516 7.790 10.121
271 HA THR 33 HA THR 33 0.050 5.300 9.693
272 HB THR 33 HB THR 33 -1.862 6.966 10.537
273 HG1 THR 33 1HG THR 33 -0.992 8.803 11.040
274 1HG2 THR 33 1HG2 THR 33 -1.782 5.441 12.137
275 2HG2 THR 33 2HG2 THR 33 -0.576 6.450 12.934
276 3HG2 THR 33 3HG2 THR 33 -0.066 5.144 11.864
277 H PHE 34 H PHE 34 -1.125 4.922 7.932
278 HA PHE 34 HA PHE 34 -2.125 7.169 6.348
279 1HB PHE 34 2HB PHE 34 -1.252 6.337 4.288
280 2HB PHE 34 1HB PHE 34 0.093 6.387 5.423
281 HD1 PHE 34 1HD PHE 34 1.052 4.329 6.307
282 HD2 PHE 34 2HD PHE 34 -2.120 4.256 3.470
283 HE1 PHE 34 1HE PHE 34 1.501 1.951 5.869
284 HE2 PHE 34 2HE PHE 34 -1.675 1.877 3.028
285 HZ PHE 34 HZ PHE 34 0.137 0.724 4.231
286 H ARG 35 H ARG 35 -3.815 6.559 4.834
287 HA ARG 35 HA ARG 35 -5.434 4.375 5.886
288 1HB ARG 35 2HB ARG 35 -6.542 6.515 5.664
289 2HB ARG 35 1HB ARG 35 -6.076 6.625 3.972
290 1HG ARG 35 2HG ARG 35 -7.701 5.197 3.285
291 2HG ARG 35 1HG ARG 35 -7.676 4.270 4.784
292 1HD ARG 35 2HD ARG 35 -9.535 5.348 5.361
293 2HD ARG 35 1HD ARG 35 -8.545 6.793 5.548
294 HE ARG 35 HE ARG 35 -9.119 6.793 2.910
295 1HH1 ARG 35 1HH1 ARG 35 -11.099 6.517 5.771
296 2HH1 ARG 35 2HH1 ARG 35 -12.480 7.262 5.040
297 1HH2 ARG 35 1HH2 ARG 35 -10.935 7.774 1.948
298 2HH2 ARG 35 2HH2 ARG 35 -12.388 7.976 2.868
299 H LEU 36 H LEU 36 -6.306 2.732 4.594
300 HA LEU 36 HA LEU 36 -4.660 1.492 2.782
301 1HB LEU 36 2HB LEU 36 -6.571 0.133 2.136
302 2HB LEU 36 1HB LEU 36 -6.536 0.382 3.871
303 HG LEU 36 HG LEU 36 -8.194 2.345 3.327
304 1HD1 LEU 36 1HD1 LEU 36 -9.710 1.446 1.422
305 2HD1 LEU 36 2HD1 LEU 36 -8.236 0.656 0.862
306 3HD1 LEU 36 3HD1 LEU 36 -8.289 2.411 1.022
307 1HD2 LEU 36 1HD2 LEU 36 -8.457 -0.145 4.365
308 2HD2 LEU 36 2HD2 LEU 36 -9.569 -0.231 3.001
309 3HD2 LEU 36 3HD2 LEU 36 -9.772 1.021 4.226
310 H LEU 37 H LEU 37 -4.758 1.173 0.498
311 HA LEU 37 HA LEU 37 -5.003 3.578 -0.971
312 1HB LEU 37 2HB LEU 37 -4.656 2.048 -2.962
313 2HB LEU 37 1HB LEU 37 -3.394 2.057 -1.745
314 HG LEU 37 HG LEU 37 -5.220 -0.003 -1.048
315 1HD1 LEU 37 1HD1 LEU 37 -4.662 0.217 -3.962
316 2HD1 LEU 37 2HD1 LEU 37 -6.105 -0.356 -3.128
317 3HD1 LEU 37 3HD1 LEU 37 -4.672 -1.379 -3.213
318 1HD2 LEU 37 1HD2 LEU 37 -2.673 -0.715 -2.344
319 2HD2 LEU 37 2HD2 LEU 37 -3.316 -1.177 -0.769
320 3HD2 LEU 37 3HD2 LEU 37 -2.555 0.401 -0.982
321 H LEU 38 H LEU 38 -6.383 4.012 -2.781
322 HA LEU 38 HA LEU 38 -9.039 2.767 -2.506
323 1HB LEU 38 2HB LEU 38 -9.940 4.890 -3.410
324 2HB LEU 38 1HB LEU 38 -9.122 5.076 -1.870
325 HG LEU 38 HG LEU 38 -7.557 5.577 -4.355
326 1HD1 LEU 38 1HD1 LEU 38 -9.895 7.144 -3.458
327 2HD1 LEU 38 2HD1 LEU 38 -9.184 6.976 -5.064
328 3HD1 LEU 38 3HD1 LEU 38 -8.444 8.052 -3.878
329 1HD2 LEU 38 1HD2 LEU 38 -6.168 6.700 -2.976
330 2HD2 LEU 38 2HD2 LEU 38 -6.937 5.704 -1.742
331 3HD2 LEU 38 3HD2 LEU 38 -7.485 7.358 -2.006
332 H VAL 39 H VAL 39 -9.926 1.806 -4.231
333 HA VAL 39 HA VAL 39 -8.363 1.618 -6.662
334 HB VAL 39 HB VAL 39 -10.178 0.022 -7.372
335 1HG1 VAL 39 1HG1 VAL 39 -8.266 -0.999 -6.537
336 2HG1 VAL 39 2HG1 VAL 39 -9.548 -1.677 -5.536
337 3HG1 VAL 39 3HG1 VAL 39 -8.530 -0.384 -4.905
338 1HG2 VAL 39 1HG2 VAL 39 -11.783 1.179 -5.637
339 2HG2 VAL 39 2HG2 VAL 39 -11.114 -0.033 -4.544
340 3HG2 VAL 39 3HG2 VAL 39 -11.944 -0.535 -6.018
341 H ASP 40 H ASP 40 -8.871 2.442 -8.628
342 HA ASP 40 HA ASP 40 -11.022 4.419 -8.700
343 1HB ASP 40 2HB ASP 40 -8.425 4.095 -10.029
344 2HB ASP 40 1HB ASP 40 -9.711 4.627 -11.109
345 H THR 41 H THR 41 -12.891 4.013 -9.660
346 HA THR 41 HA THR 41 -13.202 1.592 -11.230
347 HB THR 41 HB THR 41 -15.257 3.624 -10.341
348 HG1 THR 41 1HG THR 41 -14.427 1.153 -9.240
349 1HG2 THR 41 1HG2 THR 41 -15.834 2.107 -12.321
350 2HG2 THR 41 2HG2 THR 41 -16.948 2.165 -10.954
351 3HG2 THR 41 3HG2 THR 41 -15.842 0.802 -11.133
352 HA PRO 42 HA PRO 42 -12.923 3.664 -15.138
353 1HB PRO 42 2HB PRO 42 -14.310 1.887 -16.668
354 2HB PRO 42 1HB PRO 42 -12.656 1.606 -16.116
355 1HG PRO 42 2HG PRO 42 -15.231 0.582 -14.984
356 2HG PRO 42 1HG PRO 42 -13.701 -0.275 -15.238
357 1HD PRO 42 2HD PRO 42 -14.444 0.651 -12.815
358 2HD PRO 42 1HD PRO 42 -12.745 0.603 -13.327
359 H GLU 43 H GLU 43 -14.133 4.985 -16.468
360 HA GLU 43 HA GLU 43 -16.634 5.876 -15.459
361 1HB GLU 43 2HB GLU 43 -14.704 7.023 -16.964
362 2HB GLU 43 1HB GLU 43 -15.876 6.636 -18.217
363 1HG GLU 43 2HG GLU 43 -17.599 7.830 -16.859
364 2HG GLU 43 1HG GLU 43 -16.302 8.349 -15.784
365 H THR 44 H THR 44 -15.695 3.639 -17.955
366 HA THR 44 HA THR 44 -18.230 3.588 -19.282
367 HB THR 44 HB THR 44 -16.119 1.432 -19.363
368 HG1 THR 44 1HG THR 44 -16.234 3.835 -20.865
369 1HG2 THR 44 1HG2 THR 44 -17.279 2.091 -21.882
370 2HG2 THR 44 2HG2 THR 44 -18.557 1.735 -20.720
371 3HG2 THR 44 3HG2 THR 44 -17.282 0.554 -21.018
372 H LYS 45 H LYS 45 -19.823 1.997 -19.200
373 HA LYS 45 HA LYS 45 -21.225 0.494 -18.236
374 1HB LYS 45 2HB LYS 45 -18.533 -0.551 -17.539
375 2HB LYS 45 1HB LYS 45 -19.898 -1.208 -16.646
376 1HG LYS 45 2HG LYS 45 -20.964 -1.869 -18.735
377 2HG LYS 45 1HG LYS 45 -19.615 -1.184 -19.645
378 1HD LYS 45 2HD LYS 45 -18.960 -3.372 -19.573
379 2HD LYS 45 1HD LYS 45 -18.208 -2.788 -18.086
380 1HE LYS 45 2HE LYS 45 -20.986 -3.731 -17.827
381 2HE LYS 45 1HE LYS 45 -19.799 -4.970 -18.231
382 1HZ LYS 45 1HZ LYS 45 -19.385 -3.080 -15.994
383 2HZ LYS 45 2HZ LYS 45 -18.604 -4.552 -16.282
384 3HZ LYS 45 3HZ LYS 45 -20.222 -4.536 -15.790
385 H HIS 46 H HIS 46 -18.897 0.579 -15.563
386 HA HIS 46 HA HIS 46 -21.049 1.392 -13.774
387 1HB HIS 46 2HB HIS 46 -19.144 -0.458 -13.428
388 2HB HIS 46 1HB HIS 46 -18.293 0.929 -12.755
389 HD1 HIS 46 1HD HIS 46 -18.767 1.435 -10.373
390 HD2 HIS 46 2HD HIS 46 -21.744 -0.897 -12.093
391 HE1 HIS 46 1HE HIS 46 -20.329 0.844 -8.492
392 HE2 HIS 46 2HE HIS 46 -22.175 -0.484 -9.576
393 HA PRO 47 HA PRO 47 -20.006 5.663 -13.469
394 1HB PRO 47 2HB PRO 47 -20.228 5.327 -10.522
395 2HB PRO 47 1HB PRO 47 -21.066 6.455 -11.594
396 1HG PRO 47 2HG PRO 47 -22.334 4.344 -10.581
397 2HG PRO 47 1HG PRO 47 -22.636 4.879 -12.244
398 1HD PRO 47 2HD PRO 47 -21.016 2.570 -11.259
399 2HD PRO 47 1HD PRO 47 -22.060 2.688 -12.690
400 H LYS 48 H LYS 48 -18.311 7.052 -12.881
401 HA LYS 48 HA LYS 48 -15.874 5.672 -12.068
402 1HB LYS 48 2HB LYS 48 -16.103 7.245 -14.110
403 2HB LYS 48 1HB LYS 48 -16.033 8.546 -12.930
404 1HG LYS 48 2HG LYS 48 -13.880 7.261 -12.132
405 2HG LYS 48 1HG LYS 48 -13.921 6.641 -13.784
406 1HD LYS 48 2HD LYS 48 -14.102 9.040 -14.549
407 2HD LYS 48 1HD LYS 48 -13.745 9.510 -12.886
408 1HE LYS 48 2HE LYS 48 -11.752 9.488 -14.368
409 2HE LYS 48 1HE LYS 48 -11.612 8.418 -12.973
410 1HZ LYS 48 1HZ LYS 48 -12.690 7.225 -15.395
411 2HZ LYS 48 2HZ LYS 48 -11.600 6.591 -14.266
412 3HZ LYS 48 3HZ LYS 48 -11.055 7.664 -15.455
413 H LYS 49 H LYS 49 -15.568 5.567 -9.935
414 HA LYS 49 HA LYS 49 -15.288 7.983 -8.419
415 1HB LYS 49 2HB LYS 49 -17.812 6.685 -8.376
416 2HB LYS 49 1HB LYS 49 -17.050 6.388 -6.819
417 1HG LYS 49 2HG LYS 49 -16.911 8.674 -6.324
418 2HG LYS 49 1HG LYS 49 -17.209 9.140 -8.000
419 1HD LYS 49 2HD LYS 49 -19.327 9.452 -7.332
420 2HD LYS 49 1HD LYS 49 -19.449 7.693 -7.409
421 1HE LYS 49 2HE LYS 49 -18.305 8.631 -4.904
422 2HE LYS 49 1HE LYS 49 -19.920 9.275 -5.193
423 1HZ LYS 49 1HZ LYS 49 -20.262 7.270 -4.085
424 2HZ LYS 49 2HZ LYS 49 -19.084 6.448 -4.977
425 3HZ LYS 49 3HZ LYS 49 -20.548 6.881 -5.705
426 H GLY 50 H GLY 50 -13.727 7.719 -6.947
427 1HA GLY 50 2HA GLY 50 -12.413 5.201 -6.697
428 2HA GLY 50 1HA GLY 50 -12.018 6.669 -5.815
429 H VAL 51 H VAL 51 -14.018 3.790 -5.850
430 HA VAL 51 HA VAL 51 -15.287 4.270 -3.347
431 HB VAL 51 HB VAL 51 -15.905 1.878 -3.425
432 1HG1 VAL 51 1HG1 VAL 51 -17.200 1.991 -5.549
433 2HG1 VAL 51 2HG1 VAL 51 -16.294 3.445 -5.970
434 3HG1 VAL 51 3HG1 VAL 51 -17.337 3.436 -4.547
435 1HG2 VAL 51 1HG2 VAL 51 -13.837 1.030 -4.438
436 2HG2 VAL 51 2HG2 VAL 51 -14.267 1.814 -5.958
437 3HG2 VAL 51 3HG2 VAL 51 -15.265 0.504 -5.330
438 H GLU 52 H GLU 52 -14.986 2.905 -1.419
439 HA GLU 52 HA GLU 52 -12.125 2.418 -0.937
440 1HB GLU 52 2HB GLU 52 -14.216 3.714 0.607
441 2HB GLU 52 1HB GLU 52 -13.416 2.455 1.535
442 1HG GLU 52 2HG GLU 52 -11.550 4.147 0.085
443 2HG GLU 52 1HG GLU 52 -12.554 5.044 1.222
444 H LYS 53 H LYS 53 -11.485 0.582 0.272
445 HA LYS 53 HA LYS 53 -12.762 -1.805 -0.426
446 1HB LYS 53 2HB LYS 53 -10.571 -1.068 1.461
447 2HB LYS 53 1HB LYS 53 -11.260 -2.682 1.571
448 1HG LYS 53 2HG LYS 53 -10.581 -3.240 -0.605
449 2HG LYS 53 1HG LYS 53 -10.262 -1.556 -1.024
450 1HD LYS 53 2HD LYS 53 -8.122 -2.097 -0.583
451 2HD LYS 53 1HD LYS 53 -8.606 -1.882 1.101
452 1HE LYS 53 2HE LYS 53 -8.880 -4.527 -0.291
453 2HE LYS 53 1HE LYS 53 -7.363 -4.037 0.462
454 1HZ LYS 53 1HZ LYS 53 -8.612 -3.721 2.552
455 2HZ LYS 53 2HZ LYS 53 -8.622 -5.323 2.013
456 3HZ LYS 53 3HZ LYS 53 -9.992 -4.354 1.805
457 H TYR 54 H TYR 54 -14.884 -1.938 0.181
458 HA TYR 54 HA TYR 54 -15.557 -1.619 3.010
459 1HB TYR 54 2HB TYR 54 -17.929 -1.916 2.144
460 2HB TYR 54 1HB TYR 54 -17.081 -0.471 1.603
461 HD1 TYR 54 1HD TYR 54 -17.246 0.073 -0.631
462 HD2 TYR 54 2HD TYR 54 -17.597 -4.011 0.507
463 HE1 TYR 54 1HE TYR 54 -17.698 -0.534 -2.970
464 HE2 TYR 54 2HE TYR 54 -18.050 -4.631 -1.829
465 HH TYR 54 HH TYR 54 -17.640 -3.739 -4.082
466 H GLY 55 H GLY 55 -14.010 -3.917 1.960
467 1HA GLY 55 2HA GLY 55 -15.910 -6.084 2.607
468 2HA GLY 55 1HA GLY 55 -14.499 -6.285 1.579
469 HA PRO 56 HA PRO 56 -13.570 -7.266 6.142
470 1HB PRO 56 2HB PRO 56 -13.481 -9.969 6.005
471 2HB PRO 56 1HB PRO 56 -14.965 -9.081 6.365
472 1HG PRO 56 2HG PRO 56 -14.047 -10.263 3.772
473 2HG PRO 56 1HG PRO 56 -15.659 -10.304 4.511
474 1HD PRO 56 2HD PRO 56 -14.997 -8.574 2.529
475 2HD PRO 56 1HD PRO 56 -16.180 -8.179 3.791
476 H GLU 57 H GLU 57 -12.395 -8.230 3.027
477 HA GLU 57 HA GLU 57 -10.038 -9.538 3.616
478 1HB GLU 57 2HB GLU 57 -10.653 -7.575 1.408
479 2HB GLU 57 1HB GLU 57 -9.178 -8.530 1.470
480 1HG GLU 57 2HG GLU 57 -10.647 -10.575 1.533
481 2HG GLU 57 1HG GLU 57 -12.000 -9.508 1.165
482 H ALA 58 H ALA 58 -10.829 -6.193 4.068
483 HA ALA 58 HA ALA 58 -8.273 -5.062 4.113
484 1HB ALA 58 1HB ALA 58 -10.430 -4.125 5.960
485 2HB ALA 58 2HB ALA 58 -10.606 -3.947 4.215
486 3HB ALA 58 3HB ALA 58 -9.251 -3.183 5.047
487 H SER 59 H SER 59 -10.240 -6.038 6.932
488 HA SER 59 HA SER 59 -7.828 -6.081 8.568
489 1HB SER 59 2HB SER 59 -9.354 -6.306 10.470
490 2HB SER 59 1HB SER 59 -9.838 -4.956 9.444
491 HG SER 59 HG SER 59 -10.977 -7.556 9.472
492 H ALA 60 H ALA 60 -9.789 -8.272 6.842
493 HA ALA 60 HA ALA 60 -9.237 -10.550 8.531
494 1HB ALA 60 1HB ALA 60 -11.326 -10.177 7.089
495 2HB ALA 60 2HB ALA 60 -10.608 -11.788 7.110
496 3HB ALA 60 3HB ALA 60 -10.321 -10.712 5.743
497 H PHE 61 H PHE 61 -8.501 -9.821 5.114
498 HA PHE 61 HA PHE 61 -6.664 -11.856 4.704
499 1HB PHE 61 2HB PHE 61 -7.693 -10.311 2.972
500 2HB PHE 61 1HB PHE 61 -6.468 -9.130 3.423
501 HD1 PHE 61 1HD PHE 61 -4.506 -9.084 2.233
502 HD2 PHE 61 2HD PHE 61 -6.747 -12.698 2.376
503 HE1 PHE 61 1HE PHE 61 -2.925 -10.122 0.661
504 HE2 PHE 61 2HE PHE 61 -5.169 -13.745 0.806
505 HZ PHE 61 HZ PHE 61 -3.255 -12.457 -0.054
506 H THR 62 H THR 62 -5.966 -8.464 5.557
507 HA THR 62 HA THR 62 -3.197 -8.754 5.790
508 HB THR 62 HB THR 62 -3.221 -6.652 6.989
509 HG1 THR 62 1HG THR 62 -4.827 -6.105 8.210
510 1HG2 THR 62 1HG2 THR 62 -5.108 -5.441 5.567
511 2HG2 THR 62 2HG2 THR 62 -5.026 -6.958 4.672
512 3HG2 THR 62 3HG2 THR 62 -3.578 -5.971 4.869
513 H LYS 63 H LYS 63 -5.722 -9.786 7.879
514 HA LYS 63 HA LYS 63 -3.984 -10.003 10.197
515 1HB LYS 63 2HB LYS 63 -6.308 -9.337 10.534
516 2HB LYS 63 1HB LYS 63 -6.862 -10.832 9.795
517 1HG LYS 63 2HG LYS 63 -6.616 -11.984 11.686
518 2HG LYS 63 1HG LYS 63 -5.034 -11.274 12.016
519 1HD LYS 63 2HD LYS 63 -5.937 -9.477 13.167
520 2HD LYS 63 1HD LYS 63 -7.514 -9.646 12.395
521 1HE LYS 63 2HE LYS 63 -8.102 -11.474 13.734
522 2HE LYS 63 1HE LYS 63 -6.432 -11.763 14.224
523 1HZ LYS 63 1HZ LYS 63 -8.200 -10.510 15.750
524 2HZ LYS 63 2HZ LYS 63 -7.552 -9.176 14.937
525 3HZ LYS 63 3HZ LYS 63 -6.537 -10.199 15.824
526 H LYS 64 H LYS 64 -4.966 -11.927 7.533
527 HA LYS 64 HA LYS 64 -4.421 -14.446 8.868
528 1HB LYS 64 2HB LYS 64 -5.607 -13.605 6.299
529 2HB LYS 64 1HB LYS 64 -4.716 -15.120 6.262
530 1HG LYS 64 2HG LYS 64 -6.106 -15.869 8.215
531 2HG LYS 64 1HG LYS 64 -7.093 -14.426 7.965
532 1HD LYS 64 2HD LYS 64 -8.189 -16.189 6.825
533 2HD LYS 64 1HD LYS 64 -7.413 -15.204 5.584
534 1HE LYS 64 2HE LYS 64 -7.053 -17.531 5.083
535 2HE LYS 64 1HE LYS 64 -5.522 -16.801 5.561
536 1HZ LYS 64 1HZ LYS 64 -6.649 -17.760 7.886
537 2HZ LYS 64 2HZ LYS 64 -5.341 -18.423 7.042
538 3HZ LYS 64 3HZ LYS 64 -6.910 -18.977 6.738
539 H MET 65 H MET 65 -3.210 -12.979 5.846
540 HA MET 65 HA MET 65 -0.780 -14.551 6.072
541 1HB MET 65 2HB MET 65 -2.282 -13.752 3.932
542 2HB MET 65 1HB MET 65 -0.956 -12.598 3.886
543 1HG MET 65 2HG MET 65 -0.176 -14.297 2.552
544 2HG MET 65 1HG MET 65 0.552 -14.685 4.112
545 1HE MET 65 1HE MET 65 -1.198 -17.336 5.629
546 2HE MET 65 2HE MET 65 0.215 -16.290 5.468
547 3HE MET 65 3HE MET 65 0.180 -17.858 4.660
548 H TRP 66 H TRP 66 -1.560 -11.087 5.663
549 HA TRP 66 HA TRP 66 1.043 -10.150 5.969
550 1HB TRP 66 2HB TRP 66 -0.782 -8.766 5.100
551 2HB TRP 66 1HB TRP 66 -1.524 -8.740 6.693
552 HD1 TRP 66 HD TRP 66 1.909 -7.717 5.178
553 HE1 TRP 66 1HE TRP 66 2.640 -5.525 6.311
554 HE3 TRP 66 3HE TRP 66 -1.992 -7.140 8.433
555 HZ2 TRP 66 2HZ TRP 66 1.688 -3.780 8.315
556 HZ3 TRP 66 3HZ TRP 66 -2.005 -5.183 9.923
557 HH2 TRP 66 HH TRP 66 -0.201 -3.538 9.866
558 H GLU 67 H GLU 67 -1.072 -11.444 8.328
559 HA GLU 67 HA GLU 67 0.292 -10.135 10.542
560 1HB GLU 67 2HB GLU 67 -2.276 -10.952 10.249
561 2HB GLU 67 1HB GLU 67 -1.602 -12.333 11.100
562 1HG GLU 67 2HG GLU 67 -0.727 -9.907 12.343
563 2HG GLU 67 1HG GLU 67 -2.482 -9.901 12.178
564 H ASN 68 H ASN 68 -0.122 -13.402 9.217
565 HA ASN 68 HA ASN 68 1.667 -14.566 11.149
566 1HB ASN 68 2HB ASN 68 0.517 -15.744 8.610
567 2HB ASN 68 1HB ASN 68 1.344 -16.643 9.879
568 1HD2 ASN 68 1HD2 ASN 68 -0.263 -17.913 10.586
569 2HD2 ASN 68 2HD2 ASN 68 -1.742 -17.339 11.264
570 H ALA 69 H ALA 69 1.907 -13.258 7.936
571 HA ALA 69 HA ALA 69 4.699 -14.167 7.756
572 1HB ALA 69 1HB ALA 69 3.715 -14.884 5.799
573 2HB ALA 69 2HB ALA 69 4.362 -13.316 5.311
574 3HB ALA 69 3HB ALA 69 2.648 -13.485 5.696
575 H LYS 70 H LYS 70 6.333 -12.668 7.172
576 HA LYS 70 HA LYS 70 5.690 -9.929 7.993
577 1HB LYS 70 2HB LYS 70 8.222 -9.728 8.155
578 2HB LYS 70 1HB LYS 70 7.440 -10.795 9.312
579 1HG LYS 70 2HG LYS 70 8.216 -12.719 8.245
580 2HG LYS 70 1HG LYS 70 8.595 -11.850 6.757
581 1HD LYS 70 2HD LYS 70 10.700 -11.998 7.597
582 2HD LYS 70 1HD LYS 70 10.198 -10.523 8.427
583 1HE LYS 70 2HE LYS 70 9.772 -11.676 10.436
584 2HE LYS 70 1HE LYS 70 9.816 -13.247 9.636
585 1HZ LYS 70 1HZ LYS 70 11.836 -12.532 10.998
586 2HZ LYS 70 2HZ LYS 70 12.202 -11.508 9.702
587 3HZ LYS 70 3HZ LYS 70 12.116 -13.181 9.461
588 H LYS 71 H LYS 71 4.884 -9.049 6.111
589 HA LYS 71 HA LYS 71 6.880 -8.534 4.027
590 1HB LYS 71 2HB LYS 71 4.991 -8.738 2.340
591 2HB LYS 71 1HB LYS 71 5.579 -10.248 3.022
592 1HG LYS 71 2HG LYS 71 3.320 -8.963 4.422
593 2HG LYS 71 1HG LYS 71 2.983 -9.639 2.829
594 1HD LYS 71 2HD LYS 71 4.575 -11.394 4.546
595 2HD LYS 71 1HD LYS 71 2.964 -11.042 5.178
596 1HE LYS 71 2HE LYS 71 3.394 -11.896 2.331
597 2HE LYS 71 1HE LYS 71 3.236 -13.074 3.635
598 1HZ LYS 71 1HZ LYS 71 1.097 -12.778 2.734
599 2HZ LYS 71 2HZ LYS 71 1.230 -11.092 2.725
600 3HZ LYS 71 3HZ LYS 71 1.090 -11.922 4.194
601 H ILE 72 H ILE 72 7.167 -6.407 4.600
602 HA ILE 72 HA ILE 72 4.851 -4.663 4.181
603 HB ILE 72 HB ILE 72 6.675 -3.805 6.345
604 1HG1 ILE 72 2HG1 ILE 72 5.147 -5.110 7.978
605 2HG1 ILE 72 1HG1 ILE 72 4.786 -6.139 6.597
606 1HG2 ILE 72 1HG2 ILE 72 4.530 -2.701 5.322
607 2HG2 ILE 72 2HG2 ILE 72 4.859 -2.593 7.051
608 3HG2 ILE 72 3HG2 ILE 72 3.698 -3.775 6.447
609 1HD1 ILE 72 1HD1 ILE 72 7.621 -5.776 6.867
610 2HD1 ILE 72 2HD1 ILE 72 6.670 -7.261 6.878
611 3HD1 ILE 72 3HD1 ILE 72 6.916 -6.361 8.375
612 H GLU 73 H GLU 73 5.328 -3.222 2.686
613 HA GLU 73 HA GLU 73 7.888 -1.867 2.723
614 1HB GLU 73 2HB GLU 73 6.941 -3.480 0.359
615 2HB GLU 73 1HB GLU 73 8.205 -2.262 0.258
616 1HG GLU 73 2HG GLU 73 9.085 -3.787 2.330
617 2HG GLU 73 1HG GLU 73 8.292 -4.989 1.313
618 H VAL 74 H VAL 74 7.951 -0.164 0.907
619 HA VAL 74 HA VAL 74 5.373 1.229 0.969
620 HB VAL 74 HB VAL 74 8.089 2.351 0.269
621 1HG1 VAL 74 1HG1 VAL 74 5.737 3.938 1.210
622 2HG1 VAL 74 2HG1 VAL 74 5.879 3.482 -0.488
623 3HG1 VAL 74 3HG1 VAL 74 7.137 4.458 0.270
624 1HG2 VAL 74 1HG2 VAL 74 7.383 1.436 2.732
625 2HG2 VAL 74 2HG2 VAL 74 6.862 3.118 2.820
626 3HG2 VAL 74 3HG2 VAL 74 8.539 2.735 2.435
627 H GLU 75 H GLU 75 4.351 1.962 -0.862
628 HA GLU 75 HA GLU 75 5.603 1.364 -3.450
629 1HB GLU 75 2HB GLU 75 3.588 -0.182 -2.355
630 2HB GLU 75 1HB GLU 75 2.726 0.889 -3.450
631 1HG GLU 75 2HG GLU 75 5.114 -0.749 -4.255
632 2HG GLU 75 1HG GLU 75 3.445 -1.290 -4.432
633 H PHE 76 H PHE 76 4.166 3.676 -1.547
634 HA PHE 76 HA PHE 76 2.813 5.043 -3.735
635 1HB PHE 76 2HB PHE 76 1.821 6.426 -2.144
636 2HB PHE 76 1HB PHE 76 1.953 4.892 -1.299
637 HD1 PHE 76 1HD PHE 76 1.627 7.706 -0.130
638 HD2 PHE 76 2HD PHE 76 5.028 5.244 -0.810
639 HE1 PHE 76 1HE PHE 76 2.808 8.834 1.709
640 HE2 PHE 76 2HE PHE 76 6.215 6.365 1.030
641 HZ PHE 76 HZ PHE 76 5.104 8.163 2.293
642 H ASP 77 H ASP 77 3.220 7.396 -4.037
643 HA ASP 77 HA ASP 77 6.112 7.883 -4.097
644 1HB ASP 77 2HB ASP 77 4.444 8.013 -6.156
645 2HB ASP 77 1HB ASP 77 4.169 9.637 -5.534
646 H LYS 78 H LYS 78 7.037 9.638 -3.151
647 HA LYS 78 HA LYS 78 5.664 10.876 -0.997
648 1HB LYS 78 2HB LYS 78 7.768 12.308 -0.892
649 2HB LYS 78 1HB LYS 78 7.987 10.574 -0.710
650 1HG LYS 78 2HG LYS 78 8.919 10.348 -2.837
651 2HG LYS 78 1HG LYS 78 8.296 11.909 -3.374
652 1HD LYS 78 2HD LYS 78 9.918 13.097 -2.216
653 2HD LYS 78 1HD LYS 78 10.235 11.768 -1.099
654 1HE LYS 78 2HE LYS 78 12.028 12.208 -2.814
655 2HE LYS 78 1HE LYS 78 11.431 10.551 -2.740
656 1HZ LYS 78 1HZ LYS 78 11.649 11.318 -5.021
657 2HZ LYS 78 2HZ LYS 78 10.589 12.601 -4.719
658 3HZ LYS 78 3HZ LYS 78 10.028 11.006 -4.651
659 H GLY 79 H GLY 79 4.086 12.310 -1.330
660 1HA GLY 79 2HA GLY 79 3.307 14.465 -1.800
661 2HA GLY 79 1HA GLY 79 4.699 14.717 -2.842
662 H GLN 80 H GLN 80 2.338 12.080 -2.938
663 HA GLN 80 HA GLN 80 1.966 12.472 -5.764
664 1HB GLN 80 2HB GLN 80 1.739 10.315 -4.033
665 2HB GLN 80 1HB GLN 80 0.075 10.659 -4.485
666 1HG GLN 80 2HG GLN 80 2.371 10.030 -6.320
667 2HG GLN 80 1HG GLN 80 0.951 9.038 -5.995
668 1HE2 GLN 80 1HE2 GLN 80 -1.151 10.014 -6.590
669 2HE2 GLN 80 2HE2 GLN 80 -1.223 10.966 -8.030
670 H ARG 81 H ARG 81 -0.369 12.296 -3.067
671 HA ARG 81 HA ARG 81 -1.720 14.671 -3.926
672 1HB ARG 81 2HB ARG 81 -2.504 12.823 -5.512
673 2HB ARG 81 1HB ARG 81 -3.317 12.124 -4.119
674 1HG ARG 81 2HG ARG 81 -5.042 13.357 -4.866
675 2HG ARG 81 1HG ARG 81 -4.237 14.639 -3.960
676 1HD ARG 81 2HD ARG 81 -4.305 15.777 -5.888
677 2HD ARG 81 1HD ARG 81 -2.947 14.756 -6.361
678 HE ARG 81 HE ARG 81 -5.516 13.603 -6.934
679 1HH1 ARG 81 1HH1 ARG 81 -3.002 15.719 -8.112
680 2HH1 ARG 81 2HH1 ARG 81 -3.434 15.510 -9.776
681 1HH2 ARG 81 1HH2 ARG 81 -6.085 13.328 -9.123
682 2HH2 ARG 81 2HH2 ARG 81 -5.182 14.151 -10.350
683 H THR 82 H THR 82 -1.522 15.392 -1.838
684 HA THR 82 HA THR 82 -2.288 13.818 0.424
685 HB THR 82 HB THR 82 -1.725 15.692 1.740
686 HG1 THR 82 1HG THR 82 -2.099 17.265 -0.588
687 1HG2 THR 82 1HG2 THR 82 -0.029 16.100 -0.707
688 2HG2 THR 82 2HG2 THR 82 0.211 14.792 0.453
689 3HG2 THR 82 3HG2 THR 82 0.383 16.470 0.968
690 H ASP 83 H ASP 83 -4.053 14.261 1.871
691 HA ASP 83 HA ASP 83 -6.362 15.467 0.493
692 1HB ASP 83 2HB ASP 83 -6.338 12.931 1.000
693 2HB ASP 83 1HB ASP 83 -6.607 13.411 2.672
694 H LYS 84 H LYS 84 -5.061 14.825 3.762
695 HA LYS 84 HA LYS 84 -6.478 17.240 4.675
696 1HB LYS 84 2HB LYS 84 -6.817 14.830 5.710
697 2HB LYS 84 1HB LYS 84 -5.359 15.252 6.599
698 1HG LYS 84 2HG LYS 84 -7.350 15.778 7.882
699 2HG LYS 84 1HG LYS 84 -6.460 17.246 7.475
700 1HD LYS 84 2HD LYS 84 -8.035 17.902 5.881
701 2HD LYS 84 1HD LYS 84 -8.715 16.280 5.751
702 1HE LYS 84 2HE LYS 84 -9.861 16.467 7.777
703 2HE LYS 84 1HE LYS 84 -8.865 17.818 8.319
704 1HZ LYS 84 1HZ LYS 84 -10.456 18.209 5.901
705 2HZ LYS 84 2HZ LYS 84 -10.068 19.305 7.129
706 3HZ LYS 84 3HZ LYS 84 -11.288 18.159 7.374
707 H TYR 85 H TYR 85 -3.555 15.414 5.616
708 HA TYR 85 HA TYR 85 -2.075 17.953 5.644
709 1HB TYR 85 2HB TYR 85 -2.739 17.403 7.953
710 2HB TYR 85 1HB TYR 85 -1.943 15.839 7.803
711 HD1 TYR 85 1HD TYR 85 -1.277 19.500 7.672
712 HD2 TYR 85 2HD TYR 85 0.315 15.614 8.360
713 HE1 TYR 85 1HE TYR 85 0.826 20.505 8.454
714 HE2 TYR 85 2HE TYR 85 2.421 16.610 9.144
715 HH TYR 85 HH TYR 85 3.269 19.777 8.616
716 H GLY 86 H GLY 86 -2.264 15.208 4.077
717 1HA GLY 86 2HA GLY 86 -0.237 14.895 2.598
718 2HA GLY 86 1HA GLY 86 0.643 14.688 4.103
719 H ARG 87 H ARG 87 -1.986 13.280 5.042
720 HA ARG 87 HA ARG 87 -1.083 10.636 4.229
721 1HB ARG 87 2HB ARG 87 -3.380 11.062 6.093
722 2HB ARG 87 1HB ARG 87 -2.155 9.802 6.100
723 1HG ARG 87 2HG ARG 87 -0.692 12.081 6.567
724 2HG ARG 87 1HG ARG 87 -2.193 12.380 7.443
725 1HD ARG 87 2HD ARG 87 -1.863 9.978 8.344
726 2HD ARG 87 1HD ARG 87 -0.194 10.181 7.811
727 HE ARG 87 HE ARG 87 -1.463 11.430 10.072
728 1HH1 ARG 87 1HH1 ARG 87 1.154 11.643 7.772
729 2HH1 ARG 87 2HH1 ARG 87 2.141 12.628 8.799
730 1HH2 ARG 87 1HH2 ARG 87 -0.167 12.726 11.422
731 2HH2 ARG 87 2HH2 ARG 87 1.393 13.243 10.871
732 H GLY 88 H GLY 88 -1.825 10.201 2.210
733 1HA GLY 88 2HA GLY 88 -4.720 9.879 1.946
734 2HA GLY 88 1HA GLY 88 -3.912 10.896 0.762
735 H LEU 89 H LEU 89 -1.565 9.484 0.375
736 HA LEU 89 HA LEU 89 -2.527 7.331 -1.285
737 1HB LEU 89 2HB LEU 89 0.094 8.710 -0.893
738 2HB LEU 89 1HB LEU 89 0.059 7.153 -1.697
739 HG LEU 89 HG LEU 89 0.052 9.074 -3.264
740 1HD1 LEU 89 1HD1 LEU 89 -0.780 7.301 -4.394
741 2HD1 LEU 89 2HD1 LEU 89 -2.253 8.271 -4.358
742 3HD1 LEU 89 3HD1 LEU 89 -2.023 6.972 -3.187
743 1HD2 LEU 89 1HD2 LEU 89 -2.069 10.344 -3.503
744 2HD2 LEU 89 2HD2 LEU 89 -1.211 10.678 -1.999
745 3HD2 LEU 89 3HD2 LEU 89 -2.625 9.624 -1.993
746 H ALA 90 H ALA 90 -1.905 5.157 -1.163
747 HA ALA 90 HA ALA 90 -1.150 4.294 1.541
748 1HB ALA 90 1HB ALA 90 -2.051 2.225 -0.308
749 2HB ALA 90 2HB ALA 90 -3.235 3.506 -0.047
750 3HB ALA 90 3HB ALA 90 -2.597 2.603 1.326
751 H TYR 91 H TYR 91 0.529 2.898 1.913
752 HA TYR 91 HA TYR 91 2.107 1.978 -0.372
753 1HB TYR 91 2HB TYR 91 4.189 2.721 0.907
754 2HB TYR 91 1HB TYR 91 3.246 3.983 0.124
755 HD1 TYR 91 1HD TYR 91 1.428 5.117 1.658
756 HD2 TYR 91 2HD TYR 91 4.832 3.014 3.103
757 HE1 TYR 91 1HE TYR 91 1.251 6.313 3.798
758 HE2 TYR 91 2HE TYR 91 4.663 4.202 5.246
759 HH TYR 91 HH TYR 91 2.746 5.362 6.564
760 H ILE 92 H ILE 92 1.398 -0.120 0.142
761 HA ILE 92 HA ILE 92 2.921 -1.371 2.278
762 HB ILE 92 HB ILE 92 0.808 -0.821 3.383
763 1HG1 ILE 92 2HG1 ILE 92 0.237 -3.629 3.251
764 2HG1 ILE 92 1HG1 ILE 92 1.980 -3.395 3.173
765 1HG2 ILE 92 1HG2 ILE 92 -0.663 -0.715 1.478
766 2HG2 ILE 92 2HG2 ILE 92 -1.290 -1.890 2.635
767 3HG2 ILE 92 3HG2 ILE 92 -0.457 -2.442 1.182
768 1HD1 ILE 92 1HD1 ILE 92 1.836 -2.013 5.218
769 2HD1 ILE 92 2HD1 ILE 92 1.324 -3.685 5.454
770 3HD1 ILE 92 3HD1 ILE 92 0.118 -2.404 5.314
771 H TYR 93 H TYR 93 3.461 -3.473 1.852
772 HA TYR 93 HA TYR 93 2.361 -4.649 -0.612
773 1HB TYR 93 2HB TYR 93 4.407 -4.641 -1.515
774 2HB TYR 93 1HB TYR 93 5.049 -3.869 -0.073
775 HD1 TYR 93 1HD TYR 93 4.743 -6.979 -1.934
776 HD2 TYR 93 2HD TYR 93 6.083 -5.234 1.706
777 HE1 TYR 93 1HE TYR 93 6.069 -8.996 -1.463
778 HE2 TYR 93 2HE TYR 93 7.413 -7.246 2.188
779 HH TYR 93 HH TYR 93 7.269 -9.761 1.482
780 H ALA 94 H ALA 94 1.291 -6.457 -0.210
781 HA ALA 94 HA ALA 94 2.068 -8.064 2.132
782 1HB ALA 94 1HB ALA 94 -0.332 -6.962 1.747
783 2HB ALA 94 2HB ALA 94 -0.112 -8.498 2.582
784 3HB ALA 94 3HB ALA 94 -0.584 -8.478 0.882
785 H ASP 95 H ASP 95 3.598 -9.370 1.134
786 HA ASP 95 HA ASP 95 4.393 -11.142 -0.055
787 1HB ASP 95 2HB ASP 95 1.948 -11.910 0.941
788 2HB ASP 95 1HB ASP 95 1.780 -12.265 -0.776
789 H GLY 96 H GLY 96 3.473 -8.640 -1.454
790 1HA GLY 96 2HA GLY 96 2.487 -9.451 -4.016
791 2HA GLY 96 1HA GLY 96 3.114 -7.864 -3.597
792 H LYS 97 H LYS 97 5.164 -7.326 -4.160
793 HA LYS 97 HA LYS 97 6.666 -9.356 -5.667
794 1HB LYS 97 2HB LYS 97 6.945 -6.352 -5.833
795 2HB LYS 97 1HB LYS 97 7.681 -7.544 -6.899
796 1HG LYS 97 2HG LYS 97 5.575 -8.121 -7.839
797 2HG LYS 97 1HG LYS 97 4.708 -7.178 -6.625
798 1HD LYS 97 2HD LYS 97 6.691 -5.641 -8.136
799 2HD LYS 97 1HD LYS 97 5.386 -6.298 -9.127
800 1HE LYS 97 2HE LYS 97 4.291 -4.438 -8.496
801 2HE LYS 97 1HE LYS 97 3.990 -5.340 -7.011
802 1HZ LYS 97 1HZ LYS 97 5.101 -2.927 -7.068
803 2HZ LYS 97 2HZ LYS 97 6.497 -3.880 -7.118
804 3HZ LYS 97 3HZ LYS 97 5.399 -4.056 -5.844
805 H MET 98 H MET 98 8.214 -10.248 -4.469
806 HA MET 98 HA MET 98 9.435 -8.861 -2.266
807 1HB MET 98 2HB MET 98 9.512 -11.596 -3.395
808 2HB MET 98 1HB MET 98 10.957 -11.075 -2.541
809 1HG MET 98 2HG MET 98 9.606 -10.563 -0.570
810 2HG MET 98 1HG MET 98 8.159 -11.090 -1.429
811 1HE MET 98 1HE MET 98 10.259 -11.953 1.254
812 2HE MET 98 2HE MET 98 11.606 -12.273 0.161
813 3HE MET 98 3HE MET 98 10.868 -13.597 1.062
814 H VAL 99 H VAL 99 11.305 -7.773 -2.234
815 HA VAL 99 HA VAL 99 12.638 -7.183 -4.697
816 HB VAL 99 HB VAL 99 14.224 -5.894 -3.208
817 1HG1 VAL 99 1HG1 VAL 99 11.990 -5.100 -4.273
818 2HG1 VAL 99 2HG1 VAL 99 12.784 -4.092 -3.064
819 3HG1 VAL 99 3HG1 VAL 99 11.407 -5.094 -2.607
820 1HG2 VAL 99 1HG2 VAL 99 14.093 -5.933 -0.958
821 2HG2 VAL 99 2HG2 VAL 99 13.332 -7.503 -1.224
822 3HG2 VAL 99 3HG2 VAL 99 12.333 -6.074 -0.959
823 H ASN 100 H ASN 100 14.362 -8.136 -5.565
824 HA ASN 100 HA ASN 100 15.485 -10.474 -4.381
825 1HB ASN 100 2HB ASN 100 15.215 -9.745 -6.915
826 2HB ASN 100 1HB ASN 100 16.832 -9.094 -6.663
827 1HD2 ASN 100 1HD2 ASN 100 14.900 -11.936 -6.956
828 2HD2 ASN 100 2HD2 ASN 100 16.200 -13.073 -7.000
829 H GLU 101 H GLU 101 16.299 -9.645 -2.381
830 HA GLU 101 HA GLU 101 18.968 -8.462 -2.681
831 1HB GLU 101 2HB GLU 101 16.923 -7.618 -0.618
832 2HB GLU 101 1HB GLU 101 18.587 -7.055 -0.694
833 1HG GLU 101 2HG GLU 101 16.631 -6.665 -2.938
834 2HG GLU 101 1HG GLU 101 16.835 -5.505 -1.626
835 H ALA 102 H ALA 102 20.506 -9.203 -1.256
836 HA ALA 102 HA ALA 102 19.894 -11.692 0.070
837 1HB ALA 102 1HB ALA 102 22.463 -10.159 -0.279
838 2HB ALA 102 2HB ALA 102 21.945 -11.606 -1.143
839 3HB ALA 102 3HB ALA 102 22.346 -11.699 0.572
840 H LEU 103 H LEU 103 21.694 -8.828 1.203
841 HA LEU 103 HA LEU 103 20.135 -8.783 3.651
842 1HB LEU 103 2HB LEU 103 22.513 -8.626 4.847
843 2HB LEU 103 1HB LEU 103 21.646 -10.138 4.655
844 HG LEU 103 HG LEU 103 23.490 -9.420 2.455
845 1HD1 LEU 103 1HD1 LEU 103 24.489 -8.958 4.911
846 2HD1 LEU 103 2HD1 LEU 103 25.448 -9.561 3.559
847 3HD1 LEU 103 3HD1 LEU 103 24.815 -10.686 4.760
848 1HD2 LEU 103 1HD2 LEU 103 22.045 -11.580 2.959
849 2HD2 LEU 103 2HD2 LEU 103 23.476 -12.018 3.892
850 3HD2 LEU 103 3HD2 LEU 103 23.619 -11.676 2.167
851 H VAL 104 H VAL 104 23.365 -7.497 2.932
852 HA VAL 104 HA VAL 104 24.174 -5.370 2.863
853 HB VAL 104 HB VAL 104 21.442 -4.596 1.837
854 1HG1 VAL 104 1HG1 VAL 104 23.899 -3.348 0.797
855 2HG1 VAL 104 2HG1 VAL 104 23.501 -2.975 2.474
856 3HG1 VAL 104 3HG1 VAL 104 22.338 -2.629 1.194
857 1HG2 VAL 104 1HG2 VAL 104 22.909 -4.895 -0.397
858 2HG2 VAL 104 2HG2 VAL 104 21.877 -6.162 0.266
859 3HG2 VAL 104 3HG2 VAL 104 23.609 -6.173 0.598
860 H ARG 105 H ARG 105 24.393 -5.077 5.090
861 HA ARG 105 HA ARG 105 22.445 -3.216 6.248
862 1HB ARG 105 2HB ARG 105 23.431 -5.780 7.464
863 2HB ARG 105 1HB ARG 105 22.901 -4.447 8.479
864 1HG ARG 105 2HG ARG 105 21.256 -5.904 6.423
865 2HG ARG 105 1HG ARG 105 21.098 -6.009 8.178
866 1HD ARG 105 2HD ARG 105 20.820 -3.382 7.925
867 2HD ARG 105 1HD ARG 105 20.277 -3.846 6.314
868 HE ARG 105 HE ARG 105 19.025 -5.336 8.429
869 1HH1 ARG 105 1HH1 ARG 105 18.891 -2.419 6.518
870 2HH1 ARG 105 2HH1 ARG 105 17.194 -2.186 6.766
871 1HH2 ARG 105 1HH2 ARG 105 16.793 -5.032 8.756
872 2HH2 ARG 105 2HH2 ARG 105 16.002 -3.668 8.036
873 H GLN 106 H GLN 106 25.544 -4.824 6.988
874 HA GLN 106 HA GLN 106 26.605 -2.187 7.772
875 1HB GLN 106 2HB GLN 106 27.103 -4.938 8.874
876 2HB GLN 106 1HB GLN 106 28.289 -3.657 9.089
877 1HG GLN 106 2HG GLN 106 25.603 -2.812 9.793
878 2HG GLN 106 1HG GLN 106 26.146 -4.203 10.732
879 1HE2 GLN 106 1HE2 GLN 106 26.091 -2.788 12.563
880 2HE2 GLN 106 2HE2 GLN 106 27.407 -1.711 12.866
881 H GLY 107 H GLY 107 27.354 -5.267 6.197
882 1HA GLY 107 2HA GLY 107 28.957 -4.020 4.214
883 2HA GLY 107 1HA GLY 107 29.979 -4.774 5.430
884 H LEU 108 H LEU 108 30.194 -6.975 5.481
885 HA LEU 108 HA LEU 108 28.643 -8.514 3.511
886 1HB LEU 108 2HB LEU 108 31.402 -7.901 3.372
887 2HB LEU 108 1HB LEU 108 31.282 -9.601 3.782
888 HG LEU 108 HG LEU 108 29.436 -9.200 1.701
889 1HD1 LEU 108 1HD1 LEU 108 32.093 -7.958 1.014
890 2HD1 LEU 108 2HD1 LEU 108 30.601 -7.055 1.274
891 3HD1 LEU 108 3HD1 LEU 108 30.718 -8.199 -0.064
892 1HD2 LEU 108 1HD2 LEU 108 31.264 -11.039 2.383
893 2HD2 LEU 108 2HD2 LEU 108 32.117 -10.258 1.052
894 3HD2 LEU 108 3HD2 LEU 108 30.521 -10.960 0.786
895 H ALA 109 H ALA 109 28.311 -8.245 6.382
896 HA ALA 109 HA ALA 109 28.811 -11.044 7.160
897 1HB ALA 109 1HB ALA 109 28.561 -9.064 9.332
898 2HB ALA 109 2HB ALA 109 30.030 -8.967 8.361
899 3HB ALA 109 3HB ALA 109 29.619 -10.469 9.187
900 H LYS 110 H LYS 110 27.203 -12.072 8.374
901 HA LYS 110 HA LYS 110 25.070 -12.607 8.957
902 1HB LYS 110 2HB LYS 110 25.583 -10.089 10.068
903 2HB LYS 110 1HB LYS 110 23.993 -9.945 9.334
904 1HG LYS 110 2HG LYS 110 24.699 -12.223 11.153
905 2HG LYS 110 1HG LYS 110 24.107 -10.679 11.766
906 1HD LYS 110 2HD LYS 110 21.999 -11.070 11.073
907 2HD LYS 110 1HD LYS 110 22.529 -11.824 9.567
908 1HE LYS 110 2HE LYS 110 22.645 -13.150 12.271
909 2HE LYS 110 1HE LYS 110 21.333 -13.368 11.114
910 1HZ LYS 110 1HZ LYS 110 24.032 -14.439 11.082
911 2HZ LYS 110 2HZ LYS 110 23.433 -13.926 9.585
912 3HZ LYS 110 3HZ LYS 110 22.597 -15.098 10.474
Start of MODEL 10
1 1H ALA 1 1HT ALA 1 0.999 11.388 -21.465
2 2H ALA 1 2HT ALA 1 0.410 12.289 -22.801
3 3H ALA 1 3HT ALA 1 -0.283 10.767 -22.418
4 HA ALA 1 HA ALA 1 -0.548 13.338 -21.069
5 1HB ALA 1 1HB ALA 1 -2.398 13.105 -22.347
6 2HB ALA 1 2HB ALA 1 -2.947 12.153 -20.967
7 3HB ALA 1 3HB ALA 1 -2.285 11.346 -22.389
8 H THR 2 H THR 2 -1.379 9.910 -20.512
9 HA THR 2 HA THR 2 -1.482 10.382 -17.653
10 HB THR 2 HB THR 2 -1.684 7.621 -18.713
11 HG1 THR 2 1HG THR 2 -2.821 8.531 -20.328
12 1HG2 THR 2 1HG2 THR 2 -2.361 8.769 -16.355
13 2HG2 THR 2 2HG2 THR 2 -3.048 7.269 -16.982
14 3HG2 THR 2 3HG2 THR 2 -3.902 8.795 -17.212
15 H SER 3 H SER 3 0.404 10.500 -16.620
16 HA SER 3 HA SER 3 2.544 8.627 -17.371
17 1HB SER 3 2HB SER 3 4.058 10.197 -16.164
18 2HB SER 3 1HB SER 3 3.226 10.951 -17.524
19 HG SER 3 HG SER 3 2.447 11.131 -14.798
20 H THR 4 H THR 4 2.526 6.859 -16.149
21 HA THR 4 HA THR 4 1.428 6.829 -13.499
22 HB THR 4 HB THR 4 2.220 4.448 -13.503
23 HG1 THR 4 1HG THR 4 3.993 4.875 -14.980
24 1HG2 THR 4 1HG2 THR 4 0.079 5.474 -14.809
25 2HG2 THR 4 2HG2 THR 4 0.426 3.753 -14.630
26 3HG2 THR 4 3HG2 THR 4 0.899 4.600 -16.104
27 H LYS 5 H LYS 5 2.451 7.276 -11.668
28 HA LYS 5 HA LYS 5 5.320 7.719 -11.698
29 1HB LYS 5 2HB LYS 5 3.829 9.349 -10.608
30 2HB LYS 5 1HB LYS 5 3.299 8.108 -9.481
31 1HG LYS 5 2HG LYS 5 4.894 8.868 -8.135
32 2HG LYS 5 1HG LYS 5 6.029 8.046 -9.207
33 1HD LYS 5 2HD LYS 5 5.150 10.763 -10.000
34 2HD LYS 5 1HD LYS 5 6.225 10.644 -8.605
35 1HE LYS 5 2HE LYS 5 6.787 9.348 -11.266
36 2HE LYS 5 1HE LYS 5 7.375 10.948 -10.816
37 1HZ LYS 5 1HZ LYS 5 8.776 8.756 -10.412
38 2HZ LYS 5 2HZ LYS 5 7.916 8.769 -8.956
39 3HZ LYS 5 3HZ LYS 5 8.877 10.094 -9.380
40 H LYS 6 H LYS 6 6.571 5.980 -11.467
41 HA LYS 6 HA LYS 6 5.736 3.868 -9.604
42 1HB LYS 6 2HB LYS 6 6.279 3.281 -11.995
43 2HB LYS 6 1HB LYS 6 7.943 3.740 -11.661
44 1HG LYS 6 2HG LYS 6 8.318 1.667 -10.985
45 2HG LYS 6 1HG LYS 6 7.234 1.960 -9.624
46 1HD LYS 6 2HD LYS 6 6.393 0.031 -10.675
47 2HD LYS 6 1HD LYS 6 5.339 1.342 -11.210
48 1HE LYS 6 2HE LYS 6 7.656 0.936 -12.939
49 2HE LYS 6 1HE LYS 6 6.604 -0.475 -12.839
50 1HZ LYS 6 1HZ LYS 6 6.202 1.553 -14.515
51 2HZ LYS 6 2HZ LYS 6 5.260 2.070 -13.209
52 3HZ LYS 6 3HZ LYS 6 4.956 0.570 -13.928
53 H LEU 7 H LEU 7 6.437 4.459 -7.619
54 HA LEU 7 HA LEU 7 9.159 5.477 -7.310
55 1HB LEU 7 2HB LEU 7 6.975 6.403 -6.182
56 2HB LEU 7 1HB LEU 7 7.258 5.111 -5.034
57 HG LEU 7 HG LEU 7 8.158 7.322 -4.325
58 1HD1 LEU 7 1HD1 LEU 7 9.268 4.806 -4.068
59 2HD1 LEU 7 2HD1 LEU 7 9.673 6.233 -3.114
60 3HD1 LEU 7 3HD1 LEU 7 10.631 5.822 -4.536
61 1HD2 LEU 7 1HD2 LEU 7 9.833 8.426 -5.442
62 2HD2 LEU 7 2HD2 LEU 7 8.901 7.779 -6.793
63 3HD2 LEU 7 3HD2 LEU 7 10.384 6.974 -6.278
64 H HIS 8 H HIS 8 10.698 4.490 -6.000
65 HA HIS 8 HA HIS 8 10.159 1.665 -5.367
66 1HB HIS 8 2HB HIS 8 12.466 3.034 -6.618
67 2HB HIS 8 1HB HIS 8 12.860 1.765 -5.464
68 HD1 HIS 8 1HD HIS 8 10.462 -0.137 -6.214
69 HD2 HIS 8 2HD HIS 8 13.087 1.635 -8.904
70 HE1 HIS 8 1HE HIS 8 10.402 -1.589 -8.267
71 HE2 HIS 8 2HE HIS 8 12.053 -0.538 -9.853
72 H LYS 9 H LYS 9 9.834 1.439 -3.260
73 HA LYS 9 HA LYS 9 11.621 2.868 -1.404
74 1HB LYS 9 2HB LYS 9 8.683 2.259 -1.152
75 2HB LYS 9 1HB LYS 9 9.681 2.657 0.240
76 1HG LYS 9 2HG LYS 9 9.807 4.504 -2.061
77 2HG LYS 9 1HG LYS 9 8.308 4.480 -1.130
78 1HD LYS 9 2HD LYS 9 9.418 6.012 0.117
79 2HD LYS 9 1HD LYS 9 10.072 4.565 0.884
80 1HE LYS 9 2HE LYS 9 12.136 4.969 0.126
81 2HE LYS 9 1HE LYS 9 11.555 5.358 -1.493
82 1HZ LYS 9 1HZ LYS 9 10.759 7.510 -0.141
83 2HZ LYS 9 2HZ LYS 9 12.248 7.405 -0.935
84 3HZ LYS 9 3HZ LYS 9 12.158 7.119 0.729
85 H GLU 10 H GLU 10 12.018 1.778 0.644
86 HA GLU 10 HA GLU 10 12.125 -1.135 0.279
87 1HB GLU 10 2HB GLU 10 13.883 0.857 1.604
88 2HB GLU 10 1HB GLU 10 13.769 -0.725 2.363
89 1HG GLU 10 2HG GLU 10 15.623 -0.830 0.933
90 2HG GLU 10 1HG GLU 10 14.334 -1.708 0.109
91 HA PRO 11 HA PRO 11 9.465 -1.822 3.728
92 1HB PRO 11 2HB PRO 11 10.412 -4.072 4.827
93 2HB PRO 11 1HB PRO 11 9.743 -4.060 3.193
94 1HG PRO 11 2HG PRO 11 12.611 -3.993 4.058
95 2HG PRO 11 1HG PRO 11 11.852 -4.960 2.777
96 1HD PRO 11 2HD PRO 11 13.217 -2.639 2.304
97 2HD PRO 11 1HD PRO 11 11.897 -3.226 1.273
98 H ALA 12 H ALA 12 9.173 -1.512 5.923
99 HA ALA 12 HA ALA 12 11.585 -0.798 7.455
100 1HB ALA 12 1HB ALA 12 10.774 1.238 7.800
101 2HB ALA 12 2HB ALA 12 9.289 0.566 8.473
102 3HB ALA 12 3HB ALA 12 9.418 0.856 6.738
103 H THR 13 H THR 13 8.196 -0.986 8.493
104 HA THR 13 HA THR 13 8.111 -3.495 9.613
105 HB THR 13 HB THR 13 8.486 -2.423 12.114
106 HG1 THR 13 1HG THR 13 10.531 -1.399 12.000
107 1HG2 THR 13 1HG2 THR 13 9.508 -4.401 12.088
108 2HG2 THR 13 2HG2 THR 13 10.945 -3.480 11.643
109 3HG2 THR 13 3HG2 THR 13 9.970 -4.251 10.392
110 H LEU 14 H LEU 14 6.069 -3.853 10.248
111 HA LEU 14 HA LEU 14 4.343 -1.520 10.644
112 1HB LEU 14 2HB LEU 14 3.903 -3.467 8.968
113 2HB LEU 14 1HB LEU 14 3.347 -4.334 10.387
114 HG LEU 14 HG LEU 14 1.443 -3.378 9.289
115 1HD1 LEU 14 1HD1 LEU 14 1.827 -1.469 11.538
116 2HD1 LEU 14 2HD1 LEU 14 1.802 -3.201 11.873
117 3HD1 LEU 14 3HD1 LEU 14 0.415 -2.430 11.101
118 1HD2 LEU 14 1HD2 LEU 14 1.316 -1.306 8.397
119 2HD2 LEU 14 2HD2 LEU 14 3.073 -1.453 8.376
120 3HD2 LEU 14 3HD2 LEU 14 2.278 -0.574 9.681
121 H ILE 15 H ILE 15 3.453 -1.044 12.543
122 HA ILE 15 HA ILE 15 4.127 -2.656 14.852
123 HB ILE 15 HB ILE 15 2.832 -0.801 16.081
124 1HG1 ILE 15 2HG1 ILE 15 3.379 1.112 13.964
125 2HG1 ILE 15 1HG1 ILE 15 2.178 -0.070 13.463
126 1HG2 ILE 15 1HG2 ILE 15 4.848 0.829 15.459
127 2HG2 ILE 15 2HG2 ILE 15 5.457 -0.657 14.726
128 3HG2 ILE 15 3HG2 ILE 15 5.061 -0.621 16.444
129 1HD1 ILE 15 1HD1 ILE 15 1.349 2.067 14.556
130 2HD1 ILE 15 2HD1 ILE 15 1.957 1.390 16.067
131 3HD1 ILE 15 3HD1 ILE 15 0.702 0.543 15.164
132 H LYS 16 H LYS 16 1.122 -1.412 13.388
133 HA LYS 16 HA LYS 16 -0.293 -3.818 13.975
134 1HB LYS 16 2HB LYS 16 -0.201 -2.420 16.173
135 2HB LYS 16 1HB LYS 16 -1.400 -1.408 15.379
136 1HG LYS 16 2HG LYS 16 -2.694 -3.594 15.001
137 2HG LYS 16 1HG LYS 16 -1.621 -4.268 16.231
138 1HD LYS 16 2HD LYS 16 -2.506 -2.970 17.907
139 2HD LYS 16 1HD LYS 16 -3.007 -1.691 16.797
140 1HE LYS 16 2HE LYS 16 -4.286 -4.412 16.817
141 2HE LYS 16 1HE LYS 16 -4.851 -3.094 17.842
142 1HZ LYS 16 1HZ LYS 16 -4.737 -3.098 14.875
143 2HZ LYS 16 2HZ LYS 16 -5.170 -1.761 15.816
144 3HZ LYS 16 3HZ LYS 16 -6.131 -3.152 15.831
145 H ALA 17 H ALA 17 -2.360 -3.885 12.982
146 HA ALA 17 HA ALA 17 -2.933 -1.602 11.208
147 1HB ALA 17 1HB ALA 17 -1.947 -3.923 10.293
148 2HB ALA 17 2HB ALA 17 -3.044 -2.900 9.364
149 3HB ALA 17 3HB ALA 17 -3.672 -4.291 10.247
150 H ILE 18 H ILE 18 -5.097 -1.175 10.740
151 HA ILE 18 HA ILE 18 -7.060 -2.621 12.393
152 HB ILE 18 HB ILE 18 -8.260 -0.551 12.790
153 1HG1 ILE 18 2HG1 ILE 18 -6.016 0.809 11.278
154 2HG1 ILE 18 1HG1 ILE 18 -7.663 0.603 10.688
155 1HG2 ILE 18 1HG2 ILE 18 -6.177 0.708 13.914
156 2HG2 ILE 18 2HG2 ILE 18 -5.439 -0.861 13.596
157 3HG2 ILE 18 3HG2 ILE 18 -6.900 -0.756 14.578
158 1HD1 ILE 18 1HD1 ILE 18 -8.477 1.979 12.552
159 2HD1 ILE 18 2HD1 ILE 18 -7.343 2.843 11.514
160 3HD1 ILE 18 3HD1 ILE 18 -6.811 2.221 13.077
161 H ASP 19 H ASP 19 -9.360 -1.370 11.502
162 HA ASP 19 HA ASP 19 -9.782 -2.704 9.025
163 1HB ASP 19 2HB ASP 19 -11.451 -1.037 10.860
164 2HB ASP 19 1HB ASP 19 -12.035 -1.332 9.224
165 H GLY 20 H GLY 20 -7.874 -1.317 8.109
166 1HA GLY 20 2HA GLY 20 -7.138 0.369 6.716
167 2HA GLY 20 1HA GLY 20 -8.701 0.124 5.959
168 H ASP 21 H ASP 21 -7.055 1.927 8.522
169 HA ASP 21 HA ASP 21 -8.669 4.256 7.863
170 1HB ASP 21 2HB ASP 21 -8.955 2.705 10.344
171 2HB ASP 21 1HB ASP 21 -8.709 4.430 10.600
172 H THR 22 H THR 22 -6.144 2.913 9.960
173 HA THR 22 HA THR 22 -4.249 4.878 9.163
174 HB THR 22 HB THR 22 -5.228 6.434 10.592
175 HG1 THR 22 1HG THR 22 -3.633 6.769 11.935
176 1HG2 THR 22 1HG2 THR 22 -5.684 5.632 13.077
177 2HG2 THR 22 2HG2 THR 22 -5.986 4.106 12.247
178 3HG2 THR 22 3HG2 THR 22 -6.910 5.544 11.811
179 H VAL 23 H VAL 23 -2.629 3.469 8.919
180 HA VAL 23 HA VAL 23 -1.946 1.751 11.215
181 HB VAL 23 HB VAL 23 -0.973 0.133 9.637
182 1HG1 VAL 23 1HG1 VAL 23 -3.794 0.583 8.749
183 2HG1 VAL 23 2HG1 VAL 23 -3.436 0.159 10.423
184 3HG1 VAL 23 3HG1 VAL 23 -2.965 -0.929 9.118
185 1HG2 VAL 23 1HG2 VAL 23 -1.303 2.258 7.777
186 2HG2 VAL 23 2HG2 VAL 23 -2.260 0.885 7.222
187 3HG2 VAL 23 3HG2 VAL 23 -0.535 0.690 7.533
188 H LYS 24 H LYS 24 -0.181 2.491 12.174
189 HA LYS 24 HA LYS 24 1.727 4.097 10.696
190 1HB LYS 24 2HB LYS 24 0.941 3.791 13.465
191 2HB LYS 24 1HB LYS 24 2.690 3.729 13.297
192 1HG LYS 24 2HG LYS 24 2.834 5.890 12.547
193 2HG LYS 24 1HG LYS 24 1.188 5.893 11.910
194 1HD LYS 24 2HD LYS 24 1.562 5.599 14.847
195 2HD LYS 24 1HD LYS 24 1.825 7.189 14.128
196 1HE LYS 24 2HE LYS 24 -0.503 6.780 14.958
197 2HE LYS 24 1HE LYS 24 -0.392 7.249 13.261
198 1HZ LYS 24 1HZ LYS 24 -0.605 4.911 12.652
199 2HZ LYS 24 2HZ LYS 24 -1.940 5.433 13.549
200 3HZ LYS 24 3HZ LYS 24 -0.749 4.483 14.284
201 H LEU 25 H LEU 25 3.909 3.643 10.470
202 HA LEU 25 HA LEU 25 4.817 0.951 11.173
203 1HB LEU 25 2HB LEU 25 5.977 1.002 8.840
204 2HB LEU 25 1HB LEU 25 4.307 0.485 8.975
205 HG LEU 25 HG LEU 25 4.731 3.366 8.445
206 1HD1 LEU 25 1HD1 LEU 25 6.262 2.895 6.843
207 2HD1 LEU 25 2HD1 LEU 25 4.806 2.528 5.916
208 3HD1 LEU 25 3HD1 LEU 25 5.727 1.224 6.666
209 1HD2 LEU 25 1HD2 LEU 25 2.647 3.240 7.612
210 2HD2 LEU 25 2HD2 LEU 25 2.580 1.718 8.502
211 3HD2 LEU 25 3HD2 LEU 25 2.959 1.716 6.780
212 H MET 26 H MET 26 6.926 0.860 11.803
213 HA MET 26 HA MET 26 8.243 3.327 12.366
214 1HB MET 26 2HB MET 26 8.317 0.952 13.565
215 2HB MET 26 1HB MET 26 9.717 0.743 12.522
216 1HG MET 26 2HG MET 26 10.657 1.576 14.446
217 2HG MET 26 1HG MET 26 10.467 3.027 13.464
218 1HE MET 26 1HE MET 26 10.116 4.676 16.561
219 2HE MET 26 2HE MET 26 11.223 3.462 15.917
220 3HE MET 26 3HE MET 26 10.230 3.092 17.327
221 H TYR 27 H TYR 27 8.896 4.433 10.598
222 HA TYR 27 HA TYR 27 10.765 3.061 8.778
223 1HB TYR 27 2HB TYR 27 8.758 3.677 7.572
224 2HB TYR 27 1HB TYR 27 8.840 5.323 8.192
225 HD1 TYR 27 1HD TYR 27 10.303 2.921 5.828
226 HD2 TYR 27 2HD TYR 27 10.363 6.932 7.241
227 HE1 TYR 27 1HE TYR 27 11.632 3.584 3.868
228 HE2 TYR 27 2HE TYR 27 11.691 7.608 5.285
229 HH TYR 27 HH TYR 27 13.134 5.331 3.167
230 H LYS 28 H LYS 28 12.787 3.684 9.095
231 HA LYS 28 HA LYS 28 14.620 4.939 9.585
232 1HB LYS 28 2HB LYS 28 12.739 6.902 8.361
233 2HB LYS 28 1HB LYS 28 14.186 7.524 9.143
234 1HG LYS 28 2HG LYS 28 14.105 5.519 6.899
235 2HG LYS 28 1HG LYS 28 14.551 7.222 6.768
236 1HD LYS 28 2HD LYS 28 16.354 6.683 8.511
237 2HD LYS 28 1HD LYS 28 16.030 4.990 8.130
238 1HE LYS 28 2HE LYS 28 16.978 7.143 6.246
239 2HE LYS 28 1HE LYS 28 17.878 5.729 6.793
240 1HZ LYS 28 1HZ LYS 28 17.148 5.018 4.767
241 2HZ LYS 28 2HZ LYS 28 15.711 5.908 4.826
242 3HZ LYS 28 3HZ LYS 28 15.860 4.483 5.725
243 H GLY 29 H GLY 29 12.587 4.413 11.661
244 1HA GLY 29 2HA GLY 29 12.506 4.841 13.930
245 2HA GLY 29 1HA GLY 29 13.701 6.106 13.693
246 H GLN 30 H GLN 30 10.771 6.111 11.826
247 HA GLN 30 HA GLN 30 9.536 8.067 13.614
248 1HB GLN 30 2HB GLN 30 11.034 9.004 11.593
249 2HB GLN 30 1HB GLN 30 9.520 8.768 10.731
250 1HG GLN 30 2HG GLN 30 9.255 10.134 13.308
251 2HG GLN 30 1HG GLN 30 10.198 11.007 12.100
252 1HE2 GLN 30 1HE2 GLN 30 8.785 12.583 11.591
253 2HE2 GLN 30 2HE2 GLN 30 7.229 12.312 10.892
254 HA PRO 31 HA PRO 31 6.167 5.295 12.448
255 1HB PRO 31 2HB PRO 31 4.612 7.248 14.046
256 2HB PRO 31 1HB PRO 31 4.720 5.493 14.208
257 1HG PRO 31 2HG PRO 31 5.922 7.108 15.958
258 2HG PRO 31 1HG PRO 31 6.683 5.594 15.434
259 1HD PRO 31 2HD PRO 31 7.266 8.404 14.584
260 2HD PRO 31 1HD PRO 31 8.390 7.066 14.902
261 H MET 32 H MET 32 4.676 5.376 10.849
262 HA MET 32 HA MET 32 3.660 7.969 9.958
263 1HB MET 32 2HB MET 32 5.525 6.228 8.479
264 2HB MET 32 1HB MET 32 4.143 6.792 7.552
265 1HG MET 32 2HG MET 32 5.636 8.793 9.146
266 2HG MET 32 1HG MET 32 6.411 8.148 7.700
267 1HE MET 32 1HE MET 32 5.828 11.337 6.571
268 2HE MET 32 2HE MET 32 6.085 10.860 8.248
269 3HE MET 32 3HE MET 32 4.630 11.747 7.799
270 H THR 33 H THR 33 1.530 7.722 10.095
271 HA THR 33 HA THR 33 0.253 5.165 9.803
272 HB THR 33 HB THR 33 -0.738 6.577 11.409
273 HG1 THR 33 1HG THR 33 -2.474 5.751 10.510
274 1HG2 THR 33 1HG2 THR 33 -0.685 8.718 9.313
275 2HG2 THR 33 2HG2 THR 33 0.018 8.738 10.930
276 3HG2 THR 33 3HG2 THR 33 -1.733 8.807 10.728
277 H PHE 34 H PHE 34 -0.986 4.410 8.146
278 HA PHE 34 HA PHE 34 -1.423 6.119 5.812
279 1HB PHE 34 2HB PHE 34 -0.091 3.405 5.700
280 2HB PHE 34 1HB PHE 34 -0.626 4.322 4.298
281 HD1 PHE 34 1HD PHE 34 2.208 3.325 5.604
282 HD2 PHE 34 2HD PHE 34 0.230 7.027 4.914
283 HE1 PHE 34 1HE PHE 34 4.385 4.468 5.526
284 HE2 PHE 34 2HE PHE 34 2.404 8.179 4.834
285 HZ PHE 34 HZ PHE 34 4.485 6.898 5.140
286 H ARG 35 H ARG 35 -3.298 5.710 4.733
287 HA ARG 35 HA ARG 35 -5.028 3.627 5.856
288 1HB ARG 35 2HB ARG 35 -5.730 6.081 5.791
289 2HB ARG 35 1HB ARG 35 -5.878 5.886 4.049
290 1HG ARG 35 2HG ARG 35 -7.459 3.972 4.533
291 2HG ARG 35 1HG ARG 35 -7.457 4.523 6.208
292 1HD ARG 35 2HD ARG 35 -7.952 6.581 4.148
293 2HD ARG 35 1HD ARG 35 -9.219 5.375 4.370
294 HE ARG 35 HE ARG 35 -8.603 6.219 6.898
295 1HH1 ARG 35 1HH1 ARG 35 -9.657 7.773 3.957
296 2HH1 ARG 35 2HH1 ARG 35 -10.502 9.041 4.782
297 1HH2 ARG 35 1HH2 ARG 35 -9.712 7.884 7.986
298 2HH2 ARG 35 2HH2 ARG 35 -10.532 9.105 7.069
299 H LEU 36 H LEU 36 -6.168 2.193 4.519
300 HA LEU 36 HA LEU 36 -4.790 1.137 2.347
301 1HB LEU 36 2HB LEU 36 -7.019 -0.017 1.841
302 2HB LEU 36 1HB LEU 36 -6.260 -0.329 3.389
303 HG LEU 36 HG LEU 36 -7.815 1.114 4.522
304 1HD1 LEU 36 1HD1 LEU 36 -8.775 1.813 1.757
305 2HD1 LEU 36 2HD1 LEU 36 -8.111 2.894 2.984
306 3HD1 LEU 36 3HD1 LEU 36 -9.696 2.156 3.223
307 1HD2 LEU 36 1HD2 LEU 36 -9.344 -0.598 2.570
308 2HD2 LEU 36 2HD2 LEU 36 -9.854 -0.105 4.185
309 3HD2 LEU 36 3HD2 LEU 36 -8.498 -1.213 3.990
310 H LEU 37 H LEU 37 -5.793 0.803 0.126
311 HA LEU 37 HA LEU 37 -6.439 3.439 -0.954
312 1HB LEU 37 2HB LEU 37 -6.016 2.265 -3.180
313 2HB LEU 37 1HB LEU 37 -4.641 2.545 -2.135
314 HG LEU 37 HG LEU 37 -4.806 0.288 -3.331
315 1HD1 LEU 37 1HD1 LEU 37 -3.274 -0.360 -1.870
316 2HD1 LEU 37 2HD1 LEU 37 -4.467 -0.502 -0.581
317 3HD1 LEU 37 3HD1 LEU 37 -3.696 1.052 -0.902
318 1HD2 LEU 37 1HD2 LEU 37 -6.168 -1.408 -2.410
319 2HD2 LEU 37 2HD2 LEU 37 -7.225 -0.028 -2.705
320 3HD2 LEU 37 3HD2 LEU 37 -6.671 -0.380 -1.069
321 H LEU 38 H LEU 38 -8.010 3.551 -2.764
322 HA LEU 38 HA LEU 38 -10.355 1.903 -2.125
323 1HB LEU 38 2HB LEU 38 -11.620 3.703 -3.334
324 2HB LEU 38 1HB LEU 38 -10.838 4.206 -1.848
325 HG LEU 38 HG LEU 38 -9.279 4.616 -4.328
326 1HD1 LEU 38 1HD1 LEU 38 -10.539 6.252 -5.275
327 2HD1 LEU 38 2HD1 LEU 38 -11.323 6.685 -3.755
328 3HD1 LEU 38 3HD1 LEU 38 -11.840 5.247 -4.635
329 1HD2 LEU 38 1HD2 LEU 38 -9.662 5.878 -1.673
330 2HD2 LEU 38 2HD2 LEU 38 -9.172 6.920 -3.009
331 3HD2 LEU 38 3HD2 LEU 38 -8.178 5.532 -2.561
332 H VAL 39 H VAL 39 -10.117 0.112 -3.388
333 HA VAL 39 HA VAL 39 -9.779 0.532 -6.280
334 HB VAL 39 HB VAL 39 -8.089 -0.925 -5.231
335 1HG1 VAL 39 1HG1 VAL 39 -10.123 -1.867 -3.688
336 2HG1 VAL 39 2HG1 VAL 39 -8.552 -2.649 -3.871
337 3HG1 VAL 39 3HG1 VAL 39 -9.922 -3.180 -4.848
338 1HG2 VAL 39 1HG2 VAL 39 -8.160 -1.579 -7.386
339 2HG2 VAL 39 2HG2 VAL 39 -9.911 -1.795 -7.375
340 3HG2 VAL 39 3HG2 VAL 39 -8.864 -3.048 -6.709
341 H ASP 40 H ASP 40 -11.517 0.318 -7.510
342 HA ASP 40 HA ASP 40 -13.703 -1.423 -6.575
343 1HB ASP 40 2HB ASP 40 -14.092 1.135 -6.549
344 2HB ASP 40 1HB ASP 40 -14.163 0.996 -8.303
345 H THR 41 H THR 41 -14.752 -2.681 -8.100
346 HA THR 41 HA THR 41 -13.308 -2.983 -10.634
347 HB THR 41 HB THR 41 -13.335 -5.022 -9.426
348 HG1 THR 41 1HG THR 41 -14.641 -6.345 -10.772
349 1HG2 THR 41 1HG2 THR 41 -16.290 -4.619 -9.048
350 2HG2 THR 41 2HG2 THR 41 -15.045 -4.638 -7.798
351 3HG2 THR 41 3HG2 THR 41 -15.426 -6.114 -8.687
352 HA PRO 42 HA PRO 42 -16.914 -1.040 -12.503
353 1HB PRO 42 2HB PRO 42 -16.017 -1.180 -15.070
354 2HB PRO 42 1HB PRO 42 -15.483 0.054 -13.925
355 1HG PRO 42 2HG PRO 42 -14.130 -2.490 -14.736
356 2HG PRO 42 1HG PRO 42 -13.432 -0.876 -14.505
357 1HD PRO 42 2HD PRO 42 -13.223 -2.813 -12.637
358 2HD PRO 42 1HD PRO 42 -13.360 -1.095 -12.207
359 H GLU 43 H GLU 43 -18.569 -1.664 -14.029
360 HA GLU 43 HA GLU 43 -19.123 -4.465 -13.937
361 1HB GLU 43 2HB GLU 43 -20.936 -2.877 -13.724
362 2HB GLU 43 1HB GLU 43 -20.565 -2.181 -15.294
363 1HG GLU 43 2HG GLU 43 -22.014 -3.575 -16.207
364 2HG GLU 43 1HG GLU 43 -20.970 -4.918 -15.741
365 H THR 44 H THR 44 -19.506 -2.514 -16.872
366 HA THR 44 HA THR 44 -18.076 -4.624 -18.344
367 HB THR 44 HB THR 44 -19.771 -2.793 -19.900
368 HG1 THR 44 1HG THR 44 -21.697 -3.625 -19.161
369 1HG2 THR 44 1HG2 THR 44 -18.980 -5.592 -19.930
370 2HG2 THR 44 2HG2 THR 44 -19.436 -4.522 -21.256
371 3HG2 THR 44 3HG2 THR 44 -20.683 -5.335 -20.311
372 H LYS 45 H LYS 45 -16.020 -3.904 -18.503
373 HA LYS 45 HA LYS 45 -15.366 -1.909 -20.353
374 1HB LYS 45 2HB LYS 45 -15.655 -1.013 -17.562
375 2HB LYS 45 1HB LYS 45 -14.138 -0.553 -18.323
376 1HG LYS 45 2HG LYS 45 -15.900 0.113 -20.267
377 2HG LYS 45 1HG LYS 45 -16.868 0.399 -18.819
378 1HD LYS 45 2HD LYS 45 -14.580 1.568 -18.056
379 2HD LYS 45 1HD LYS 45 -14.452 1.796 -19.801
380 1HE LYS 45 2HE LYS 45 -16.268 3.183 -19.894
381 2HE LYS 45 1HE LYS 45 -17.040 2.442 -18.493
382 1HZ LYS 45 1HZ LYS 45 -15.544 3.577 -17.044
383 2HZ LYS 45 2HZ LYS 45 -16.204 4.723 -18.099
384 3HZ LYS 45 3HZ LYS 45 -14.626 4.162 -18.339
385 H HIS 46 H HIS 46 -13.751 -2.479 -17.245
386 HA HIS 46 HA HIS 46 -11.570 -3.792 -18.728
387 1HB HIS 46 2HB HIS 46 -11.589 -1.907 -16.411
388 2HB HIS 46 1HB HIS 46 -10.294 -3.094 -16.517
389 HD1 HIS 46 1HD HIS 46 -8.293 -2.094 -17.543
390 HD2 HIS 46 2HD HIS 46 -11.786 -0.578 -19.205
391 HE1 HIS 46 1HE HIS 46 -7.546 -0.462 -19.304
392 HE2 HIS 46 2HE HIS 46 -9.676 0.377 -20.355
393 HA PRO 47 HA PRO 47 -11.819 -7.596 -16.543
394 1HB PRO 47 2HB PRO 47 -9.115 -7.088 -15.393
395 2HB PRO 47 1HB PRO 47 -9.713 -8.488 -16.293
396 1HG PRO 47 2HG PRO 47 -8.109 -6.713 -17.457
397 2HG PRO 47 1HG PRO 47 -9.458 -7.442 -18.348
398 1HD PRO 47 2HD PRO 47 -9.219 -4.709 -17.168
399 2HD PRO 47 1HD PRO 47 -10.017 -5.227 -18.668
400 H LYS 48 H LYS 48 -12.359 -8.431 -14.544
401 HA LYS 48 HA LYS 48 -12.880 -6.507 -12.472
402 1HB LYS 48 2HB LYS 48 -13.987 -8.350 -11.318
403 2HB LYS 48 1HB LYS 48 -14.500 -8.276 -12.999
404 1HG LYS 48 2HG LYS 48 -13.329 -10.195 -13.575
405 2HG LYS 48 1HG LYS 48 -12.276 -10.093 -12.162
406 1HD LYS 48 2HD LYS 48 -13.638 -11.662 -11.304
407 2HD LYS 48 1HD LYS 48 -14.726 -10.307 -10.994
408 1HE LYS 48 2HE LYS 48 -15.998 -12.000 -12.079
409 2HE LYS 48 1HE LYS 48 -15.728 -10.714 -13.255
410 1HZ LYS 48 1HZ LYS 48 -13.850 -12.049 -14.126
411 2HZ LYS 48 2HZ LYS 48 -15.352 -12.802 -14.311
412 3HZ LYS 48 3HZ LYS 48 -14.299 -13.309 -13.090
413 H LYS 49 H LYS 49 -11.973 -6.380 -10.452
414 HA LYS 49 HA LYS 49 -10.114 -8.273 -9.434
415 1HB LYS 49 2HB LYS 49 -8.117 -6.768 -9.482
416 2HB LYS 49 1HB LYS 49 -8.595 -7.377 -11.060
417 1HG LYS 49 2HG LYS 49 -9.703 -5.247 -11.540
418 2HG LYS 49 1HG LYS 49 -9.199 -4.637 -9.963
419 1HD LYS 49 2HD LYS 49 -6.832 -5.499 -10.978
420 2HD LYS 49 1HD LYS 49 -7.660 -4.974 -12.445
421 1HE LYS 49 2HE LYS 49 -6.603 -3.036 -11.761
422 2HE LYS 49 1HE LYS 49 -8.214 -2.847 -11.067
423 1HZ LYS 49 1HZ LYS 49 -6.250 -4.183 -9.392
424 2HZ LYS 49 2HZ LYS 49 -7.432 -3.046 -8.980
425 3HZ LYS 49 3HZ LYS 49 -5.977 -2.538 -9.675
426 H GLY 50 H GLY 50 -11.150 -4.884 -9.398
427 1HA GLY 50 2HA GLY 50 -10.435 -4.298 -6.749
428 2HA GLY 50 1HA GLY 50 -11.694 -3.481 -7.665
429 H VAL 51 H VAL 51 -12.073 -3.745 -5.019
430 HA VAL 51 HA VAL 51 -13.842 -6.060 -4.665
431 HB VAL 51 HB VAL 51 -12.130 -5.745 -2.931
432 1HG1 VAL 51 1HG1 VAL 51 -11.924 -3.312 -3.073
433 2HG1 VAL 51 2HG1 VAL 51 -12.217 -3.839 -1.416
434 3HG1 VAL 51 3HG1 VAL 51 -13.528 -3.134 -2.361
435 1HG2 VAL 51 1HG2 VAL 51 -14.854 -5.131 -1.800
436 2HG2 VAL 51 2HG2 VAL 51 -13.545 -6.035 -1.038
437 3HG2 VAL 51 3HG2 VAL 51 -14.392 -6.713 -2.429
438 H GLU 52 H GLU 52 -15.915 -5.717 -3.584
439 HA GLU 52 HA GLU 52 -17.208 -3.304 -4.591
440 1HB GLU 52 2HB GLU 52 -18.504 -5.701 -3.291
441 2HB GLU 52 1HB GLU 52 -19.290 -4.455 -4.254
442 1HG GLU 52 2HG GLU 52 -19.102 -5.888 -5.941
443 2HG GLU 52 1HG GLU 52 -17.404 -5.414 -5.981
444 H LYS 53 H LYS 53 -18.507 -1.956 -3.293
445 HA LYS 53 HA LYS 53 -17.451 -1.295 -0.793
446 1HB LYS 53 2HB LYS 53 -19.154 -0.088 -2.538
447 2HB LYS 53 1HB LYS 53 -20.265 -0.533 -1.249
448 1HG LYS 53 2HG LYS 53 -19.333 0.908 0.245
449 2HG LYS 53 1HG LYS 53 -17.728 0.797 -0.482
450 1HD LYS 53 2HD LYS 53 -18.189 2.829 -1.317
451 2HD LYS 53 1HD LYS 53 -19.166 1.948 -2.492
452 1HE LYS 53 2HE LYS 53 -20.911 3.135 -1.779
453 2HE LYS 53 1HE LYS 53 -20.820 2.221 -0.274
454 1HZ LYS 53 1HZ LYS 53 -19.868 3.940 0.819
455 2HZ LYS 53 2HZ LYS 53 -20.694 4.849 -0.346
456 3HZ LYS 53 3HZ LYS 53 -19.046 4.520 -0.541
457 H TYR 54 H TYR 54 -17.382 -3.091 0.552
458 HA TYR 54 HA TYR 54 -19.992 -4.110 1.468
459 1HB TYR 54 2HB TYR 54 -17.326 -5.400 1.125
460 2HB TYR 54 1HB TYR 54 -18.347 -5.958 2.448
461 HD1 TYR 54 1HD TYR 54 -17.390 -6.908 -0.615
462 HD2 TYR 54 2HD TYR 54 -21.007 -5.991 1.428
463 HE1 TYR 54 1HE TYR 54 -18.633 -8.334 -2.186
464 HE2 TYR 54 2HE TYR 54 -22.260 -7.416 -0.136
465 HH TYR 54 HH TYR 54 -21.970 -8.271 -2.483
466 H GLY 55 H GLY 55 -16.893 -2.792 2.459
467 1HA GLY 55 2HA GLY 55 -17.319 -1.286 4.501
468 2HA GLY 55 1HA GLY 55 -17.804 -2.795 5.260
469 HA PRO 56 HA PRO 56 -13.366 -2.334 6.311
470 1HB PRO 56 2HB PRO 56 -13.531 -3.702 8.653
471 2HB PRO 56 1HB PRO 56 -13.926 -1.984 8.509
472 1HG PRO 56 2HG PRO 56 -15.757 -4.352 8.553
473 2HG PRO 56 1HG PRO 56 -15.926 -2.792 9.380
474 1HD PRO 56 2HD PRO 56 -17.251 -3.373 7.094
475 2HD PRO 56 1HD PRO 56 -16.704 -1.730 7.486
476 H GLU 57 H GLU 57 -15.395 -4.986 5.633
477 HA GLU 57 HA GLU 57 -13.816 -7.196 6.188
478 1HB GLU 57 2HB GLU 57 -16.227 -6.940 5.134
479 2HB GLU 57 1HB GLU 57 -15.344 -7.110 3.623
480 1HG GLU 57 2HG GLU 57 -14.518 -9.116 5.512
481 2HG GLU 57 1HG GLU 57 -16.267 -9.142 5.295
482 H ALA 58 H ALA 58 -13.514 -4.820 3.657
483 HA ALA 58 HA ALA 58 -11.758 -6.304 1.983
484 1HB ALA 58 1HB ALA 58 -12.626 -4.604 0.767
485 2HB ALA 58 2HB ALA 58 -11.168 -3.779 1.318
486 3HB ALA 58 3HB ALA 58 -12.701 -3.508 2.146
487 H SER 59 H SER 59 -11.316 -4.262 4.783
488 HA SER 59 HA SER 59 -8.506 -3.899 4.480
489 1HB SER 59 2HB SER 59 -9.672 -2.319 5.839
490 2HB SER 59 1HB SER 59 -10.364 -3.593 6.842
491 HG SER 59 HG SER 59 -7.633 -2.840 6.685
492 H ALA 60 H ALA 60 -10.491 -6.441 5.725
493 HA ALA 60 HA ALA 60 -8.792 -7.687 7.533
494 1HB ALA 60 1HB ALA 60 -10.427 -9.347 5.671
495 2HB ALA 60 2HB ALA 60 -11.236 -8.233 6.774
496 3HB ALA 60 3HB ALA 60 -10.191 -9.504 7.412
497 H PHE 61 H PHE 61 -8.536 -7.446 4.094
498 HA PHE 61 HA PHE 61 -7.069 -9.692 3.423
499 1HB PHE 61 2HB PHE 61 -7.917 -7.591 2.024
500 2HB PHE 61 1HB PHE 61 -6.243 -7.088 2.234
501 HD1 PHE 61 1HD PHE 61 -8.166 -10.139 1.274
502 HD2 PHE 61 2HD PHE 61 -4.754 -7.686 0.603
503 HE1 PHE 61 1HE PHE 61 -7.503 -11.584 -0.605
504 HE2 PHE 61 2HE PHE 61 -4.085 -9.125 -1.278
505 HZ PHE 61 HZ PHE 61 -5.460 -11.076 -1.884
506 H THR 62 H THR 62 -5.814 -6.540 4.511
507 HA THR 62 HA THR 62 -3.104 -7.259 4.523
508 HB THR 62 HB THR 62 -3.045 -5.367 6.357
509 HG1 THR 62 1HG THR 62 -4.913 -4.586 6.834
510 1HG2 THR 62 1HG2 THR 62 -3.111 -5.316 3.521
511 2HG2 THR 62 2HG2 THR 62 -2.333 -4.190 4.634
512 3HG2 THR 62 3HG2 THR 62 -4.002 -3.920 4.131
513 H LYS 63 H LYS 63 -5.505 -7.284 7.145
514 HA LYS 63 HA LYS 63 -3.853 -8.124 9.213
515 1HB LYS 63 2HB LYS 63 -6.779 -8.673 8.713
516 2HB LYS 63 1HB LYS 63 -5.960 -9.070 10.217
517 1HG LYS 63 2HG LYS 63 -5.365 -6.373 9.650
518 2HG LYS 63 1HG LYS 63 -7.095 -6.590 9.381
519 1HD LYS 63 2HD LYS 63 -6.347 -7.963 11.775
520 2HD LYS 63 1HD LYS 63 -5.724 -6.314 11.841
521 1HE LYS 63 2HE LYS 63 -7.833 -5.373 11.721
522 2HE LYS 63 1HE LYS 63 -8.540 -6.806 10.976
523 1HZ LYS 63 1HZ LYS 63 -7.795 -7.794 13.326
524 2HZ LYS 63 2HZ LYS 63 -9.320 -7.121 13.047
525 3HZ LYS 63 3HZ LYS 63 -8.112 -6.196 13.782
526 H LYS 64 H LYS 64 -4.934 -9.884 6.465
527 HA LYS 64 HA LYS 64 -4.559 -12.483 7.676
528 1HB LYS 64 2HB LYS 64 -6.088 -11.619 5.600
529 2HB LYS 64 1HB LYS 64 -4.713 -12.294 4.738
530 1HG LYS 64 2HG LYS 64 -5.943 -14.176 4.872
531 2HG LYS 64 1HG LYS 64 -5.162 -14.295 6.450
532 1HD LYS 64 2HD LYS 64 -7.069 -13.417 7.558
533 2HD LYS 64 1HD LYS 64 -7.811 -12.928 6.033
534 1HE LYS 64 2HE LYS 64 -8.686 -14.957 5.689
535 2HE LYS 64 1HE LYS 64 -7.186 -15.770 6.133
536 1HZ LYS 64 1HZ LYS 64 -8.804 -16.415 7.701
537 2HZ LYS 64 2HZ LYS 64 -9.336 -14.828 7.939
538 3HZ LYS 64 3HZ LYS 64 -7.813 -15.300 8.500
539 H MET 65 H MET 65 -3.053 -10.807 4.902
540 HA MET 65 HA MET 65 -0.742 -12.560 5.107
541 1HB MET 65 2HB MET 65 -1.500 -10.419 3.119
542 2HB MET 65 1HB MET 65 0.006 -11.324 3.045
543 1HG MET 65 2HG MET 65 -1.010 -13.236 2.358
544 2HG MET 65 1HG MET 65 -2.518 -12.866 3.192
545 1HE MET 65 1HE MET 65 -4.081 -13.484 1.627
546 2HE MET 65 2HE MET 65 -3.149 -13.992 0.220
547 3HE MET 65 3HE MET 65 -4.407 -12.770 0.048
548 H TRP 66 H TRP 66 -1.390 -9.059 5.167
549 HA TRP 66 HA TRP 66 1.192 -8.172 5.642
550 1HB TRP 66 2HB TRP 66 -1.036 -6.865 5.229
551 2HB TRP 66 1HB TRP 66 -1.137 -6.844 6.985
552 HD1 TRP 66 HD TRP 66 0.760 -5.435 8.304
553 HE1 TRP 66 1HE TRP 66 2.220 -3.454 7.546
554 HE3 TRP 66 3HE TRP 66 0.180 -5.883 3.243
555 HZ2 TRP 66 2HZ TRP 66 3.019 -2.243 5.131
556 HZ3 TRP 66 3HZ TRP 66 1.327 -4.271 1.779
557 HH2 TRP 66 HH TRP 66 2.717 -2.488 2.707
558 H GLU 67 H GLU 67 -1.166 -9.488 7.892
559 HA GLU 67 HA GLU 67 0.587 -8.938 10.155
560 1HB GLU 67 2HB GLU 67 -2.246 -9.323 9.793
561 2HB GLU 67 1HB GLU 67 -1.638 -10.403 11.039
562 1HG GLU 67 2HG GLU 67 -0.434 -8.015 11.657
563 2HG GLU 67 1HG GLU 67 -2.027 -7.523 11.086
564 H ASN 68 H ASN 68 -1.035 -11.790 8.731
565 HA ASN 68 HA ASN 68 0.466 -13.589 10.393
566 1HB ASN 68 2HB ASN 68 -1.933 -13.778 9.145
567 2HB ASN 68 1HB ASN 68 -0.917 -14.689 8.030
568 1HD2 ASN 68 1HD2 ASN 68 -1.780 -14.397 11.442
569 2HD2 ASN 68 2HD2 ASN 68 -1.580 -16.072 11.818
570 H ALA 69 H ALA 69 0.817 -12.334 7.154
571 HA ALA 69 HA ALA 69 3.034 -14.213 6.693
572 1HB ALA 69 1HB ALA 69 2.831 -13.354 4.290
573 2HB ALA 69 2HB ALA 69 1.285 -12.678 4.801
574 3HB ALA 69 3HB ALA 69 1.562 -14.416 4.896
575 H LYS 70 H LYS 70 5.041 -13.445 5.920
576 HA LYS 70 HA LYS 70 5.705 -10.809 6.947
577 1HB LYS 70 2HB LYS 70 7.021 -13.071 7.242
578 2HB LYS 70 1HB LYS 70 7.723 -12.621 5.694
579 1HG LYS 70 2HG LYS 70 8.656 -10.643 6.584
580 2HG LYS 70 1HG LYS 70 7.711 -10.780 8.067
581 1HD LYS 70 2HD LYS 70 9.136 -12.269 8.989
582 2HD LYS 70 1HD LYS 70 9.436 -13.086 7.453
583 1HE LYS 70 2HE LYS 70 10.578 -10.566 7.152
584 2HE LYS 70 1HE LYS 70 10.984 -11.044 8.798
585 1HZ LYS 70 1HZ LYS 70 12.698 -11.958 7.607
586 2HZ LYS 70 2HZ LYS 70 11.741 -12.312 6.258
587 3HZ LYS 70 3HZ LYS 70 11.624 -13.266 7.650
588 H LYS 71 H LYS 71 4.922 -9.355 5.453
589 HA LYS 71 HA LYS 71 6.599 -8.837 3.209
590 1HB LYS 71 2HB LYS 71 4.829 -8.964 1.482
591 2HB LYS 71 1HB LYS 71 5.257 -10.531 2.126
592 1HG LYS 71 2HG LYS 71 3.063 -9.290 3.567
593 2HG LYS 71 1HG LYS 71 2.719 -9.502 1.852
594 1HD LYS 71 2HD LYS 71 3.952 -11.789 3.272
595 2HD LYS 71 1HD LYS 71 2.274 -11.409 3.659
596 1HE LYS 71 2HE LYS 71 1.913 -11.365 1.116
597 2HE LYS 71 1HE LYS 71 3.465 -12.194 1.020
598 1HZ LYS 71 1HZ LYS 71 2.615 -14.007 2.259
599 2HZ LYS 71 2HZ LYS 71 1.472 -13.672 1.059
600 3HZ LYS 71 3HZ LYS 71 1.193 -13.178 2.654
601 H ILE 72 H ILE 72 6.855 -6.776 3.968
602 HA ILE 72 HA ILE 72 4.492 -5.058 3.769
603 HB ILE 72 HB ILE 72 5.269 -3.805 5.807
604 1HG1 ILE 72 2HG1 ILE 72 6.638 -6.306 6.697
605 2HG1 ILE 72 1HG1 ILE 72 7.535 -5.191 5.670
606 1HG2 ILE 72 1HG2 ILE 72 3.469 -5.733 5.547
607 2HG2 ILE 72 2HG2 ILE 72 3.834 -5.000 7.112
608 3HG2 ILE 72 3HG2 ILE 72 4.551 -6.550 6.674
609 1HD1 ILE 72 1HD1 ILE 72 7.523 -3.516 7.262
610 2HD1 ILE 72 2HD1 ILE 72 7.730 -4.980 8.225
611 3HD1 ILE 72 3HD1 ILE 72 6.148 -4.207 8.124
612 H GLU 73 H GLU 73 4.849 -3.276 2.651
613 HA GLU 73 HA GLU 73 7.337 -1.861 2.714
614 1HB GLU 73 2HB GLU 73 6.992 -3.876 0.714
615 2HB GLU 73 1HB GLU 73 6.988 -2.301 -0.070
616 1HG GLU 73 2HG GLU 73 9.157 -1.913 0.385
617 2HG GLU 73 1HG GLU 73 9.090 -2.736 1.941
618 H VAL 74 H VAL 74 7.288 -0.010 1.055
619 HA VAL 74 HA VAL 74 4.531 1.019 0.921
620 HB VAL 74 HB VAL 74 5.825 3.286 0.693
621 1HG1 VAL 74 1HG1 VAL 74 4.909 3.636 2.686
622 2HG1 VAL 74 2HG1 VAL 74 6.107 2.605 3.469
623 3HG1 VAL 74 3HG1 VAL 74 4.628 1.900 2.814
624 1HG2 VAL 74 1HG2 VAL 74 7.983 3.414 1.365
625 2HG2 VAL 74 2HG2 VAL 74 8.015 1.751 0.781
626 3HG2 VAL 74 3HG2 VAL 74 7.825 2.076 2.503
627 H GLU 75 H GLU 75 3.920 2.268 -0.928
628 HA GLU 75 HA GLU 75 5.264 1.351 -3.348
629 1HB GLU 75 2HB GLU 75 2.841 1.032 -3.177
630 2HB GLU 75 1HB GLU 75 2.616 2.766 -2.999
631 1HG GLU 75 2HG GLU 75 3.035 3.187 -5.206
632 2HG GLU 75 1HG GLU 75 4.044 1.757 -5.403
633 H PHE 76 H PHE 76 3.543 4.419 -2.839
634 HA PHE 76 HA PHE 76 5.979 5.834 -3.686
635 1HB PHE 76 2HB PHE 76 4.733 7.241 -5.170
636 2HB PHE 76 1HB PHE 76 4.318 5.575 -5.558
637 HD1 PHE 76 1HD PHE 76 2.195 4.662 -4.258
638 HD2 PHE 76 2HD PHE 76 3.032 8.767 -5.000
639 HE1 PHE 76 1HE PHE 76 -0.191 5.193 -3.985
640 HE2 PHE 76 2HE PHE 76 0.647 9.306 -4.728
641 HZ PHE 76 HZ PHE 76 -0.968 7.518 -4.219
642 H ASP 77 H ASP 77 6.382 7.786 -2.737
643 HA ASP 77 HA ASP 77 4.634 8.488 -0.482
644 1HB ASP 77 2HB ASP 77 7.245 7.970 -0.354
645 2HB ASP 77 1HB ASP 77 7.352 9.678 -0.772
646 H LYS 78 H LYS 78 3.234 10.048 -0.970
647 HA LYS 78 HA LYS 78 3.435 11.831 -3.110
648 1HB LYS 78 2HB LYS 78 1.400 11.171 -1.616
649 2HB LYS 78 1HB LYS 78 1.905 12.535 -0.627
650 1HG LYS 78 2HG LYS 78 0.872 13.936 -1.990
651 2HG LYS 78 1HG LYS 78 1.844 13.367 -3.348
652 1HD LYS 78 2HD LYS 78 0.191 11.398 -3.436
653 2HD LYS 78 1HD LYS 78 -0.843 12.406 -2.421
654 1HE LYS 78 2HE LYS 78 -1.104 14.019 -4.075
655 2HE LYS 78 1HE LYS 78 0.331 13.491 -4.953
656 1HZ LYS 78 1HZ LYS 78 -1.011 11.335 -5.285
657 2HZ LYS 78 2HZ LYS 78 -1.390 12.684 -6.234
658 3HZ LYS 78 3HZ LYS 78 -2.357 12.286 -4.904
659 H GLY 79 H GLY 79 4.507 12.108 0.226
660 1HA GLY 79 2HA GLY 79 6.434 13.470 0.730
661 2HA GLY 79 1HA GLY 79 5.919 14.583 -0.528
662 H GLN 80 H GLN 80 3.652 13.238 1.751
663 HA GLN 80 HA GLN 80 3.328 15.920 2.913
664 1HB GLN 80 2HB GLN 80 1.442 14.421 1.697
665 2HB GLN 80 1HB GLN 80 1.242 13.864 3.353
666 1HG GLN 80 2HG GLN 80 -0.244 15.601 3.275
667 2HG GLN 80 1HG GLN 80 1.191 16.404 3.912
668 1HE2 GLN 80 1HE2 GLN 80 -0.142 18.255 3.059
669 2HE2 GLN 80 2HE2 GLN 80 0.150 18.738 1.425
670 H ARG 81 H ARG 81 2.663 16.005 5.202
671 HA ARG 81 HA ARG 81 3.796 13.789 6.775
672 1HB ARG 81 2HB ARG 81 4.666 15.466 8.374
673 2HB ARG 81 1HB ARG 81 5.402 15.598 6.783
674 1HG ARG 81 2HG ARG 81 4.948 17.770 6.918
675 2HG ARG 81 1HG ARG 81 3.271 17.321 6.610
676 1HD ARG 81 2HD ARG 81 4.007 17.018 9.407
677 2HD ARG 81 1HD ARG 81 4.236 18.667 8.827
678 HE ARG 81 HE ARG 81 1.767 18.048 7.927
679 1HH1 ARG 81 1HH1 ARG 81 3.270 17.835 11.069
680 2HH1 ARG 81 2HH1 ARG 81 1.790 18.087 11.932
681 1HH2 ARG 81 1HH2 ARG 81 -0.181 18.376 9.059
682 2HH2 ARG 81 2HH2 ARG 81 -0.170 18.391 10.791
683 H THR 82 H THR 82 1.119 13.893 6.222
684 HA THR 82 HA THR 82 -0.178 15.101 8.546
685 HB THR 82 HB THR 82 -2.262 14.106 7.298
686 HG1 THR 82 1HG THR 82 -0.462 14.336 5.129
687 1HG2 THR 82 1HG2 THR 82 -2.027 16.072 5.564
688 2HG2 THR 82 2HG2 THR 82 -0.690 16.525 6.622
689 3HG2 THR 82 3HG2 THR 82 -2.320 16.374 7.278
690 H ASP 83 H ASP 83 -0.716 13.964 10.288
691 HA ASP 83 HA ASP 83 -0.677 11.024 10.096
692 1HB ASP 83 2HB ASP 83 0.057 12.827 12.408
693 2HB ASP 83 1HB ASP 83 -0.112 11.080 12.546
694 H LYS 84 H LYS 84 -2.146 13.717 11.905
695 HA LYS 84 HA LYS 84 -4.474 12.007 12.444
696 1HB LYS 84 2HB LYS 84 -3.220 14.305 13.852
697 2HB LYS 84 1HB LYS 84 -4.969 14.159 13.958
698 1HG LYS 84 2HG LYS 84 -4.703 12.709 15.603
699 2HG LYS 84 1HG LYS 84 -3.956 11.595 14.455
700 1HD LYS 84 2HD LYS 84 -1.817 12.174 15.083
701 2HD LYS 84 1HD LYS 84 -2.304 13.772 15.651
702 1HE LYS 84 2HE LYS 84 -2.777 13.027 17.718
703 2HE LYS 84 1HE LYS 84 -3.510 11.539 17.119
704 1HZ LYS 84 1HZ LYS 84 -0.621 11.753 16.848
705 2HZ LYS 84 2HZ LYS 84 -1.575 10.421 17.270
706 3HZ LYS 84 3HZ LYS 84 -1.210 11.599 18.427
707 H TYR 85 H TYR 85 -3.426 14.757 10.657
708 HA TYR 85 HA TYR 85 -5.771 16.209 10.354
709 1HB TYR 85 2HB TYR 85 -3.239 16.369 9.325
710 2HB TYR 85 1HB TYR 85 -4.178 15.949 7.896
711 HD1 TYR 85 1HD TYR 85 -2.831 18.620 9.521
712 HD2 TYR 85 2HD TYR 85 -6.572 17.359 7.935
713 HE1 TYR 85 1HE TYR 85 -3.519 20.970 9.294
714 HE2 TYR 85 2HE TYR 85 -7.270 19.705 7.703
715 HH TYR 85 HH TYR 85 -5.621 22.268 9.165
716 H GLY 86 H GLY 86 -4.813 13.176 8.903
717 1HA GLY 86 2HA GLY 86 -6.812 11.780 8.309
718 2HA GLY 86 1HA GLY 86 -7.346 13.172 7.380
719 H ARG 87 H ARG 87 -4.213 11.490 7.677
720 HA ARG 87 HA ARG 87 -3.486 11.836 5.003
721 1HB ARG 87 2HB ARG 87 -2.246 10.850 7.222
722 2HB ARG 87 1HB ARG 87 -2.480 9.379 6.286
723 1HG ARG 87 2HG ARG 87 -1.513 11.034 4.380
724 2HG ARG 87 1HG ARG 87 -0.694 11.661 5.812
725 1HD ARG 87 2HD ARG 87 0.190 9.471 6.314
726 2HD ARG 87 1HD ARG 87 -0.722 8.763 4.983
727 HE ARG 87 HE ARG 87 0.932 9.437 3.564
728 1HH1 ARG 87 1HH1 ARG 87 1.158 11.326 6.490
729 2HH1 ARG 87 2HH1 ARG 87 2.626 12.112 6.016
730 1HH2 ARG 87 1HH2 ARG 87 2.862 10.471 2.940
731 2HH2 ARG 87 2HH2 ARG 87 3.592 11.629 4.000
732 H GLY 88 H GLY 88 -4.526 11.109 3.278
733 1HA GLY 88 2HA GLY 88 -5.906 8.512 3.447
734 2HA GLY 88 1HA GLY 88 -6.290 9.792 2.305
735 H LEU 89 H LEU 89 -2.961 9.048 2.862
736 HA LEU 89 HA LEU 89 -2.628 8.283 0.111
737 1HB LEU 89 2HB LEU 89 -0.762 8.628 2.438
738 2HB LEU 89 1HB LEU 89 -0.204 7.910 0.939
739 HG LEU 89 HG LEU 89 -1.475 10.640 1.078
740 1HD1 LEU 89 1HD1 LEU 89 1.301 9.756 1.604
741 2HD1 LEU 89 2HD1 LEU 89 0.408 11.138 2.236
742 3HD1 LEU 89 3HD1 LEU 89 1.085 11.197 0.609
743 1HD2 LEU 89 1HD2 LEU 89 -1.525 9.485 -1.101
744 2HD2 LEU 89 2HD2 LEU 89 0.232 9.333 -1.036
745 3HD2 LEU 89 3HD2 LEU 89 -0.514 10.930 -1.119
746 H ALA 90 H ALA 90 -1.881 6.296 -0.676
747 HA ALA 90 HA ALA 90 -2.471 4.027 1.096
748 1HB ALA 90 1HB ALA 90 -2.203 3.449 -1.755
749 2HB ALA 90 2HB ALA 90 -3.486 4.596 -1.373
750 3HB ALA 90 3HB ALA 90 -3.475 3.003 -0.617
751 H TYR 91 H TYR 91 -0.984 2.528 1.557
752 HA TYR 91 HA TYR 91 1.497 2.411 0.015
753 1HB TYR 91 2HB TYR 91 1.356 2.830 3.006
754 2HB TYR 91 1HB TYR 91 2.817 2.359 2.146
755 HD1 TYR 91 1HD TYR 91 3.983 3.947 0.712
756 HD2 TYR 91 2HD TYR 91 0.488 5.087 2.851
757 HE1 TYR 91 1HE TYR 91 4.511 6.314 0.303
758 HE2 TYR 91 2HE TYR 91 1.006 7.455 2.448
759 HH TYR 91 HH TYR 91 3.866 8.599 1.623
760 H ILE 92 H ILE 92 0.832 0.383 -0.743
761 HA ILE 92 HA ILE 92 0.973 -1.751 1.274
762 HB ILE 92 HB ILE 92 -0.938 -1.821 -1.058
763 1HG1 ILE 92 2HG1 ILE 92 -1.587 -0.066 0.556
764 2HG1 ILE 92 1HG1 ILE 92 -2.729 -1.406 0.548
765 1HG2 ILE 92 1HG2 ILE 92 -0.673 -3.575 1.380
766 2HG2 ILE 92 2HG2 ILE 92 -0.181 -3.998 -0.260
767 3HG2 ILE 92 3HG2 ILE 92 -1.887 -3.743 0.111
768 1HD1 ILE 92 1HD1 ILE 92 -0.731 -1.917 2.508
769 2HD1 ILE 92 2HD1 ILE 92 -2.463 -1.664 2.723
770 3HD1 ILE 92 3HD1 ILE 92 -1.362 -0.286 2.737
771 H TYR 93 H TYR 93 2.634 -3.006 0.842
772 HA TYR 93 HA TYR 93 3.052 -4.019 -1.839
773 1HB TYR 93 2HB TYR 93 4.698 -1.915 -0.748
774 2HB TYR 93 1HB TYR 93 5.659 -3.367 -1.001
775 HD1 TYR 93 1HD TYR 93 4.821 -0.411 -2.480
776 HD2 TYR 93 2HD TYR 93 4.911 -4.568 -3.383
777 HE1 TYR 93 1HE TYR 93 4.978 0.117 -4.878
778 HE2 TYR 93 2HE TYR 93 5.068 -4.050 -5.780
779 HH TYR 93 HH TYR 93 4.582 -2.262 -7.314
780 H ALA 94 H ALA 94 3.222 -6.130 -1.586
781 HA ALA 94 HA ALA 94 4.137 -7.221 0.954
782 1HB ALA 94 1HB ALA 94 3.366 -9.408 -0.224
783 2HB ALA 94 2HB ALA 94 2.572 -8.303 -1.348
784 3HB ALA 94 3HB ALA 94 2.166 -8.261 0.369
785 H ASP 95 H ASP 95 6.228 -7.653 1.173
786 HA ASP 95 HA ASP 95 8.393 -8.201 0.707
787 1HB ASP 95 2HB ASP 95 7.069 -10.403 0.481
788 2HB ASP 95 1HB ASP 95 7.289 -10.199 -1.255
789 H GLY 96 H GLY 96 7.068 -6.187 -1.028
790 1HA GLY 96 2HA GLY 96 7.605 -4.914 -2.862
791 2HA GLY 96 1HA GLY 96 9.189 -5.670 -2.785
792 H LYS 97 H LYS 97 6.226 -5.481 -4.459
793 HA LYS 97 HA LYS 97 6.630 -7.936 -5.946
794 1HB LYS 97 2HB LYS 97 4.612 -5.805 -6.610
795 2HB LYS 97 1HB LYS 97 4.533 -7.530 -6.940
796 1HG LYS 97 2HG LYS 97 4.085 -8.041 -4.674
797 2HG LYS 97 1HG LYS 97 4.489 -6.403 -4.157
798 1HD LYS 97 2HD LYS 97 2.311 -5.944 -4.294
799 2HD LYS 97 1HD LYS 97 2.490 -6.041 -6.046
800 1HE LYS 97 2HE LYS 97 2.171 -8.602 -5.643
801 2HE LYS 97 1HE LYS 97 1.447 -8.077 -4.123
802 1HZ LYS 97 1HZ LYS 97 0.444 -7.835 -6.833
803 2HZ LYS 97 2HZ LYS 97 0.211 -6.474 -5.857
804 3HZ LYS 97 3HZ LYS 97 -0.399 -7.974 -5.373
805 H MET 98 H MET 98 8.392 -7.792 -7.218
806 HA MET 98 HA MET 98 8.971 -5.417 -8.753
807 1HB MET 98 2HB MET 98 10.300 -8.120 -8.957
808 2HB MET 98 1HB MET 98 10.943 -6.574 -9.491
809 1HG MET 98 2HG MET 98 10.365 -6.286 -6.758
810 2HG MET 98 1HG MET 98 11.159 -7.849 -6.939
811 1HE MET 98 1HE MET 98 14.641 -7.243 -7.175
812 2HE MET 98 2HE MET 98 13.899 -7.641 -8.725
813 3HE MET 98 3HE MET 98 13.251 -8.325 -7.235
814 H VAL 99 H VAL 99 8.771 -5.149 -10.942
815 HA VAL 99 HA VAL 99 7.056 -7.106 -12.304
816 HB VAL 99 HB VAL 99 6.161 -4.819 -12.152
817 1HG1 VAL 99 1HG1 VAL 99 8.725 -3.985 -12.546
818 2HG1 VAL 99 2HG1 VAL 99 7.297 -2.960 -12.683
819 3HG1 VAL 99 3HG1 VAL 99 8.003 -3.687 -14.127
820 1HG2 VAL 99 1HG2 VAL 99 5.620 -4.531 -14.529
821 2HG2 VAL 99 2HG2 VAL 99 5.513 -6.220 -14.031
822 3HG2 VAL 99 3HG2 VAL 99 6.909 -5.659 -14.951
823 H ASN 100 H ASN 100 10.117 -5.433 -12.497
824 HA ASN 100 HA ASN 100 10.792 -7.060 -14.857
825 1HB ASN 100 2HB ASN 100 10.591 -4.297 -14.847
826 2HB ASN 100 1HB ASN 100 12.318 -4.579 -14.651
827 1HD2 ASN 100 1HD2 ASN 100 9.944 -4.124 -16.854
828 2HD2 ASN 100 2HD2 ASN 100 10.674 -4.867 -18.233
829 H GLU 101 H GLU 101 12.601 -4.870 -12.706
830 HA GLU 101 HA GLU 101 13.929 -6.868 -11.253
831 1HB GLU 101 2HB GLU 101 16.182 -6.700 -12.302
832 2HB GLU 101 1HB GLU 101 14.991 -7.501 -13.318
833 1HG GLU 101 2HG GLU 101 14.686 -5.051 -14.263
834 2HG GLU 101 1HG GLU 101 16.339 -4.887 -13.672
835 H ALA 102 H ALA 102 16.223 -5.855 -10.492
836 HA ALA 102 HA ALA 102 15.569 -3.108 -9.653
837 1HB ALA 102 1HB ALA 102 17.143 -5.272 -8.271
838 2HB ALA 102 2HB ALA 102 15.623 -4.538 -7.758
839 3HB ALA 102 3HB ALA 102 17.112 -3.594 -7.726
840 H LEU 103 H LEU 103 17.353 -1.619 -9.354
841 HA LEU 103 HA LEU 103 19.361 -1.955 -11.445
842 1HB LEU 103 2HB LEU 103 18.110 0.333 -10.051
843 2HB LEU 103 1HB LEU 103 19.790 0.541 -10.508
844 HG LEU 103 HG LEU 103 17.734 -0.351 -12.509
845 1HD1 LEU 103 1HD1 LEU 103 16.737 1.634 -11.924
846 2HD1 LEU 103 2HD1 LEU 103 17.875 2.176 -13.156
847 3HD1 LEU 103 3HD1 LEU 103 18.260 2.384 -11.447
848 1HD2 LEU 103 1HD2 LEU 103 20.373 1.086 -12.772
849 2HD2 LEU 103 2HD2 LEU 103 19.322 0.589 -14.098
850 3HD2 LEU 103 3HD2 LEU 103 20.096 -0.627 -13.084
851 H VAL 104 H VAL 104 21.459 -0.513 -10.695
852 HA VAL 104 HA VAL 104 22.946 -2.189 -9.050
853 HB VAL 104 HB VAL 104 24.616 -0.361 -8.946
854 1HG1 VAL 104 1HG1 VAL 104 25.167 -0.389 -11.250
855 2HG1 VAL 104 2HG1 VAL 104 23.482 -0.603 -11.722
856 3HG1 VAL 104 3HG1 VAL 104 24.345 -1.912 -10.915
857 1HG2 VAL 104 1HG2 VAL 104 23.667 1.688 -8.850
858 2HG2 VAL 104 2HG2 VAL 104 22.283 1.211 -9.835
859 3HG2 VAL 104 3HG2 VAL 104 23.822 1.598 -10.605
860 H ARG 105 H ARG 105 23.881 -1.823 -6.955
861 HA ARG 105 HA ARG 105 21.954 -0.951 -5.037
862 1HB ARG 105 2HB ARG 105 24.427 -2.452 -5.042
863 2HB ARG 105 1HB ARG 105 24.405 -1.297 -3.716
864 1HG ARG 105 2HG ARG 105 21.882 -2.683 -3.935
865 2HG ARG 105 1HG ARG 105 23.226 -3.813 -3.776
866 1HD ARG 105 2HD ARG 105 23.109 -3.434 -1.583
867 2HD ARG 105 1HD ARG 105 23.812 -1.854 -1.922
868 HE ARG 105 HE ARG 105 21.075 -2.429 -1.210
869 1HH1 ARG 105 1HH1 ARG 105 23.273 -0.114 -2.623
870 2HH1 ARG 105 2HH1 ARG 105 22.231 1.238 -2.333
871 1HH2 ARG 105 1HH2 ARG 105 19.705 -0.651 -0.831
872 2HH2 ARG 105 2HH2 ARG 105 20.206 0.934 -1.317
873 H GLN 106 H GLN 106 25.326 0.097 -5.579
874 HA GLN 106 HA GLN 106 24.581 2.868 -5.352
875 1HB GLN 106 2HB GLN 106 25.161 1.541 -2.983
876 2HB GLN 106 1HB GLN 106 26.666 2.354 -3.386
877 1HG GLN 106 2HG GLN 106 24.245 3.996 -3.647
878 2HG GLN 106 1HG GLN 106 24.641 3.480 -2.008
879 1HE2 GLN 106 1HE2 GLN 106 24.928 5.984 -3.952
880 2HE2 GLN 106 2HE2 GLN 106 26.453 6.627 -3.455
881 H GLY 107 H GLY 107 25.880 1.159 -7.300
882 1HA GLY 107 2HA GLY 107 27.606 2.550 -8.636
883 2HA GLY 107 1HA GLY 107 28.640 2.175 -7.267
884 H LEU 108 H LEU 108 29.630 0.220 -7.155
885 HA LEU 108 HA LEU 108 29.057 -1.666 -9.345
886 1HB LEU 108 2HB LEU 108 31.558 -2.331 -8.870
887 2HB LEU 108 1HB LEU 108 31.156 -1.003 -9.940
888 HG LEU 108 HG LEU 108 33.047 -0.535 -8.392
889 1HD1 LEU 108 1HD1 LEU 108 30.977 1.120 -9.175
890 2HD1 LEU 108 2HD1 LEU 108 32.544 1.623 -8.539
891 3HD1 LEU 108 3HD1 LEU 108 31.164 1.457 -7.454
892 1HD2 LEU 108 1HD2 LEU 108 32.484 -1.644 -6.406
893 2HD2 LEU 108 2HD2 LEU 108 30.895 -0.884 -6.327
894 3HD2 LEU 108 3HD2 LEU 108 32.344 0.071 -6.024
895 H ALA 109 H ALA 109 27.512 -2.560 -7.757
896 HA ALA 109 HA ALA 109 28.244 -3.699 -5.319
897 1HB ALA 109 1HB ALA 109 25.979 -3.663 -5.536
898 2HB ALA 109 2HB ALA 109 26.271 -5.337 -6.007
899 3HB ALA 109 3HB ALA 109 26.023 -4.104 -7.244
900 H LYS 110 H LYS 110 28.316 -5.061 -8.586
901 HA LYS 110 HA LYS 110 30.160 -7.118 -7.620
902 1HB LYS 110 2HB LYS 110 27.867 -7.766 -9.472
903 2HB LYS 110 1HB LYS 110 29.014 -8.893 -8.761
904 1HG LYS 110 2HG LYS 110 27.978 -7.791 -6.530
905 2HG LYS 110 1HG LYS 110 26.593 -7.678 -7.617
906 1HD LYS 110 2HD LYS 110 28.145 -10.230 -7.338
907 2HD LYS 110 1HD LYS 110 26.868 -9.809 -6.195
908 1HE LYS 110 2HE LYS 110 25.727 -9.345 -8.674
909 2HE LYS 110 1HE LYS 110 26.680 -10.807 -8.916
910 1HZ LYS 110 1HZ LYS 110 24.554 -11.486 -8.201
911 2HZ LYS 110 2HZ LYS 110 24.519 -10.362 -6.938
912 3HZ LYS 110 3HZ LYS 110 25.570 -11.685 -6.864
Start of MODEL 11
1 1H ALA 1 1HT ALA 1 14.592 25.605 -10.486
2 2H ALA 1 2HT ALA 1 14.656 24.201 -9.502
3 3H ALA 1 3HT ALA 1 14.043 25.672 -8.863
4 HA ALA 1 HA ALA 1 12.132 25.568 -10.057
5 1HB ALA 1 1HB ALA 1 13.128 23.276 -11.711
6 2HB ALA 1 2HB ALA 1 13.460 24.946 -12.169
7 3HB ALA 1 3HB ALA 1 11.795 24.385 -12.033
8 H THR 2 H THR 2 10.639 23.392 -10.530
9 HA THR 2 HA THR 2 10.858 21.906 -8.007
10 HB THR 2 HB THR 2 8.452 21.360 -8.396
11 HG1 THR 2 1HG THR 2 8.584 21.701 -10.716
12 1HG2 THR 2 1HG2 THR 2 7.528 23.526 -7.906
13 2HG2 THR 2 2HG2 THR 2 8.995 24.316 -8.483
14 3HG2 THR 2 3HG2 THR 2 9.044 23.314 -7.032
15 H SER 3 H SER 3 12.130 20.172 -8.431
16 HA SER 3 HA SER 3 11.737 18.612 -10.847
17 1HB SER 3 2HB SER 3 13.719 17.466 -10.278
18 2HB SER 3 1HB SER 3 14.008 19.124 -9.752
19 HG SER 3 HG SER 3 14.338 17.093 -8.280
20 H THR 4 H THR 4 10.712 16.695 -10.987
21 HA THR 4 HA THR 4 8.895 15.919 -8.977
22 HB THR 4 HB THR 4 9.757 13.955 -11.052
23 HG1 THR 4 1HG THR 4 8.278 16.293 -11.667
24 1HG2 THR 4 1HG2 THR 4 7.339 14.582 -9.562
25 2HG2 THR 4 2HG2 THR 4 7.838 13.083 -10.347
26 3HG2 THR 4 3HG2 THR 4 7.064 14.356 -11.289
27 H LYS 5 H LYS 5 9.500 15.126 -7.073
28 HA LYS 5 HA LYS 5 11.925 13.604 -6.756
29 1HB LYS 5 2HB LYS 5 10.397 15.202 -5.095
30 2HB LYS 5 1HB LYS 5 10.085 13.582 -4.488
31 1HG LYS 5 2HG LYS 5 12.847 14.686 -4.931
32 2HG LYS 5 1HG LYS 5 11.983 14.784 -3.394
33 1HD LYS 5 2HD LYS 5 11.845 12.354 -3.300
34 2HD LYS 5 1HD LYS 5 12.652 12.233 -4.865
35 1HE LYS 5 2HE LYS 5 14.697 12.743 -4.005
36 2HE LYS 5 1HE LYS 5 14.030 13.772 -2.740
37 1HZ LYS 5 1HZ LYS 5 13.731 10.827 -2.707
38 2HZ LYS 5 2HZ LYS 5 13.491 11.914 -1.434
39 3HZ LYS 5 3HZ LYS 5 15.055 11.609 -2.002
40 H LYS 6 H LYS 6 12.024 11.530 -7.287
41 HA LYS 6 HA LYS 6 9.655 9.889 -7.416
42 1HB LYS 6 2HB LYS 6 12.502 9.619 -8.213
43 2HB LYS 6 1HB LYS 6 11.634 8.130 -7.867
44 1HG LYS 6 2HG LYS 6 10.269 10.058 -9.635
45 2HG LYS 6 1HG LYS 6 11.706 9.267 -10.285
46 1HD LYS 6 2HD LYS 6 10.560 7.394 -10.641
47 2HD LYS 6 1HD LYS 6 10.072 7.331 -8.947
48 1HE LYS 6 2HE LYS 6 7.996 7.582 -9.763
49 2HE LYS 6 1HE LYS 6 8.440 9.284 -9.892
50 1HZ LYS 6 1HZ LYS 6 8.349 7.236 -12.014
51 2HZ LYS 6 2HZ LYS 6 9.300 8.621 -12.197
52 3HZ LYS 6 3HZ LYS 6 7.628 8.768 -11.984
53 H LEU 7 H LEU 7 9.155 8.131 -6.140
54 HA LEU 7 HA LEU 7 10.194 8.214 -3.453
55 1HB LEU 7 2HB LEU 7 7.791 7.395 -4.693
56 2HB LEU 7 1HB LEU 7 8.460 5.972 -3.916
57 HG LEU 7 HG LEU 7 6.883 7.165 -2.462
58 1HD1 LEU 7 1HD1 LEU 7 9.699 7.401 -1.422
59 2HD1 LEU 7 2HD1 LEU 7 8.812 5.881 -1.544
60 3HD1 LEU 7 3HD1 LEU 7 8.224 7.163 -0.484
61 1HD2 LEU 7 1HD2 LEU 7 8.064 9.361 -1.490
62 2HD2 LEU 7 2HD2 LEU 7 6.904 9.400 -2.817
63 3HD2 LEU 7 3HD2 LEU 7 8.635 9.441 -3.155
64 H HIS 8 H HIS 8 11.400 6.676 -2.416
65 HA HIS 8 HA HIS 8 12.817 4.804 -4.150
66 1HB HIS 8 2HB HIS 8 14.044 6.367 -2.594
67 2HB HIS 8 1HB HIS 8 13.387 5.438 -1.251
68 HD1 HIS 8 1HD HIS 8 14.403 3.124 -0.800
69 HD2 HIS 8 2HD HIS 8 16.055 5.072 -4.079
70 HE1 HIS 8 1HE HIS 8 16.461 1.807 -1.400
71 HE2 HIS 8 2HE HIS 8 17.473 3.034 -3.354
72 H LYS 9 H LYS 9 13.233 2.603 -3.405
73 HA LYS 9 HA LYS 9 10.816 1.349 -2.519
74 1HB LYS 9 2HB LYS 9 13.523 0.351 -3.349
75 2HB LYS 9 1HB LYS 9 12.351 -0.742 -2.623
76 1HG LYS 9 2HG LYS 9 10.748 0.152 -4.447
77 2HG LYS 9 1HG LYS 9 12.230 0.688 -5.243
78 1HD LYS 9 2HD LYS 9 13.051 -1.720 -4.884
79 2HD LYS 9 1HD LYS 9 11.357 -2.105 -4.568
80 1HE LYS 9 2HE LYS 9 12.124 -2.459 -6.939
81 2HE LYS 9 1HE LYS 9 10.706 -1.431 -6.744
82 1HZ LYS 9 1HZ LYS 9 13.281 -0.079 -6.772
83 2HZ LYS 9 2HZ LYS 9 11.809 0.380 -7.469
84 3HZ LYS 9 3HZ LYS 9 12.788 -0.765 -8.239
85 H GLU 10 H GLU 10 10.268 1.444 -0.440
86 HA GLU 10 HA GLU 10 12.216 0.530 1.546
87 1HB GLU 10 2HB GLU 10 10.448 2.947 1.962
88 2HB GLU 10 1HB GLU 10 11.608 2.287 3.107
89 1HG GLU 10 2HG GLU 10 13.072 2.769 0.785
90 2HG GLU 10 1HG GLU 10 12.006 4.163 0.962
91 HA PRO 11 HA PRO 11 8.651 -1.768 2.824
92 1HB PRO 11 2HB PRO 11 9.605 -2.941 5.008
93 2HB PRO 11 1HB PRO 11 10.276 -3.311 3.416
94 1HG PRO 11 2HG PRO 11 11.354 -1.507 5.548
95 2HG PRO 11 1HG PRO 11 12.218 -2.662 4.519
96 1HD PRO 11 2HD PRO 11 12.075 0.059 4.048
97 2HD PRO 11 1HD PRO 11 12.412 -1.164 2.806
98 H ALA 12 H ALA 12 7.121 -2.014 4.600
99 HA ALA 12 HA ALA 12 7.081 0.331 6.388
100 1HB ALA 12 1HB ALA 12 4.527 -0.975 5.637
101 2HB ALA 12 2HB ALA 12 5.337 -0.005 4.407
102 3HB ALA 12 3HB ALA 12 4.886 0.724 5.949
103 H THR 13 H THR 13 7.691 -0.432 8.322
104 HA THR 13 HA THR 13 7.253 -3.054 9.250
105 HB THR 13 HB THR 13 8.047 -2.248 11.399
106 HG1 THR 13 1HG THR 13 7.091 -0.341 11.744
107 1HG2 THR 13 1HG2 THR 13 9.439 -1.371 8.948
108 2HG2 THR 13 2HG2 THR 13 9.968 -2.454 10.236
109 3HG2 THR 13 3HG2 THR 13 10.006 -0.707 10.480
110 H LEU 14 H LEU 14 4.977 -3.358 8.829
111 HA LEU 14 HA LEU 14 2.984 -1.841 10.176
112 1HB LEU 14 2HB LEU 14 2.841 -3.458 8.106
113 2HB LEU 14 1HB LEU 14 2.533 -4.671 9.332
114 HG LEU 14 HG LEU 14 0.906 -2.149 9.165
115 1HD1 LEU 14 1HD1 LEU 14 -0.592 -3.098 7.684
116 2HD1 LEU 14 2HD1 LEU 14 0.001 -4.735 7.973
117 3HD1 LEU 14 3HD1 LEU 14 0.963 -3.603 7.021
118 1HD2 LEU 14 1HD2 LEU 14 -0.116 -2.987 10.946
119 2HD2 LEU 14 2HD2 LEU 14 1.014 -4.340 10.956
120 3HD2 LEU 14 3HD2 LEU 14 -0.498 -4.460 10.058
121 H ILE 15 H ILE 15 2.495 -1.886 12.275
122 HA ILE 15 HA ILE 15 3.034 -4.365 13.773
123 HB ILE 15 HB ILE 15 3.301 -1.590 14.919
124 1HG1 ILE 15 2HG1 ILE 15 5.553 -3.452 14.160
125 2HG1 ILE 15 1HG1 ILE 15 4.981 -2.166 13.101
126 1HG2 ILE 15 1HG2 ILE 15 4.448 -2.768 16.749
127 2HG2 ILE 15 2HG2 ILE 15 4.099 -4.305 15.959
128 3HG2 ILE 15 3HG2 ILE 15 2.777 -3.300 16.555
129 1HD1 ILE 15 1HD1 ILE 15 5.530 -0.525 14.843
130 2HD1 ILE 15 2HD1 ILE 15 6.935 -1.446 14.310
131 3HD1 ILE 15 3HD1 ILE 15 6.160 -1.828 15.848
132 H LYS 16 H LYS 16 1.420 -1.258 14.488
133 HA LYS 16 HA LYS 16 -0.960 -2.809 15.275
134 1HB LYS 16 2HB LYS 16 -1.385 -1.000 16.951
135 2HB LYS 16 1HB LYS 16 0.055 -1.958 17.269
136 1HG LYS 16 2HG LYS 16 1.454 -0.196 16.349
137 2HG LYS 16 1HG LYS 16 0.020 0.763 15.979
138 1HD LYS 16 2HD LYS 16 -0.266 1.404 18.127
139 2HD LYS 16 1HD LYS 16 0.255 -0.156 18.770
140 1HE LYS 16 2HE LYS 16 2.390 0.507 18.987
141 2HE LYS 16 1HE LYS 16 2.375 1.386 17.459
142 1HZ LYS 16 1HZ LYS 16 0.993 2.427 19.856
143 2HZ LYS 16 2HZ LYS 16 1.474 3.269 18.471
144 3HZ LYS 16 3HZ LYS 16 2.634 2.733 19.579
145 H ALA 17 H ALA 17 -2.979 -1.978 14.795
146 HA ALA 17 HA ALA 17 -3.024 0.376 13.022
147 1HB ALA 17 1HB ALA 17 -4.818 -2.024 12.725
148 2HB ALA 17 2HB ALA 17 -3.315 -1.814 11.828
149 3HB ALA 17 3HB ALA 17 -4.636 -0.666 11.615
150 H ILE 18 H ILE 18 -4.833 1.732 13.165
151 HA ILE 18 HA ILE 18 -6.287 1.485 15.689
152 HB ILE 18 HB ILE 18 -6.040 3.852 13.828
153 1HG1 ILE 18 2HG1 ILE 18 -3.944 3.226 14.987
154 2HG1 ILE 18 1HG1 ILE 18 -4.566 4.785 15.521
155 1HG2 ILE 18 1HG2 ILE 18 -7.093 5.150 15.582
156 2HG2 ILE 18 2HG2 ILE 18 -7.241 3.710 16.590
157 3HG2 ILE 18 3HG2 ILE 18 -8.155 3.834 15.087
158 1HD1 ILE 18 1HD1 ILE 18 -4.002 3.845 17.518
159 2HD1 ILE 18 2HD1 ILE 18 -4.386 2.208 16.985
160 3HD1 ILE 18 3HD1 ILE 18 -5.684 3.330 17.395
161 H ASP 19 H ASP 19 -7.495 3.237 12.869
162 HA ASP 19 HA ASP 19 -9.812 1.417 12.836
163 1HB ASP 19 2HB ASP 19 -11.095 3.453 12.014
164 2HB ASP 19 1HB ASP 19 -10.586 3.486 13.699
165 H GLY 20 H GLY 20 -9.607 0.157 11.091
166 1HA GLY 20 2HA GLY 20 -9.964 -0.116 8.755
167 2HA GLY 20 1HA GLY 20 -9.284 1.483 8.493
168 H ASP 21 H ASP 21 -7.296 1.550 7.683
169 HA ASP 21 HA ASP 21 -5.539 -0.772 8.130
170 1HB ASP 21 2HB ASP 21 -6.137 0.746 5.616
171 2HB ASP 21 1HB ASP 21 -4.570 -0.032 5.816
172 H THR 22 H THR 22 -5.862 2.074 9.319
173 HA THR 22 HA THR 22 -3.425 3.410 8.636
174 HB THR 22 HB THR 22 -5.169 4.810 9.402
175 HG1 THR 22 1HG THR 22 -3.471 4.521 11.648
176 1HG2 THR 22 1HG2 THR 22 -6.647 3.427 10.570
177 2HG2 THR 22 2HG2 THR 22 -6.056 4.585 11.760
178 3HG2 THR 22 3HG2 THR 22 -5.413 2.944 11.732
179 H VAL 23 H VAL 23 -1.548 2.460 9.094
180 HA VAL 23 HA VAL 23 -1.133 1.492 11.844
181 HB VAL 23 HB VAL 23 0.156 0.247 9.417
182 1HG1 VAL 23 1HG1 VAL 23 -0.105 -1.240 11.938
183 2HG1 VAL 23 2HG1 VAL 23 0.956 0.168 12.003
184 3HG1 VAL 23 3HG1 VAL 23 1.260 -1.111 10.828
185 1HG2 VAL 23 1HG2 VAL 23 -1.992 -0.458 9.061
186 2HG2 VAL 23 2HG2 VAL 23 -2.426 -0.355 10.768
187 3HG2 VAL 23 3HG2 VAL 23 -1.445 -1.701 10.185
188 H LYS 24 H LYS 24 0.665 2.208 12.841
189 HA LYS 24 HA LYS 24 2.217 4.251 11.535
190 1HB LYS 24 2HB LYS 24 1.441 3.870 14.106
191 2HB LYS 24 1HB LYS 24 3.089 3.264 14.179
192 1HG LYS 24 2HG LYS 24 3.616 5.400 14.572
193 2HG LYS 24 1HG LYS 24 3.449 5.585 12.824
194 1HD LYS 24 2HD LYS 24 1.596 6.834 13.024
195 2HD LYS 24 1HD LYS 24 0.918 5.790 14.273
196 1HE LYS 24 2HE LYS 24 3.203 7.604 14.919
197 2HE LYS 24 1HE LYS 24 1.565 8.250 14.839
198 1HZ LYS 24 1HZ LYS 24 0.877 6.673 16.513
199 2HZ LYS 24 2HZ LYS 24 2.191 7.570 17.088
200 3HZ LYS 24 3HZ LYS 24 2.421 5.982 16.556
201 H LEU 25 H LEU 25 3.532 3.401 9.999
202 HA LEU 25 HA LEU 25 5.294 1.177 10.726
203 1HB LEU 25 2HB LEU 25 5.242 2.389 7.998
204 2HB LEU 25 1HB LEU 25 5.560 0.732 8.472
205 HG LEU 25 HG LEU 25 2.838 1.485 9.122
206 1HD1 LEU 25 1HD1 LEU 25 3.686 2.784 6.866
207 2HD1 LEU 25 2HD1 LEU 25 2.018 2.341 7.232
208 3HD1 LEU 25 3HD1 LEU 25 3.007 1.291 6.217
209 1HD2 LEU 25 1HD2 LEU 25 3.243 -0.504 7.041
210 2HD2 LEU 25 2HD2 LEU 25 2.503 -0.663 8.634
211 3HD2 LEU 25 3HD2 LEU 25 4.254 -0.783 8.459
212 H MET 26 H MET 26 7.510 1.335 10.700
213 HA MET 26 HA MET 26 8.610 3.928 11.179
214 1HB MET 26 2HB MET 26 9.668 1.135 11.148
215 2HB MET 26 1HB MET 26 10.809 2.470 11.091
216 1HG MET 26 2HG MET 26 10.581 1.856 13.357
217 2HG MET 26 1HG MET 26 9.710 3.373 13.153
218 1HE MET 26 1HE MET 26 8.596 3.398 15.048
219 2HE MET 26 2HE MET 26 8.441 1.880 15.932
220 3HE MET 26 3HE MET 26 7.005 2.676 15.289
221 H TYR 27 H TYR 27 8.650 5.241 9.429
222 HA TYR 27 HA TYR 27 9.739 4.225 6.910
223 1HB TYR 27 2HB TYR 27 7.655 5.467 6.739
224 2HB TYR 27 1HB TYR 27 8.367 6.837 7.583
225 HD1 TYR 27 1HD TYR 27 9.190 8.595 6.326
226 HD2 TYR 27 2HD TYR 27 8.927 4.744 4.537
227 HE1 TYR 27 1HE TYR 27 9.906 9.552 4.179
228 HE2 TYR 27 2HE TYR 27 9.644 5.689 2.384
229 HH TYR 27 HH TYR 27 9.480 8.660 1.533
230 H LYS 28 H LYS 28 11.922 4.184 7.060
231 HA LYS 28 HA LYS 28 14.075 4.908 7.218
232 1HB LYS 28 2HB LYS 28 13.154 6.482 5.474
233 2HB LYS 28 1HB LYS 28 12.928 7.663 6.758
234 1HG LYS 28 2HG LYS 28 15.531 6.977 7.118
235 2HG LYS 28 1HG LYS 28 15.365 6.830 5.368
236 1HD LYS 28 2HD LYS 28 15.031 9.057 5.075
237 2HD LYS 28 1HD LYS 28 14.188 9.240 6.616
238 1HE LYS 28 2HE LYS 28 17.159 8.807 6.345
239 2HE LYS 28 1HE LYS 28 16.400 10.389 6.511
240 1HZ LYS 28 1HZ LYS 28 15.671 8.413 8.511
241 2HZ LYS 28 2HZ LYS 28 15.995 10.065 8.687
242 3HZ LYS 28 3HZ LYS 28 17.271 8.960 8.571
243 H GLY 29 H GLY 29 12.472 4.792 9.646
244 1HA GLY 29 2HA GLY 29 13.185 5.101 11.862
245 2HA GLY 29 1HA GLY 29 14.222 6.413 11.323
246 H GLN 30 H GLN 30 10.954 6.414 10.224
247 HA GLN 30 HA GLN 30 10.125 8.235 12.356
248 1HB GLN 30 2HB GLN 30 10.803 9.024 9.662
249 2HB GLN 30 1HB GLN 30 9.114 9.376 9.997
250 1HG GLN 30 2HG GLN 30 10.932 10.154 12.145
251 2HG GLN 30 1HG GLN 30 11.221 10.986 10.618
252 1HE2 GLN 30 1HE2 GLN 30 9.617 12.316 9.764
253 2HE2 GLN 30 2HE2 GLN 30 8.301 12.895 10.722
254 HA PRO 31 HA PRO 31 6.624 5.451 11.745
255 1HB PRO 31 2HB PRO 31 5.160 6.415 13.837
256 2HB PRO 31 1HB PRO 31 6.466 5.241 14.021
257 1HG PRO 31 2HG PRO 31 6.508 8.202 14.443
258 2HG PRO 31 1HG PRO 31 7.237 6.919 15.427
259 1HD PRO 31 2HD PRO 31 8.684 8.401 13.700
260 2HD PRO 31 1HD PRO 31 9.050 6.692 14.011
261 H MET 32 H MET 32 5.001 5.750 10.363
262 HA MET 32 HA MET 32 3.452 8.222 10.438
263 1HB MET 32 2HB MET 32 4.992 7.236 8.044
264 2HB MET 32 1HB MET 32 3.601 8.298 7.881
265 1HG MET 32 2HG MET 32 5.820 9.072 9.710
266 2HG MET 32 1HG MET 32 6.017 9.271 7.970
267 1HE MET 32 1HE MET 32 4.252 10.390 6.497
268 2HE MET 32 2HE MET 32 3.225 11.729 7.004
269 3HE MET 32 3HE MET 32 2.709 10.066 7.286
270 H THR 33 H THR 33 1.391 7.655 10.525
271 HA THR 33 HA THR 33 0.492 5.025 9.928
272 HB THR 33 HB THR 33 -1.819 6.351 10.149
273 HG1 THR 33 1HG THR 33 -0.579 8.376 10.164
274 1HG2 THR 33 1HG2 THR 33 -1.370 6.348 12.719
275 2HG2 THR 33 2HG2 THR 33 0.090 5.475 12.252
276 3HG2 THR 33 3HG2 THR 33 -1.498 4.834 11.824
277 H PHE 34 H PHE 34 -0.493 4.206 8.162
278 HA PHE 34 HA PHE 34 -1.325 6.021 6.020
279 1HB PHE 34 2HB PHE 34 0.541 3.674 5.613
280 2HB PHE 34 1HB PHE 34 -0.177 4.640 4.328
281 HD1 PHE 34 1HD PHE 34 2.803 4.076 5.636
282 HD2 PHE 34 2HD PHE 34 0.124 7.356 5.220
283 HE1 PHE 34 1HE PHE 34 4.701 5.636 5.757
284 HE2 PHE 34 2HE PHE 34 2.019 8.923 5.339
285 HZ PHE 34 HZ PHE 34 4.311 8.062 5.607
286 H ARG 35 H ARG 35 -2.825 5.099 4.535
287 HA ARG 35 HA ARG 35 -4.121 2.653 5.548
288 1HB ARG 35 2HB ARG 35 -5.182 5.291 4.966
289 2HB ARG 35 1HB ARG 35 -6.024 4.046 4.053
290 1HG ARG 35 2HG ARG 35 -6.792 2.981 5.966
291 2HG ARG 35 1HG ARG 35 -5.568 3.732 6.993
292 1HD ARG 35 2HD ARG 35 -6.682 5.779 7.031
293 2HD ARG 35 1HD ARG 35 -7.634 5.393 5.598
294 HE ARG 35 HE ARG 35 -8.238 4.704 8.324
295 1HH1 ARG 35 1HH1 ARG 35 -8.776 3.879 4.975
296 2HH1 ARG 35 2HH1 ARG 35 -10.282 3.082 5.283
297 1HH2 ARG 35 1HH2 ARG 35 -10.220 3.657 8.730
298 2HH2 ARG 35 2HH2 ARG 35 -11.102 2.956 7.414
299 H LEU 36 H LEU 36 -4.952 1.179 4.058
300 HA LEU 36 HA LEU 36 -3.524 1.059 1.568
301 1HB LEU 36 2HB LEU 36 -3.814 -0.991 2.738
302 2HB LEU 36 1HB LEU 36 -5.540 -0.737 2.899
303 HG LEU 36 HG LEU 36 -5.810 -1.057 0.472
304 1HD1 LEU 36 1HD1 LEU 36 -3.295 -2.290 -0.100
305 2HD1 LEU 36 2HD1 LEU 36 -3.029 -0.630 0.431
306 3HD1 LEU 36 3HD1 LEU 36 -4.098 -0.960 -0.931
307 1HD2 LEU 36 1HD2 LEU 36 -4.786 -3.532 0.577
308 2HD2 LEU 36 2HD2 LEU 36 -6.259 -3.058 1.423
309 3HD2 LEU 36 3HD2 LEU 36 -4.725 -3.115 2.289
310 H LEU 37 H LEU 37 -4.287 1.351 -0.471
311 HA LEU 37 HA LEU 37 -6.758 2.824 -0.744
312 1HB LEU 37 2HB LEU 37 -4.786 3.548 -1.971
313 2HB LEU 37 1HB LEU 37 -4.689 1.996 -2.779
314 HG LEU 37 HG LEU 37 -7.212 3.527 -3.108
315 1HD1 LEU 37 1HD1 LEU 37 -4.958 4.969 -3.394
316 2HD1 LEU 37 2HD1 LEU 37 -6.405 5.208 -4.372
317 3HD1 LEU 37 3HD1 LEU 37 -5.068 4.243 -4.998
318 1HD2 LEU 37 1HD2 LEU 37 -6.584 2.663 -5.529
319 2HD2 LEU 37 2HD2 LEU 37 -7.311 1.600 -4.323
320 3HD2 LEU 37 3HD2 LEU 37 -5.571 1.555 -4.605
321 H LEU 38 H LEU 38 -8.441 1.414 -0.415
322 HA LEU 38 HA LEU 38 -8.728 -0.716 -2.429
323 1HB LEU 38 2HB LEU 38 -8.701 -0.949 0.407
324 2HB LEU 38 1HB LEU 38 -10.330 -1.293 -0.141
325 HG LEU 38 HG LEU 38 -8.901 -3.313 0.071
326 1HD1 LEU 38 1HD1 LEU 38 -9.740 -4.355 -1.834
327 2HD1 LEU 38 2HD1 LEU 38 -9.579 -2.901 -2.818
328 3HD1 LEU 38 3HD1 LEU 38 -10.838 -2.997 -1.587
329 1HD2 LEU 38 1HD2 LEU 38 -6.926 -1.814 -1.002
330 2HD2 LEU 38 2HD2 LEU 38 -7.462 -2.709 -2.424
331 3HD2 LEU 38 3HD2 LEU 38 -6.930 -3.577 -0.985
332 H VAL 39 H VAL 39 -11.012 -1.309 -2.864
333 HA VAL 39 HA VAL 39 -12.513 0.947 -3.600
334 HB VAL 39 HB VAL 39 -14.346 -0.665 -4.088
335 1HG1 VAL 39 1HG1 VAL 39 -12.682 -2.176 -5.563
336 2HG1 VAL 39 2HG1 VAL 39 -11.593 -0.859 -5.125
337 3HG1 VAL 39 3HG1 VAL 39 -13.104 -0.512 -5.965
338 1HG2 VAL 39 1HG2 VAL 39 -12.620 -2.403 -2.448
339 2HG2 VAL 39 2HG2 VAL 39 -13.306 -3.144 -3.894
340 3HG2 VAL 39 3HG2 VAL 39 -14.368 -2.430 -2.681
341 H ASP 40 H ASP 40 -14.712 1.478 -2.933
342 HA ASP 40 HA ASP 40 -15.237 0.897 -0.096
343 1HB ASP 40 2HB ASP 40 -16.040 3.237 0.158
344 2HB ASP 40 1HB ASP 40 -14.321 3.141 -0.215
345 H THR 41 H THR 41 -17.263 0.294 0.366
346 HA THR 41 HA THR 41 -19.119 -0.121 -1.779
347 HB THR 41 HB THR 41 -19.059 -1.823 -0.140
348 HG1 THR 41 1HG THR 41 -21.197 -1.108 -0.820
349 1HG2 THR 41 1HG2 THR 41 -18.108 -0.859 1.767
350 2HG2 THR 41 2HG2 THR 41 -19.738 -1.330 2.248
351 3HG2 THR 41 3HG2 THR 41 -19.378 0.359 1.889
352 HA PRO 42 HA PRO 42 -20.928 3.977 -1.174
353 1HB PRO 42 2HB PRO 42 -22.671 3.180 -3.398
354 2HB PRO 42 1HB PRO 42 -21.537 4.527 -3.294
355 1HG PRO 42 2HG PRO 42 -21.065 2.386 -4.855
356 2HG PRO 42 1HG PRO 42 -19.760 3.263 -4.036
357 1HD PRO 42 2HD PRO 42 -21.072 0.678 -3.280
358 2HD PRO 42 1HD PRO 42 -19.353 1.124 -3.236
359 H GLU 43 H GLU 43 -23.086 4.795 -0.723
360 HA GLU 43 HA GLU 43 -24.749 2.749 0.555
361 1HB GLU 43 2HB GLU 43 -23.883 4.822 1.789
362 2HB GLU 43 1HB GLU 43 -25.055 5.732 0.846
363 1HG GLU 43 2HG GLU 43 -26.627 3.767 1.822
364 2HG GLU 43 1HG GLU 43 -25.448 3.923 3.125
365 H THR 44 H THR 44 -24.851 2.948 -2.262
366 HA THR 44 HA THR 44 -27.439 4.242 -2.763
367 HB THR 44 HB THR 44 -26.882 3.932 -5.167
368 HG1 THR 44 1HG THR 44 -24.725 3.312 -5.648
369 1HG2 THR 44 1HG2 THR 44 -25.368 5.614 -3.338
370 2HG2 THR 44 2HG2 THR 44 -26.154 6.010 -4.865
371 3HG2 THR 44 3HG2 THR 44 -24.540 5.298 -4.861
372 H LYS 45 H LYS 45 -29.031 2.866 -2.246
373 HA LYS 45 HA LYS 45 -30.410 1.063 -2.312
374 1HB LYS 45 2HB LYS 45 -28.881 0.800 -4.862
375 2HB LYS 45 1HB LYS 45 -29.903 -0.537 -4.356
376 1HG LYS 45 2HG LYS 45 -31.773 0.534 -4.926
377 2HG LYS 45 1HG LYS 45 -31.239 2.045 -4.186
378 1HD LYS 45 2HD LYS 45 -31.230 2.726 -6.352
379 2HD LYS 45 1HD LYS 45 -29.613 2.020 -6.306
380 1HE LYS 45 2HE LYS 45 -31.958 0.313 -7.023
381 2HE LYS 45 1HE LYS 45 -31.266 1.398 -8.229
382 1HZ LYS 45 1HZ LYS 45 -29.175 0.315 -8.047
383 2HZ LYS 45 2HZ LYS 45 -30.342 -0.893 -8.246
384 3HZ LYS 45 3HZ LYS 45 -29.681 -0.601 -6.716
385 H HIS 46 H HIS 46 -27.652 -0.651 -3.726
386 HA HIS 46 HA HIS 46 -27.461 -2.222 -1.240
387 1HB HIS 46 2HB HIS 46 -28.220 -3.138 -3.762
388 2HB HIS 46 1HB HIS 46 -26.540 -3.643 -3.602
389 HD1 HIS 46 1HD HIS 46 -26.116 -5.691 -2.243
390 HD2 HIS 46 2HD HIS 46 -29.908 -4.124 -1.591
391 HE1 HIS 46 1HE HIS 46 -27.293 -7.368 -0.786
392 HE2 HIS 46 2HE HIS 46 -29.556 -6.356 -0.332
393 HA PRO 47 HA PRO 47 -23.174 -1.127 -1.227
394 1HB PRO 47 2HB PRO 47 -22.179 -3.070 0.354
395 2HB PRO 47 1HB PRO 47 -23.213 -1.783 0.985
396 1HG PRO 47 2HG PRO 47 -23.924 -4.599 0.260
397 2HG PRO 47 1HG PRO 47 -24.422 -3.648 1.671
398 1HD PRO 47 2HD PRO 47 -26.001 -4.008 -0.520
399 2HD PRO 47 1HD PRO 47 -26.082 -2.565 0.511
400 H LYS 48 H LYS 48 -21.718 -1.393 -2.793
401 HA LYS 48 HA LYS 48 -21.197 -4.121 -3.781
402 1HB LYS 48 2HB LYS 48 -22.518 -2.632 -5.356
403 2HB LYS 48 1HB LYS 48 -21.075 -1.635 -5.485
404 1HG LYS 48 2HG LYS 48 -20.245 -2.974 -7.035
405 2HG LYS 48 1HG LYS 48 -20.356 -4.355 -5.941
406 1HD LYS 48 2HD LYS 48 -22.566 -4.853 -6.660
407 2HD LYS 48 1HD LYS 48 -22.698 -3.323 -7.529
408 1HE LYS 48 2HE LYS 48 -22.318 -4.971 -9.175
409 2HE LYS 48 1HE LYS 48 -20.782 -4.128 -8.969
410 1HZ LYS 48 1HZ LYS 48 -21.358 -6.602 -7.468
411 2HZ LYS 48 2HZ LYS 48 -19.860 -5.917 -7.847
412 3HZ LYS 48 3HZ LYS 48 -20.772 -6.671 -9.054
413 H LYS 49 H LYS 49 -19.222 -4.699 -3.187
414 HA LYS 49 HA LYS 49 -16.982 -4.677 -2.802
415 1HB LYS 49 2HB LYS 49 -17.268 -2.532 -4.874
416 2HB LYS 49 1HB LYS 49 -15.708 -2.804 -4.110
417 1HG LYS 49 2HG LYS 49 -15.361 -4.318 -5.699
418 2HG LYS 49 1HG LYS 49 -16.500 -5.340 -4.819
419 1HD LYS 49 2HD LYS 49 -17.496 -5.377 -6.869
420 2HD LYS 49 1HD LYS 49 -18.258 -3.924 -6.218
421 1HE LYS 49 2HE LYS 49 -16.129 -2.767 -7.269
422 2HE LYS 49 1HE LYS 49 -16.142 -4.203 -8.292
423 1HZ LYS 49 1HZ LYS 49 -18.357 -3.687 -9.000
424 2HZ LYS 49 2HZ LYS 49 -17.393 -2.316 -9.229
425 3HZ LYS 49 3HZ LYS 49 -18.462 -2.388 -7.921
426 H GLY 50 H GLY 50 -16.206 -4.158 -0.872
427 1HA GLY 50 2HA GLY 50 -15.215 -1.806 0.003
428 2HA GLY 50 1HA GLY 50 -16.923 -1.651 0.380
429 H VAL 51 H VAL 51 -14.131 -2.260 1.795
430 HA VAL 51 HA VAL 51 -15.186 -4.372 3.557
431 HB VAL 51 HB VAL 51 -12.312 -3.471 3.308
432 1HG1 VAL 51 1HG1 VAL 51 -13.749 -5.416 5.000
433 2HG1 VAL 51 2HG1 VAL 51 -12.273 -4.503 5.317
434 3HG1 VAL 51 3HG1 VAL 51 -12.214 -5.959 4.322
435 1HG2 VAL 51 1HG2 VAL 51 -13.670 -4.801 1.367
436 2HG2 VAL 51 2HG2 VAL 51 -13.053 -6.140 2.333
437 3HG2 VAL 51 3HG2 VAL 51 -11.938 -4.952 1.658
438 H GLU 52 H GLU 52 -16.220 -3.430 5.210
439 HA GLU 52 HA GLU 52 -15.174 -0.968 6.374
440 1HB GLU 52 2HB GLU 52 -17.767 -2.432 6.485
441 2HB GLU 52 1HB GLU 52 -17.339 -1.418 7.857
442 1HG GLU 52 2HG GLU 52 -16.857 0.348 5.963
443 2HG GLU 52 1HG GLU 52 -17.989 -0.660 5.062
444 H LYS 53 H LYS 53 -15.605 -0.960 8.921
445 HA LYS 53 HA LYS 53 -13.609 -2.604 10.036
446 1HB LYS 53 2HB LYS 53 -15.135 -0.378 10.850
447 2HB LYS 53 1HB LYS 53 -15.427 -1.628 12.051
448 1HG LYS 53 2HG LYS 53 -13.403 -1.391 12.938
449 2HG LYS 53 1HG LYS 53 -12.618 -1.408 11.357
450 1HD LYS 53 2HD LYS 53 -14.006 0.977 12.581
451 2HD LYS 53 1HD LYS 53 -12.262 0.708 12.582
452 1HE LYS 53 2HE LYS 53 -14.066 1.188 10.223
453 2HE LYS 53 1HE LYS 53 -12.725 2.186 10.785
454 1HZ LYS 53 1HZ LYS 53 -11.472 -0.114 10.341
455 2HZ LYS 53 2HZ LYS 53 -11.634 1.095 9.168
456 3HZ LYS 53 3HZ LYS 53 -12.690 -0.228 9.171
457 H TYR 54 H TYR 54 -14.083 -4.763 9.648
458 HA TYR 54 HA TYR 54 -16.570 -5.872 10.667
459 1HB TYR 54 2HB TYR 54 -14.263 -7.041 9.115
460 2HB TYR 54 1HB TYR 54 -15.554 -8.042 9.772
461 HD1 TYR 54 1HD TYR 54 -14.470 -6.576 6.874
462 HD2 TYR 54 2HD TYR 54 -18.004 -6.911 9.218
463 HE1 TYR 54 1HE TYR 54 -15.831 -6.121 4.877
464 HE2 TYR 54 2HE TYR 54 -19.375 -6.459 7.229
465 HH TYR 54 HH TYR 54 -18.065 -6.452 4.057
466 H GLY 55 H GLY 55 -13.155 -5.790 11.452
467 1HA GLY 55 2HA GLY 55 -13.252 -6.105 14.113
468 2HA GLY 55 1HA GLY 55 -13.444 -7.763 13.564
469 HA PRO 56 HA PRO 56 -8.912 -7.162 14.203
470 1HB PRO 56 2HB PRO 56 -9.108 -10.113 14.375
471 2HB PRO 56 1HB PRO 56 -8.313 -8.973 15.464
472 1HG PRO 56 2HG PRO 56 -10.597 -10.166 16.155
473 2HG PRO 56 1HG PRO 56 -10.272 -8.478 16.594
474 1HD PRO 56 2HD PRO 56 -12.006 -9.573 14.414
475 2HD PRO 56 1HD PRO 56 -12.288 -8.189 15.491
476 H GLU 57 H GLU 57 -10.822 -8.940 11.944
477 HA GLU 57 HA GLU 57 -9.044 -10.290 10.375
478 1HB GLU 57 2HB GLU 57 -11.389 -8.600 9.501
479 2HB GLU 57 1HB GLU 57 -10.542 -9.721 8.446
480 1HG GLU 57 2HG GLU 57 -11.335 -11.580 9.562
481 2HG GLU 57 1HG GLU 57 -11.681 -10.675 11.035
482 H ALA 58 H ALA 58 -9.388 -6.833 10.674
483 HA ALA 58 HA ALA 58 -7.835 -6.205 8.344
484 1HB ALA 58 1HB ALA 58 -7.780 -3.896 9.548
485 2HB ALA 58 2HB ALA 58 -8.988 -4.629 10.602
486 3HB ALA 58 3HB ALA 58 -9.293 -4.498 8.869
487 H SER 59 H SER 59 -7.229 -5.960 11.849
488 HA SER 59 HA SER 59 -4.490 -5.274 11.548
489 1HB SER 59 2HB SER 59 -4.381 -5.850 14.015
490 2HB SER 59 1HB SER 59 -5.576 -4.630 13.576
491 HG SER 59 HG SER 59 -6.526 -6.126 14.949
492 H ALA 60 H ALA 60 -6.202 -8.282 11.593
493 HA ALA 60 HA ALA 60 -4.267 -10.059 12.467
494 1HB ALA 60 1HB ALA 60 -5.658 -11.683 11.745
495 2HB ALA 60 2HB ALA 60 -5.875 -10.941 10.159
496 3HB ALA 60 3HB ALA 60 -6.773 -10.331 11.547
497 H PHE 61 H PHE 61 -4.375 -8.230 9.535
498 HA PHE 61 HA PHE 61 -2.847 -9.779 7.814
499 1HB PHE 61 2HB PHE 61 -3.215 -6.821 8.137
500 2HB PHE 61 1HB PHE 61 -2.043 -7.435 6.976
501 HD1 PHE 61 1HD PHE 61 -5.596 -7.970 7.977
502 HD2 PHE 61 2HD PHE 61 -2.747 -7.789 4.823
503 HE1 PHE 61 1HE PHE 61 -7.401 -8.292 6.335
504 HE2 PHE 61 2HE PHE 61 -4.545 -8.108 3.173
505 HZ PHE 61 HZ PHE 61 -6.876 -8.360 3.929
506 H THR 62 H THR 62 -1.864 -7.860 10.563
507 HA THR 62 HA THR 62 0.941 -7.969 9.934
508 HB THR 62 HB THR 62 -0.040 -6.111 11.232
509 HG1 THR 62 1HG THR 62 1.820 -7.588 12.774
510 1HG2 THR 62 1HG2 THR 62 -1.402 -6.454 12.932
511 2HG2 THR 62 2HG2 THR 62 -0.076 -7.200 13.825
512 3HG2 THR 62 3HG2 THR 62 -1.137 -8.194 12.827
513 H LYS 63 H LYS 63 -1.299 -10.086 11.407
514 HA LYS 63 HA LYS 63 0.710 -11.488 12.967
515 1HB LYS 63 2HB LYS 63 -2.024 -11.148 13.236
516 2HB LYS 63 1HB LYS 63 -1.874 -12.814 12.695
517 1HG LYS 63 2HG LYS 63 -1.890 -12.735 15.099
518 2HG LYS 63 1HG LYS 63 -0.297 -13.244 14.536
519 1HD LYS 63 2HD LYS 63 0.713 -11.431 15.396
520 2HD LYS 63 1HD LYS 63 -0.576 -10.347 14.866
521 1HE LYS 63 2HE LYS 63 -1.891 -11.603 16.805
522 2HE LYS 63 1HE LYS 63 -0.253 -11.821 17.422
523 1HZ LYS 63 1HZ LYS 63 -1.418 -9.198 16.661
524 2HZ LYS 63 2HZ LYS 63 0.075 -9.465 17.410
525 3HZ LYS 63 3HZ LYS 63 -1.358 -9.792 18.245
526 H LYS 64 H LYS 64 -1.581 -12.369 10.378
527 HA LYS 64 HA LYS 64 -0.028 -14.748 9.782
528 1HB LYS 64 2HB LYS 64 -2.464 -13.784 8.295
529 2HB LYS 64 1HB LYS 64 -1.833 -15.422 8.399
530 1HG LYS 64 2HG LYS 64 -2.654 -15.745 10.536
531 2HG LYS 64 1HG LYS 64 -2.767 -14.015 10.862
532 1HD LYS 64 2HD LYS 64 -4.491 -15.540 8.913
533 2HD LYS 64 1HD LYS 64 -4.976 -15.047 10.536
534 1HE LYS 64 2HE LYS 64 -5.807 -13.249 9.462
535 2HE LYS 64 1HE LYS 64 -4.138 -12.684 9.542
536 1HZ LYS 64 1HZ LYS 64 -4.147 -14.172 7.293
537 2HZ LYS 64 2HZ LYS 64 -4.335 -12.492 7.339
538 3HZ LYS 64 3HZ LYS 64 -5.696 -13.492 7.258
539 H MET 65 H MET 65 -1.304 -12.027 7.875
540 HA MET 65 HA MET 65 0.118 -12.515 5.552
541 1HB MET 65 2HB MET 65 -1.664 -10.592 6.428
542 2HB MET 65 1HB MET 65 -0.206 -9.669 6.087
543 1HG MET 65 2HG MET 65 -1.312 -9.610 4.073
544 2HG MET 65 1HG MET 65 -0.198 -10.957 3.849
545 1HE MET 65 1HE MET 65 -2.402 -10.533 1.933
546 2HE MET 65 2HE MET 65 -3.708 -9.960 2.969
547 3HE MET 65 3HE MET 65 -3.874 -11.490 2.108
548 H TRP 66 H TRP 66 1.276 -11.293 8.556
549 HA TRP 66 HA TRP 66 3.683 -10.237 7.294
550 1HB TRP 66 2HB TRP 66 2.181 -9.446 9.538
551 2HB TRP 66 1HB TRP 66 3.733 -10.003 10.155
552 HD1 TRP 66 HD TRP 66 2.649 -7.742 7.173
553 HE1 TRP 66 1HE TRP 66 4.201 -5.688 7.143
554 HE3 TRP 66 3HE TRP 66 5.595 -8.894 11.192
555 HZ2 TRP 66 2HZ TRP 66 6.385 -4.693 8.626
556 HZ3 TRP 66 3HZ TRP 66 7.394 -7.336 11.819
557 HH2 TRP 66 HH TRP 66 7.779 -5.278 10.563
558 H GLU 67 H GLU 67 2.632 -12.823 9.439
559 HA GLU 67 HA GLU 67 5.396 -13.683 9.822
560 1HB GLU 67 2HB GLU 67 2.805 -14.710 10.975
561 2HB GLU 67 1HB GLU 67 4.376 -15.424 11.305
562 1HG GLU 67 2HG GLU 67 4.813 -12.794 11.888
563 2HG GLU 67 1HG GLU 67 3.139 -13.016 12.393
564 H ASN 68 H ASN 68 2.340 -15.200 8.734
565 HA ASN 68 HA ASN 68 3.782 -17.414 7.579
566 1HB ASN 68 2HB ASN 68 0.958 -16.693 8.030
567 2HB ASN 68 1HB ASN 68 1.257 -17.666 6.592
568 1HD2 ASN 68 1HD2 ASN 68 3.223 -19.323 7.304
569 2HD2 ASN 68 2HD2 ASN 68 2.739 -20.332 8.620
570 H ALA 69 H ALA 69 2.443 -14.404 6.485
571 HA ALA 69 HA ALA 69 3.096 -15.100 3.704
572 1HB ALA 69 1HB ALA 69 0.751 -14.127 4.603
573 2HB ALA 69 2HB ALA 69 1.367 -13.857 2.972
574 3HB ALA 69 3HB ALA 69 1.587 -12.624 4.213
575 H LYS 70 H LYS 70 4.249 -13.563 2.420
576 HA LYS 70 HA LYS 70 6.504 -12.485 3.598
577 1HB LYS 70 2HB LYS 70 5.176 -12.230 0.973
578 2HB LYS 70 1HB LYS 70 6.266 -10.915 1.388
579 1HG LYS 70 2HG LYS 70 7.387 -12.664 0.104
580 2HG LYS 70 1HG LYS 70 8.083 -12.487 1.715
581 1HD LYS 70 2HD LYS 70 6.245 -14.374 2.227
582 2HD LYS 70 1HD LYS 70 6.570 -14.735 0.531
583 1HE LYS 70 2HE LYS 70 8.954 -14.265 2.183
584 2HE LYS 70 1HE LYS 70 8.016 -15.693 2.621
585 1HZ LYS 70 1HZ LYS 70 9.310 -15.076 0.033
586 2HZ LYS 70 2HZ LYS 70 8.105 -16.255 0.167
587 3HZ LYS 70 3HZ LYS 70 9.547 -16.421 1.034
588 H LYS 71 H LYS 71 7.160 -10.161 3.671
589 HA LYS 71 HA LYS 71 5.163 -8.694 5.159
590 1HB LYS 71 2HB LYS 71 7.918 -8.923 5.309
591 2HB LYS 71 1HB LYS 71 7.676 -7.300 4.676
592 1HG LYS 71 2HG LYS 71 6.621 -6.567 6.575
593 2HG LYS 71 1HG LYS 71 6.086 -8.187 7.034
594 1HD LYS 71 2HD LYS 71 9.010 -7.678 6.954
595 2HD LYS 71 1HD LYS 71 8.093 -6.941 8.268
596 1HE LYS 71 2HE LYS 71 8.622 -8.953 9.220
597 2HE LYS 71 1HE LYS 71 7.077 -9.358 8.473
598 1HZ LYS 71 1HZ LYS 71 9.234 -10.822 8.133
599 2HZ LYS 71 2HZ LYS 71 9.476 -9.739 6.857
600 3HZ LYS 71 3HZ LYS 71 8.060 -10.660 6.926
601 H ILE 72 H ILE 72 4.831 -6.376 4.816
602 HA ILE 72 HA ILE 72 4.522 -5.822 1.956
603 HB ILE 72 HB ILE 72 2.881 -4.107 2.670
604 1HG1 ILE 72 2HG1 ILE 72 2.360 -5.067 5.314
605 2HG1 ILE 72 1HG1 ILE 72 4.053 -4.593 5.221
606 1HG2 ILE 72 1HG2 ILE 72 1.759 -5.987 2.053
607 2HG2 ILE 72 2HG2 ILE 72 1.289 -5.934 3.752
608 3HG2 ILE 72 3HG2 ILE 72 2.589 -7.005 3.231
609 1HD1 ILE 72 1HD1 ILE 72 1.633 -2.955 5.191
610 2HD1 ILE 72 2HD1 ILE 72 2.846 -2.497 3.995
611 3HD1 ILE 72 3HD1 ILE 72 3.273 -2.559 5.705
612 H GLU 73 H GLU 73 5.161 -3.922 1.033
613 HA GLU 73 HA GLU 73 6.826 -2.127 2.655
614 1HB GLU 73 2HB GLU 73 7.420 -3.094 -0.148
615 2HB GLU 73 1HB GLU 73 8.368 -1.913 0.745
616 1HG GLU 73 2HG GLU 73 8.586 -3.798 2.509
617 2HG GLU 73 1HG GLU 73 8.118 -4.855 1.177
618 H VAL 74 H VAL 74 7.366 -0.095 1.142
619 HA VAL 74 HA VAL 74 4.766 0.812 0.093
620 HB VAL 74 HB VAL 74 5.478 2.036 2.094
621 1HG1 VAL 74 1HG1 VAL 74 7.742 2.104 2.273
622 2HG1 VAL 74 2HG1 VAL 74 7.482 3.690 1.548
623 3HG1 VAL 74 3HG1 VAL 74 7.987 2.334 0.541
624 1HG2 VAL 74 1HG2 VAL 74 5.572 4.372 0.952
625 2HG2 VAL 74 2HG2 VAL 74 4.134 3.368 0.769
626 3HG2 VAL 74 3HG2 VAL 74 5.321 3.455 -0.532
627 H GLU 75 H GLU 75 4.654 1.814 -1.877
628 HA GLU 75 HA GLU 75 7.096 1.687 -3.509
629 1HB GLU 75 2HB GLU 75 4.848 0.415 -4.050
630 2HB GLU 75 1HB GLU 75 4.376 1.975 -4.711
631 1HG GLU 75 2HG GLU 75 5.258 1.051 -6.578
632 2HG GLU 75 1HG GLU 75 6.725 1.767 -5.909
633 H PHE 76 H PHE 76 4.073 3.582 -3.580
634 HA PHE 76 HA PHE 76 5.646 6.042 -3.631
635 1HB PHE 76 2HB PHE 76 4.367 6.907 -5.559
636 2HB PHE 76 1HB PHE 76 5.338 5.502 -5.983
637 HD1 PHE 76 1HD PHE 76 2.031 6.904 -5.823
638 HD2 PHE 76 2HD PHE 76 4.223 3.278 -6.225
639 HE1 PHE 76 1HE PHE 76 0.026 5.795 -6.718
640 HE2 PHE 76 2HE PHE 76 2.222 2.163 -7.122
641 HZ PHE 76 HZ PHE 76 0.119 3.421 -7.370
642 H ASP 77 H ASP 77 4.770 7.581 -2.401
643 HA ASP 77 HA ASP 77 2.108 7.111 -1.291
644 1HB ASP 77 2HB ASP 77 4.554 8.484 -0.393
645 2HB ASP 77 1HB ASP 77 3.056 9.319 0.012
646 H LYS 78 H LYS 78 0.591 8.887 -1.075
647 HA LYS 78 HA LYS 78 0.069 10.189 -3.492
648 1HB LYS 78 2HB LYS 78 -1.435 9.669 -1.373
649 2HB LYS 78 1HB LYS 78 -1.006 11.320 -0.949
650 1HG LYS 78 2HG LYS 78 -2.819 11.853 -2.144
651 2HG LYS 78 1HG LYS 78 -1.753 11.634 -3.533
652 1HD LYS 78 2HD LYS 78 -2.895 9.123 -2.621
653 2HD LYS 78 1HD LYS 78 -4.136 10.301 -3.052
654 1HE LYS 78 2HE LYS 78 -1.839 9.982 -4.903
655 2HE LYS 78 1HE LYS 78 -3.026 8.679 -4.844
656 1HZ LYS 78 1HZ LYS 78 -4.604 9.951 -5.796
657 2HZ LYS 78 2HZ LYS 78 -3.276 10.800 -6.410
658 3HZ LYS 78 3HZ LYS 78 -4.089 11.378 -5.043
659 H GLY 79 H GLY 79 1.365 11.496 -0.445
660 1HA GLY 79 2HA GLY 79 2.664 13.343 -0.034
661 2HA GLY 79 1HA GLY 79 3.117 13.294 -1.731
662 H GLN 80 H GLN 80 -0.187 13.647 -0.610
663 HA GLN 80 HA GLN 80 -0.254 16.294 -1.873
664 1HB GLN 80 2HB GLN 80 -2.656 15.998 -2.038
665 2HB GLN 80 1HB GLN 80 -1.839 14.593 -2.707
666 1HG GLN 80 2HG GLN 80 -2.362 13.272 -0.816
667 2HG GLN 80 1HG GLN 80 -2.901 14.679 0.099
668 1HE2 GLN 80 1HE2 GLN 80 -4.570 15.973 -1.483
669 2HE2 GLN 80 2HE2 GLN 80 -5.908 14.985 -1.951
670 H ARG 81 H ARG 81 0.418 15.292 1.066
671 HA ARG 81 HA ARG 81 0.205 16.100 3.182
672 1HB ARG 81 2HB ARG 81 -0.701 18.639 1.822
673 2HB ARG 81 1HB ARG 81 0.018 18.492 3.419
674 1HG ARG 81 2HG ARG 81 2.137 17.944 2.516
675 2HG ARG 81 1HG ARG 81 1.463 17.721 0.899
676 1HD ARG 81 2HD ARG 81 1.063 20.361 2.176
677 2HD ARG 81 1HD ARG 81 2.701 19.963 1.660
678 HE ARG 81 HE ARG 81 1.288 19.366 -0.529
679 1HH1 ARG 81 1HH1 ARG 81 1.243 22.187 1.533
680 2HH1 ARG 81 2HH1 ARG 81 0.779 23.263 0.259
681 1HH2 ARG 81 1HH2 ARG 81 0.678 20.784 -2.202
682 2HH2 ARG 81 2HH2 ARG 81 0.457 22.467 -1.860
683 H THR 82 H THR 82 -1.466 14.892 4.015
684 HA THR 82 HA THR 82 -4.189 15.275 3.435
685 HB THR 82 HB THR 82 -2.975 14.129 5.957
686 HG1 THR 82 1HG THR 82 -3.369 12.126 4.772
687 1HG2 THR 82 1HG2 THR 82 -5.332 14.502 6.260
688 2HG2 THR 82 2HG2 THR 82 -5.028 12.777 6.052
689 3HG2 THR 82 3HG2 THR 82 -5.686 13.723 4.718
690 H ASP 83 H ASP 83 -5.841 16.282 4.614
691 HA ASP 83 HA ASP 83 -4.912 18.455 6.376
692 1HB ASP 83 2HB ASP 83 -7.289 18.404 4.506
693 2HB ASP 83 1HB ASP 83 -6.902 19.723 5.607
694 H LYS 84 H LYS 84 -7.480 16.101 5.801
695 HA LYS 84 HA LYS 84 -9.257 16.638 7.793
696 1HB LYS 84 2HB LYS 84 -8.432 14.250 6.332
697 2HB LYS 84 1HB LYS 84 -9.061 13.881 7.932
698 1HG LYS 84 2HG LYS 84 -10.526 15.629 5.978
699 2HG LYS 84 1HG LYS 84 -10.727 13.877 6.042
700 1HD LYS 84 2HD LYS 84 -12.377 14.385 7.496
701 2HD LYS 84 1HD LYS 84 -11.048 14.501 8.649
702 1HE LYS 84 2HE LYS 84 -11.060 16.808 8.634
703 2HE LYS 84 1HE LYS 84 -11.812 16.897 7.042
704 1HZ LYS 84 1HZ LYS 84 -13.526 17.488 8.433
705 2HZ LYS 84 2HZ LYS 84 -13.065 16.421 9.661
706 3HZ LYS 84 3HZ LYS 84 -13.809 15.828 8.262
707 H TYR 85 H TYR 85 -6.562 14.337 8.222
708 HA TYR 85 HA TYR 85 -6.433 15.170 11.044
709 1HB TYR 85 2HB TYR 85 -7.265 12.673 10.133
710 2HB TYR 85 1HB TYR 85 -5.593 12.416 10.620
711 HD1 TYR 85 1HD TYR 85 -8.936 12.546 11.730
712 HD2 TYR 85 2HD TYR 85 -4.955 13.373 12.981
713 HE1 TYR 85 1HE TYR 85 -9.652 12.410 14.078
714 HE2 TYR 85 2HE TYR 85 -5.660 13.239 15.333
715 HH TYR 85 HH TYR 85 -8.964 13.140 16.259
716 H GLY 86 H GLY 86 -4.720 13.947 8.220
717 1HA GLY 86 2HA GLY 86 -2.539 14.894 7.727
718 2HA GLY 86 1HA GLY 86 -2.210 14.886 9.454
719 H ARG 87 H ARG 87 -3.480 12.414 7.238
720 HA ARG 87 HA ARG 87 -1.171 10.725 7.930
721 1HB ARG 87 2HB ARG 87 -3.942 9.591 7.636
722 2HB ARG 87 1HB ARG 87 -2.518 8.829 8.328
723 1HG ARG 87 2HG ARG 87 -2.779 9.843 10.343
724 2HG ARG 87 1HG ARG 87 -3.534 11.279 9.652
725 1HD ARG 87 2HD ARG 87 -4.839 8.572 9.909
726 2HD ARG 87 1HD ARG 87 -5.106 9.937 10.988
727 HE ARG 87 HE ARG 87 -6.293 11.032 9.288
728 1HH1 ARG 87 1HH1 ARG 87 -5.158 7.890 8.254
729 2HH1 ARG 87 2HH1 ARG 87 -6.234 7.815 6.901
730 1HH2 ARG 87 1HH2 ARG 87 -7.699 10.926 7.505
731 2HH2 ARG 87 2HH2 ARG 87 -7.672 9.535 6.474
732 H GLY 88 H GLY 88 -0.119 10.746 6.017
733 1HA GLY 88 2HA GLY 88 -1.125 10.980 3.470
734 2HA GLY 88 1HA GLY 88 0.350 10.106 3.855
735 H LEU 89 H LEU 89 -1.018 9.228 1.729
736 HA LEU 89 HA LEU 89 -2.530 6.896 2.699
737 1HB LEU 89 2HB LEU 89 -2.563 8.139 -0.051
738 2HB LEU 89 1HB LEU 89 -3.545 6.789 0.485
739 HG LEU 89 HG LEU 89 -4.198 8.714 2.321
740 1HD1 LEU 89 1HD1 LEU 89 -2.807 10.248 0.724
741 2HD1 LEU 89 2HD1 LEU 89 -4.340 10.809 1.392
742 3HD1 LEU 89 3HD1 LEU 89 -4.269 10.202 -0.260
743 1HD2 LEU 89 1HD2 LEU 89 -5.951 7.515 1.457
744 2HD2 LEU 89 2HD2 LEU 89 -5.421 7.731 -0.211
745 3HD2 LEU 89 3HD2 LEU 89 -6.191 9.063 0.650
746 H ALA 90 H ALA 90 -1.335 5.121 2.780
747 HA ALA 90 HA ALA 90 0.499 4.566 0.548
748 1HB ALA 90 1HB ALA 90 1.214 3.486 3.210
749 2HB ALA 90 2HB ALA 90 1.459 5.213 2.951
750 3HB ALA 90 3HB ALA 90 2.249 4.043 1.894
751 H TYR 91 H TYR 91 0.225 2.643 -0.395
752 HA TYR 91 HA TYR 91 -1.694 0.793 0.817
753 1HB TYR 91 2HB TYR 91 -0.789 0.120 -1.876
754 2HB TYR 91 1HB TYR 91 -2.422 0.332 -1.263
755 HD1 TYR 91 1HD TYR 91 -0.239 1.477 -3.642
756 HD2 TYR 91 2HD TYR 91 -2.876 2.979 -0.663
757 HE1 TYR 91 1HE TYR 91 -0.411 3.596 -4.875
758 HE2 TYR 91 2HE TYR 91 -3.057 5.106 -1.886
759 HH TYR 91 HH TYR 91 -1.113 6.240 -3.903
760 H ILE 92 H ILE 92 -1.286 -1.433 0.974
761 HA ILE 92 HA ILE 92 1.457 -2.077 1.573
762 HB ILE 92 HB ILE 92 0.592 -4.275 2.259
763 1HG1 ILE 92 2HG1 ILE 92 -2.026 -4.354 2.342
764 2HG1 ILE 92 1HG1 ILE 92 -1.920 -3.216 1.005
765 1HG2 ILE 92 1HG2 ILE 92 -0.362 -3.535 4.224
766 2HG2 ILE 92 2HG2 ILE 92 -1.280 -2.261 3.424
767 3HG2 ILE 92 3HG2 ILE 92 0.461 -2.085 3.649
768 1HD1 ILE 92 1HD1 ILE 92 -0.214 -5.558 0.686
769 2HD1 ILE 92 2HD1 ILE 92 -1.340 -4.806 -0.443
770 3HD1 ILE 92 3HD1 ILE 92 -1.935 -5.928 0.781
771 H TYR 93 H TYR 93 2.518 -4.025 0.740
772 HA TYR 93 HA TYR 93 1.642 -4.855 -1.927
773 1HB TYR 93 2HB TYR 93 4.090 -3.316 -1.285
774 2HB TYR 93 1HB TYR 93 4.290 -4.661 -2.402
775 HD1 TYR 93 1HD TYR 93 2.590 -4.741 -4.390
776 HD2 TYR 93 2HD TYR 93 3.432 -1.250 -2.108
777 HE1 TYR 93 1HE TYR 93 1.756 -3.343 -6.232
778 HE2 TYR 93 2HE TYR 93 2.598 0.158 -3.943
779 HH TYR 93 HH TYR 93 0.956 -0.154 -5.906
780 H ALA 94 H ALA 94 3.041 -6.695 -2.751
781 HA ALA 94 HA ALA 94 3.456 -8.564 -0.538
782 1HB ALA 94 1HB ALA 94 2.144 -9.725 -1.969
783 2HB ALA 94 2HB ALA 94 3.695 -10.117 -2.712
784 3HB ALA 94 3HB ALA 94 2.701 -8.824 -3.381
785 H ASP 95 H ASP 95 5.454 -8.700 0.223
786 HA ASP 95 HA ASP 95 7.731 -8.585 0.363
787 1HB ASP 95 2HB ASP 95 8.888 -10.175 -1.044
788 2HB ASP 95 1HB ASP 95 7.321 -10.839 -0.597
789 H GLY 96 H GLY 96 6.727 -6.248 -0.749
790 1HA GLY 96 2HA GLY 96 8.101 -4.411 -1.475
791 2HA GLY 96 1HA GLY 96 8.958 -5.523 -2.530
792 H LYS 97 H LYS 97 7.268 -6.683 -4.100
793 HA LYS 97 HA LYS 97 5.516 -4.593 -5.208
794 1HB LYS 97 2HB LYS 97 7.741 -6.063 -6.486
795 2HB LYS 97 1HB LYS 97 6.275 -5.916 -7.446
796 1HG LYS 97 2HG LYS 97 7.054 -3.409 -6.195
797 2HG LYS 97 1HG LYS 97 8.295 -4.061 -7.267
798 1HD LYS 97 2HD LYS 97 5.584 -4.206 -8.362
799 2HD LYS 97 1HD LYS 97 6.147 -2.561 -8.058
800 1HE LYS 97 2HE LYS 97 8.275 -3.252 -9.287
801 2HE LYS 97 1HE LYS 97 7.366 -4.662 -9.825
802 1HZ LYS 97 1HZ LYS 97 5.652 -2.794 -10.490
803 2HZ LYS 97 2HZ LYS 97 6.913 -3.249 -11.520
804 3HZ LYS 97 3HZ LYS 97 7.058 -1.856 -10.573
805 H MET 98 H MET 98 3.592 -5.265 -6.093
806 HA MET 98 HA MET 98 2.443 -7.622 -5.116
807 1HB MET 98 2HB MET 98 1.633 -5.401 -6.814
808 2HB MET 98 1HB MET 98 0.894 -6.917 -7.313
809 1HG MET 98 2HG MET 98 0.847 -6.045 -4.452
810 2HG MET 98 1HG MET 98 -0.334 -5.441 -5.612
811 1HE MET 98 1HE MET 98 0.513 -8.716 -3.316
812 2HE MET 98 2HE MET 98 -1.219 -8.608 -3.006
813 3HE MET 98 3HE MET 98 -0.212 -7.166 -2.891
814 H VAL 99 H VAL 99 2.056 -9.612 -5.982
815 HA VAL 99 HA VAL 99 3.798 -10.451 -8.120
816 HB VAL 99 HB VAL 99 1.700 -12.158 -6.794
817 1HG1 VAL 99 1HG1 VAL 99 2.571 -13.490 -8.410
818 2HG1 VAL 99 2HG1 VAL 99 3.794 -13.768 -7.170
819 3HG1 VAL 99 3HG1 VAL 99 4.099 -12.613 -8.466
820 1HG2 VAL 99 1HG2 VAL 99 4.183 -11.039 -5.661
821 2HG2 VAL 99 2HG2 VAL 99 3.921 -12.764 -5.401
822 3HG2 VAL 99 3HG2 VAL 99 2.716 -11.596 -4.855
823 H ASN 100 H ASN 100 2.974 -11.815 -9.918
824 HA ASN 100 HA ASN 100 1.293 -10.484 -11.614
825 1HB ASN 100 2HB ASN 100 1.093 -12.585 -12.883
826 2HB ASN 100 1HB ASN 100 2.747 -12.305 -12.348
827 1HD2 ASN 100 1HD2 ASN 100 3.485 -14.338 -12.227
828 2HD2 ASN 100 2HD2 ASN 100 2.828 -15.562 -11.200
829 H GLU 101 H GLU 101 -0.842 -11.178 -12.494
830 HA GLU 101 HA GLU 101 -2.828 -11.036 -10.544
831 1HB GLU 101 2HB GLU 101 -4.408 -11.547 -12.359
832 2HB GLU 101 1HB GLU 101 -3.216 -10.350 -12.847
833 1HG GLU 101 2HG GLU 101 -2.050 -11.907 -14.177
834 2HG GLU 101 1HG GLU 101 -2.921 -13.270 -13.473
835 H ALA 102 H ALA 102 -4.035 -12.500 -9.460
836 HA ALA 102 HA ALA 102 -4.679 -14.481 -8.544
837 1HB ALA 102 1HB ALA 102 -3.870 -15.968 -11.000
838 2HB ALA 102 2HB ALA 102 -5.202 -14.815 -11.085
839 3HB ALA 102 3HB ALA 102 -5.287 -16.179 -9.971
840 H LEU 103 H LEU 103 -3.504 -15.308 -6.957
841 HA LEU 103 HA LEU 103 -0.989 -16.677 -7.627
842 1HB LEU 103 2HB LEU 103 -0.885 -14.279 -6.499
843 2HB LEU 103 1HB LEU 103 -1.191 -15.207 -5.042
844 HG LEU 103 HG LEU 103 1.142 -15.575 -6.924
845 1HD1 LEU 103 1HD1 LEU 103 2.493 -14.664 -5.198
846 2HD1 LEU 103 2HD1 LEU 103 1.143 -14.643 -4.063
847 3HD1 LEU 103 3HD1 LEU 103 1.151 -13.547 -5.445
848 1HD2 LEU 103 1HD2 LEU 103 1.949 -17.110 -5.100
849 2HD2 LEU 103 2HD2 LEU 103 0.595 -17.714 -6.056
850 3HD2 LEU 103 3HD2 LEU 103 0.314 -17.061 -4.441
851 H VAL 104 H VAL 104 -2.958 -16.052 -4.716
852 HA VAL 104 HA VAL 104 -3.455 -18.917 -4.454
853 HB VAL 104 HB VAL 104 -2.861 -18.807 -2.008
854 1HG1 VAL 104 1HG1 VAL 104 -1.358 -20.046 -3.240
855 2HG1 VAL 104 2HG1 VAL 104 -0.310 -18.811 -2.541
856 3HG1 VAL 104 3HG1 VAL 104 -0.853 -18.665 -4.213
857 1HG2 VAL 104 1HG2 VAL 104 -0.931 -16.961 -1.767
858 2HG2 VAL 104 2HG2 VAL 104 -2.606 -16.672 -1.297
859 3HG2 VAL 104 3HG2 VAL 104 -2.019 -16.105 -2.860
860 H ARG 105 H ARG 105 -5.093 -16.586 -5.085
861 HA ARG 105 HA ARG 105 -6.738 -16.216 -2.706
862 1HB ARG 105 2HB ARG 105 -6.367 -14.815 -5.264
863 2HB ARG 105 1HB ARG 105 -8.037 -14.893 -4.721
864 1HG ARG 105 2HG ARG 105 -7.464 -12.995 -3.654
865 2HG ARG 105 1HG ARG 105 -6.876 -14.129 -2.435
866 1HD ARG 105 2HD ARG 105 -4.724 -13.617 -2.823
867 2HD ARG 105 1HD ARG 105 -4.955 -13.544 -4.568
868 HE ARG 105 HE ARG 105 -5.054 -11.284 -4.364
869 1HH1 ARG 105 1HH1 ARG 105 -6.055 -12.676 -1.325
870 2HH1 ARG 105 2HH1 ARG 105 -6.248 -11.143 -0.543
871 1HH2 ARG 105 1HH2 ARG 105 -5.305 -9.268 -3.338
872 2HH2 ARG 105 2HH2 ARG 105 -5.822 -9.207 -1.686
873 H GLN 106 H GLN 106 -9.250 -15.998 -3.622
874 HA GLN 106 HA GLN 106 -9.843 -18.715 -4.588
875 1HB GLN 106 2HB GLN 106 -11.970 -18.537 -3.415
876 2HB GLN 106 1HB GLN 106 -10.635 -18.237 -2.311
877 1HG GLN 106 2HG GLN 106 -11.656 -15.813 -3.553
878 2HG GLN 106 1HG GLN 106 -12.871 -16.678 -2.613
879 1HE2 GLN 106 1HE2 GLN 106 -12.999 -16.047 -0.594
880 2HE2 GLN 106 2HE2 GLN 106 -11.706 -15.436 0.376
881 H GLY 107 H GLY 107 -9.285 -16.364 -6.274
882 1HA GLY 107 2HA GLY 107 -10.603 -16.553 -8.473
883 2HA GLY 107 1HA GLY 107 -11.930 -15.939 -7.499
884 H LEU 108 H LEU 108 -8.521 -15.127 -8.172
885 HA LEU 108 HA LEU 108 -7.482 -13.135 -8.528
886 1HB LEU 108 2HB LEU 108 -10.162 -12.616 -9.798
887 2HB LEU 108 1HB LEU 108 -8.841 -11.465 -9.882
888 HG LEU 108 HG LEU 108 -8.995 -12.816 -11.918
889 1HD1 LEU 108 1HD1 LEU 108 -6.815 -11.969 -11.175
890 2HD1 LEU 108 2HD1 LEU 108 -6.669 -13.497 -12.043
891 3HD1 LEU 108 3HD1 LEU 108 -6.546 -13.467 -10.283
892 1HD2 LEU 108 1HD2 LEU 108 -9.064 -15.077 -11.977
893 2HD2 LEU 108 2HD2 LEU 108 -9.750 -14.862 -10.367
894 3HD2 LEU 108 3HD2 LEU 108 -8.041 -15.257 -10.551
895 H ALA 109 H ALA 109 -7.257 -12.600 -6.329
896 HA ALA 109 HA ALA 109 -7.395 -11.221 -4.525
897 1HB ALA 109 1HB ALA 109 -8.518 -9.617 -6.719
898 2HB ALA 109 2HB ALA 109 -7.245 -9.229 -5.562
899 3HB ALA 109 3HB ALA 109 -8.939 -9.079 -5.094
900 H LYS 110 H LYS 110 -10.597 -10.418 -5.810
901 HA LYS 110 HA LYS 110 -12.688 -10.670 -4.952
902 1HB LYS 110 2HB LYS 110 -11.666 -13.165 -5.103
903 2HB LYS 110 1HB LYS 110 -11.987 -13.076 -3.376
904 1HG LYS 110 2HG LYS 110 -13.957 -13.945 -4.149
905 2HG LYS 110 1HG LYS 110 -14.330 -12.219 -4.152
906 1HD LYS 110 2HD LYS 110 -15.012 -12.665 -6.262
907 2HD LYS 110 1HD LYS 110 -13.296 -12.468 -6.621
908 1HE LYS 110 2HE LYS 110 -13.788 -14.470 -7.666
909 2HE LYS 110 1HE LYS 110 -13.156 -15.006 -6.109
910 1HZ LYS 110 1HZ LYS 110 -15.846 -15.197 -7.184
911 2HZ LYS 110 2HZ LYS 110 -15.747 -14.789 -5.545
912 3HZ LYS 110 3HZ LYS 110 -15.035 -16.217 -6.105
Start of MODEL 12
1 1H ALA 1 1HT ALA 1 9.510 24.946 -5.382
2 2H ALA 1 2HT ALA 1 10.866 24.201 -6.124
3 3H ALA 1 3HT ALA 1 10.767 25.911 -6.031
4 HA ALA 1 HA ALA 1 12.214 25.410 -4.386
5 1HB ALA 1 1HB ALA 1 9.672 25.242 -2.816
6 2HB ALA 1 2HB ALA 1 10.079 26.701 -3.720
7 3HB ALA 1 3HB ALA 1 11.156 26.122 -2.449
8 H THR 2 H THR 2 9.396 23.318 -3.730
9 HA THR 2 HA THR 2 11.260 21.270 -2.738
10 HB THR 2 HB THR 2 9.730 21.804 -1.022
11 HG1 THR 2 1HG THR 2 8.545 19.581 -2.316
12 1HG2 THR 2 1HG2 THR 2 7.535 21.626 -3.067
13 2HG2 THR 2 2HG2 THR 2 8.067 23.062 -2.191
14 3HG2 THR 2 3HG2 THR 2 7.279 21.742 -1.326
15 H SER 3 H SER 3 11.808 20.206 -4.601
16 HA SER 3 HA SER 3 9.880 19.443 -6.570
17 1HB SER 3 2HB SER 3 12.630 18.244 -6.250
18 2HB SER 3 1HB SER 3 11.683 18.420 -7.725
19 HG SER 3 HG SER 3 12.597 20.282 -7.969
20 H THR 4 H THR 4 8.651 17.676 -6.659
21 HA THR 4 HA THR 4 8.498 15.896 -4.459
22 HB THR 4 HB THR 4 6.833 14.685 -5.847
23 HG1 THR 4 1HG THR 4 7.428 16.619 -7.827
24 1HG2 THR 4 1HG2 THR 4 6.507 17.137 -4.753
25 2HG2 THR 4 2HG2 THR 4 5.221 16.190 -5.502
26 3HG2 THR 4 3HG2 THR 4 6.049 17.442 -6.428
27 H LYS 5 H LYS 5 10.168 14.567 -4.068
28 HA LYS 5 HA LYS 5 11.587 13.263 -6.229
29 1HB LYS 5 2HB LYS 5 12.984 12.316 -4.426
30 2HB LYS 5 1HB LYS 5 12.867 14.067 -4.330
31 1HG LYS 5 2HG LYS 5 12.356 13.785 -2.190
32 2HG LYS 5 1HG LYS 5 10.785 13.202 -2.743
33 1HD LYS 5 2HD LYS 5 11.888 10.908 -2.915
34 2HD LYS 5 1HD LYS 5 13.213 11.603 -1.977
35 1HE LYS 5 2HE LYS 5 11.917 10.712 -0.305
36 2HE LYS 5 1HE LYS 5 11.283 12.356 -0.379
37 1HZ LYS 5 1HZ LYS 5 9.337 11.242 -0.482
38 2HZ LYS 5 2HZ LYS 5 10.025 9.844 -1.141
39 3HZ LYS 5 3HZ LYS 5 9.697 11.173 -2.134
40 H LYS 6 H LYS 6 11.883 10.944 -6.326
41 HA LYS 6 HA LYS 6 9.418 9.545 -6.167
42 1HB LYS 6 2HB LYS 6 11.632 9.221 -7.656
43 2HB LYS 6 1HB LYS 6 11.940 8.003 -6.425
44 1HG LYS 6 2HG LYS 6 10.693 6.626 -7.637
45 2HG LYS 6 1HG LYS 6 9.297 7.579 -7.130
46 1HD LYS 6 2HD LYS 6 9.176 8.711 -9.122
47 2HD LYS 6 1HD LYS 6 10.900 8.527 -9.454
48 1HE LYS 6 2HE LYS 6 10.495 6.101 -9.846
49 2HE LYS 6 1HE LYS 6 8.767 6.408 -9.676
50 1HZ LYS 6 1HZ LYS 6 10.577 7.525 -11.749
51 2HZ LYS 6 2HZ LYS 6 8.963 7.992 -11.545
52 3HZ LYS 6 3HZ LYS 6 9.335 6.401 -11.984
53 H LEU 7 H LEU 7 8.663 8.092 -4.720
54 HA LEU 7 HA LEU 7 9.818 8.090 -2.095
55 1HB LEU 7 2HB LEU 7 7.301 7.932 -2.913
56 2HB LEU 7 1HB LEU 7 7.633 6.212 -2.858
57 HG LEU 7 HG LEU 7 6.560 7.109 -0.799
58 1HD1 LEU 7 1HD1 LEU 7 7.583 5.549 0.451
59 2HD1 LEU 7 2HD1 LEU 7 9.188 6.228 0.173
60 3HD1 LEU 7 3HD1 LEU 7 8.446 5.188 -1.045
61 1HD2 LEU 7 1HD2 LEU 7 7.597 8.616 0.617
62 2HD2 LEU 7 2HD2 LEU 7 7.974 9.273 -0.975
63 3HD2 LEU 7 3HD2 LEU 7 9.188 8.346 -0.095
64 H HIS 8 H HIS 8 11.350 6.760 -1.398
65 HA HIS 8 HA HIS 8 12.265 4.554 -2.949
66 1HB HIS 8 2HB HIS 8 13.715 4.121 -0.899
67 2HB HIS 8 1HB HIS 8 13.912 5.687 -1.678
68 HD1 HIS 8 1HD HIS 8 13.310 7.760 -0.328
69 HD2 HIS 8 2HD HIS 8 12.441 4.203 1.636
70 HE1 HIS 8 1HE HIS 8 12.770 8.414 2.039
71 HE2 HIS 8 2HE HIS 8 12.360 6.235 3.234
72 H LYS 9 H LYS 9 12.399 2.330 -2.227
73 HA LYS 9 HA LYS 9 9.912 1.508 -0.935
74 1HB LYS 9 2HB LYS 9 11.851 0.221 -2.799
75 2HB LYS 9 1HB LYS 9 10.913 -0.819 -1.735
76 1HG LYS 9 2HG LYS 9 9.347 1.220 -3.147
77 2HG LYS 9 1HG LYS 9 10.112 0.014 -4.183
78 1HD LYS 9 2HD LYS 9 9.072 -1.486 -2.111
79 2HD LYS 9 1HD LYS 9 7.846 -0.244 -2.372
80 1HE LYS 9 2HE LYS 9 7.273 -2.059 -3.779
81 2HE LYS 9 1HE LYS 9 7.956 -0.814 -4.823
82 1HZ LYS 9 1HZ LYS 9 8.734 -3.167 -5.212
83 2HZ LYS 9 2HZ LYS 9 9.582 -3.045 -3.753
84 3HZ LYS 9 3HZ LYS 9 9.952 -2.004 -5.034
85 H GLU 10 H GLU 10 9.962 1.194 1.180
86 HA GLU 10 HA GLU 10 12.339 -0.090 2.359
87 1HB GLU 10 2HB GLU 10 11.051 2.386 3.049
88 2HB GLU 10 1HB GLU 10 10.920 1.265 4.397
89 1HG GLU 10 2HG GLU 10 13.577 1.192 3.329
90 2HG GLU 10 1HG GLU 10 13.112 2.857 3.676
91 HA PRO 11 HA PRO 11 9.083 -3.021 3.370
92 1HB PRO 11 2HB PRO 11 10.610 -5.178 3.667
93 2HB PRO 11 1HB PRO 11 10.343 -4.468 2.070
94 1HG PRO 11 2HG PRO 11 12.717 -4.243 3.869
95 2HG PRO 11 1HG PRO 11 12.658 -4.416 2.107
96 1HD PRO 11 2HD PRO 11 13.007 -2.019 3.482
97 2HD PRO 11 1HD PRO 11 12.490 -2.168 1.793
98 H ALA 12 H ALA 12 8.246 -2.597 5.333
99 HA ALA 12 HA ALA 12 9.292 -3.934 7.621
100 1HB ALA 12 1HB ALA 12 9.423 -1.773 8.999
101 2HB ALA 12 2HB ALA 12 9.579 -0.950 7.446
102 3HB ALA 12 3HB ALA 12 10.774 -2.151 7.931
103 H THR 13 H THR 13 7.495 -0.892 7.488
104 HA THR 13 HA THR 13 5.461 -0.341 8.370
105 HB THR 13 HB THR 13 3.622 -1.308 7.158
106 HG1 THR 13 1HG THR 13 3.808 -3.225 6.068
107 1HG2 THR 13 1HG2 THR 13 6.019 -0.495 5.814
108 2HG2 THR 13 2HG2 THR 13 4.334 -0.220 5.373
109 3HG2 THR 13 3HG2 THR 13 5.151 -1.696 4.858
110 H LEU 14 H LEU 14 6.939 -2.276 10.057
111 HA LEU 14 HA LEU 14 4.727 -3.830 11.192
112 1HB LEU 14 2HB LEU 14 6.981 -4.878 10.740
113 2HB LEU 14 1HB LEU 14 7.626 -3.868 12.021
114 HG LEU 14 HG LEU 14 5.446 -5.133 13.200
115 1HD1 LEU 14 1HD1 LEU 14 5.256 -7.263 12.507
116 2HD1 LEU 14 2HD1 LEU 14 6.969 -7.401 12.113
117 3HD1 LEU 14 3HD1 LEU 14 5.866 -6.614 10.985
118 1HD2 LEU 14 1HD2 LEU 14 7.488 -6.603 14.097
119 2HD2 LEU 14 2HD2 LEU 14 7.218 -4.933 14.596
120 3HD2 LEU 14 3HD2 LEU 14 8.396 -5.297 13.334
121 H ILE 15 H ILE 15 3.590 -2.066 12.095
122 HA ILE 15 HA ILE 15 4.841 -0.989 14.538
123 HB ILE 15 HB ILE 15 2.779 0.546 12.974
124 1HG1 ILE 15 2HG1 ILE 15 4.743 0.149 11.518
125 2HG1 ILE 15 1HG1 ILE 15 4.571 1.845 11.959
126 1HG2 ILE 15 1HG2 ILE 15 2.851 1.636 14.943
127 2HG2 ILE 15 2HG2 ILE 15 4.313 2.353 14.267
128 3HG2 ILE 15 3HG2 ILE 15 4.431 0.981 15.368
129 1HD1 ILE 15 1HD1 ILE 15 6.253 0.431 13.830
130 2HD1 ILE 15 2HD1 ILE 15 6.583 1.884 12.884
131 3HD1 ILE 15 3HD1 ILE 15 6.847 0.291 12.175
132 H LYS 16 H LYS 16 1.597 -0.956 13.081
133 HA LYS 16 HA LYS 16 0.557 -2.494 15.337
134 1HB LYS 16 2HB LYS 16 0.345 0.230 15.372
135 2HB LYS 16 1HB LYS 16 -1.149 -0.217 14.560
136 1HG LYS 16 2HG LYS 16 -1.386 -1.901 16.540
137 2HG LYS 16 1HG LYS 16 -0.251 -0.810 17.339
138 1HD LYS 16 2HD LYS 16 -2.607 0.380 15.969
139 2HD LYS 16 1HD LYS 16 -2.875 -0.464 17.495
140 1HE LYS 16 2HE LYS 16 -0.629 1.130 17.934
141 2HE LYS 16 1HE LYS 16 -1.729 2.143 17.003
142 1HZ LYS 16 1HZ LYS 16 -3.437 1.802 18.619
143 2HZ LYS 16 2HZ LYS 16 -2.042 2.301 19.435
144 3HZ LYS 16 3HZ LYS 16 -2.500 0.672 19.464
145 H ALA 17 H ALA 17 -1.896 -2.932 14.903
146 HA ALA 17 HA ALA 17 -2.226 -3.450 12.019
147 1HB ALA 17 1HB ALA 17 -3.567 -5.286 13.894
148 2HB ALA 17 2HB ALA 17 -1.807 -5.390 13.834
149 3HB ALA 17 3HB ALA 17 -2.755 -5.615 12.364
150 H ILE 18 H ILE 18 -4.185 -3.074 11.107
151 HA ILE 18 HA ILE 18 -6.612 -2.778 12.508
152 HB ILE 18 HB ILE 18 -5.462 -0.706 13.298
153 1HG1 ILE 18 2HG1 ILE 18 -7.729 0.183 11.564
154 2HG1 ILE 18 1HG1 ILE 18 -8.031 -1.048 12.786
155 1HG2 ILE 18 1HG2 ILE 18 -5.566 0.017 10.376
156 2HG2 ILE 18 2HG2 ILE 18 -4.135 -0.138 11.396
157 3HG2 ILE 18 3HG2 ILE 18 -5.278 1.176 11.675
158 1HD1 ILE 18 1HD1 ILE 18 -8.539 1.225 13.561
159 2HD1 ILE 18 2HD1 ILE 18 -6.848 1.663 13.330
160 3HD1 ILE 18 3HD1 ILE 18 -7.288 0.444 14.525
161 H ASP 19 H ASP 19 -8.366 -1.916 11.071
162 HA ASP 19 HA ASP 19 -8.156 -3.073 8.496
163 1HB ASP 19 2HB ASP 19 -10.228 -2.273 10.155
164 2HB ASP 19 1HB ASP 19 -10.345 -1.161 8.795
165 H GLY 20 H GLY 20 -8.921 -1.772 6.505
166 1HA GLY 20 2HA GLY 20 -6.919 0.081 5.848
167 2HA GLY 20 1HA GLY 20 -8.385 -0.202 4.920
168 H ASP 21 H ASP 21 -6.986 1.639 7.569
169 HA ASP 21 HA ASP 21 -8.765 3.855 6.931
170 1HB ASP 21 2HB ASP 21 -9.555 2.255 8.948
171 2HB ASP 21 1HB ASP 21 -8.470 3.320 9.836
172 H THR 22 H THR 22 -6.210 2.699 9.104
173 HA THR 22 HA THR 22 -4.352 4.663 8.286
174 HB THR 22 HB THR 22 -5.548 6.285 9.509
175 HG1 THR 22 1HG THR 22 -4.053 6.883 10.927
176 1HG2 THR 22 1HG2 THR 22 -5.698 5.307 12.153
177 2HG2 THR 22 2HG2 THR 22 -6.446 4.114 11.090
178 3HG2 THR 22 3HG2 THR 22 -7.012 5.784 11.078
179 H VAL 23 H VAL 23 -2.695 3.280 8.276
180 HA VAL 23 HA VAL 23 -2.122 1.797 10.760
181 HB VAL 23 HB VAL 23 -1.067 0.048 9.395
182 1HG1 VAL 23 1HG1 VAL 23 -3.115 -0.774 9.813
183 2HG1 VAL 23 2HG1 VAL 23 -3.396 -0.469 8.100
184 3HG1 VAL 23 3HG1 VAL 23 -3.925 0.707 9.302
185 1HG2 VAL 23 1HG2 VAL 23 -1.325 1.999 7.329
186 2HG2 VAL 23 2HG2 VAL 23 -2.200 0.545 6.852
187 3HG2 VAL 23 3HG2 VAL 23 -0.495 0.443 7.285
188 H LYS 24 H LYS 24 -0.226 2.216 11.675
189 HA LYS 24 HA LYS 24 1.598 4.068 10.451
190 1HB LYS 24 2HB LYS 24 0.944 3.873 12.947
191 2HB LYS 24 1HB LYS 24 2.115 2.564 13.000
192 1HG LYS 24 2HG LYS 24 3.665 4.093 13.406
193 2HG LYS 24 1HG LYS 24 3.461 4.642 11.743
194 1HD LYS 24 2HD LYS 24 3.241 6.533 13.214
195 2HD LYS 24 1HD LYS 24 1.658 6.165 12.525
196 1HE LYS 24 2HE LYS 24 1.733 6.680 15.011
197 2HE LYS 24 1HE LYS 24 0.889 5.208 14.529
198 1HZ LYS 24 1HZ LYS 24 2.720 3.892 15.208
199 2HZ LYS 24 2HZ LYS 24 2.405 4.966 16.475
200 3HZ LYS 24 3HZ LYS 24 3.711 5.245 15.439
201 H LEU 25 H LEU 25 3.501 3.660 9.503
202 HA LEU 25 HA LEU 25 4.518 0.899 9.560
203 1HB LEU 25 2HB LEU 25 5.076 1.017 7.237
204 2HB LEU 25 1HB LEU 25 3.387 1.448 7.412
205 HG LEU 25 HG LEU 25 5.150 3.773 7.456
206 1HD1 LEU 25 1HD1 LEU 25 5.449 1.751 5.329
207 2HD1 LEU 25 2HD1 LEU 25 6.569 2.995 5.883
208 3HD1 LEU 25 3HD1 LEU 25 5.247 3.421 4.796
209 1HD2 LEU 25 1HD2 LEU 25 3.075 3.308 5.389
210 2HD2 LEU 25 2HD2 LEU 25 3.424 4.750 6.340
211 3HD2 LEU 25 3HD2 LEU 25 2.550 3.404 7.069
212 H MET 26 H MET 26 6.770 0.649 9.481
213 HA MET 26 HA MET 26 8.243 2.764 10.701
214 1HB MET 26 2HB MET 26 8.639 -0.059 10.111
215 2HB MET 26 1HB MET 26 10.103 0.881 9.854
216 1HG MET 26 2HG MET 26 8.922 1.704 12.307
217 2HG MET 26 1HG MET 26 9.011 -0.056 12.285
218 1HE MET 26 1HE MET 26 11.240 -1.352 12.911
219 2HE MET 26 2HE MET 26 12.722 -0.861 12.093
220 3HE MET 26 3HE MET 26 11.259 -1.166 11.157
221 H TYR 27 H TYR 27 8.613 4.518 9.471
222 HA TYR 27 HA TYR 27 9.971 4.101 6.888
223 1HB TYR 27 2HB TYR 27 7.626 5.140 6.851
224 2HB TYR 27 1HB TYR 27 8.368 6.556 7.586
225 HD1 TYR 27 1HD TYR 27 7.366 5.189 4.566
226 HD2 TYR 27 2HD TYR 27 10.621 7.311 6.295
227 HE1 TYR 27 1HE TYR 27 8.019 5.995 2.336
228 HE2 TYR 27 2HE TYR 27 11.282 8.123 4.076
229 HH TYR 27 HH TYR 27 10.263 8.499 1.871
230 H LYS 28 H LYS 28 12.017 4.719 6.884
231 HA LYS 28 HA LYS 28 13.993 5.626 7.550
232 1HB LYS 28 2HB LYS 28 14.113 7.984 7.448
233 2HB LYS 28 1HB LYS 28 12.808 7.527 6.366
234 1HG LYS 28 2HG LYS 28 11.161 8.306 7.849
235 2HG LYS 28 1HG LYS 28 12.295 8.388 9.196
236 1HD LYS 28 2HD LYS 28 13.292 10.323 8.414
237 2HD LYS 28 1HD LYS 28 12.781 10.032 6.749
238 1HE LYS 28 2HE LYS 28 10.411 10.403 7.549
239 2HE LYS 28 1HE LYS 28 11.106 10.974 9.066
240 1HZ LYS 28 1HZ LYS 28 10.544 12.634 7.157
241 2HZ LYS 28 2HZ LYS 28 12.046 12.152 6.548
242 3HZ LYS 28 3HZ LYS 28 11.941 12.847 8.086
243 H GLY 29 H GLY 29 12.321 4.441 9.658
244 1HA GLY 29 2HA GLY 29 12.669 4.068 11.911
245 2HA GLY 29 1HA GLY 29 13.874 5.346 11.897
246 H GLN 30 H GLN 30 10.939 6.392 10.579
247 HA GLN 30 HA GLN 30 10.133 7.532 13.173
248 1HB GLN 30 2HB GLN 30 10.677 8.821 10.586
249 2HB GLN 30 1HB GLN 30 9.176 9.328 11.346
250 1HG GLN 30 2HG GLN 30 11.553 9.248 13.087
251 2HG GLN 30 1HG GLN 30 11.547 10.476 11.822
252 1HE2 GLN 30 1HE2 GLN 30 10.275 9.493 14.838
253 2HE2 GLN 30 2HE2 GLN 30 9.246 10.856 15.107
254 HA PRO 31 HA PRO 31 6.181 5.645 12.551
255 1HB PRO 31 2HB PRO 31 5.036 8.063 13.827
256 2HB PRO 31 1HB PRO 31 4.908 6.367 14.307
257 1HG PRO 31 2HG PRO 31 6.447 8.075 15.670
258 2HG PRO 31 1HG PRO 31 6.938 6.390 15.418
259 1HD PRO 31 2HD PRO 31 7.881 8.868 14.032
260 2HD PRO 31 1HD PRO 31 8.803 7.438 14.547
261 H MET 32 H MET 32 4.986 5.604 10.766
262 HA MET 32 HA MET 32 3.912 8.084 9.666
263 1HB MET 32 2HB MET 32 5.624 6.144 8.109
264 2HB MET 32 1HB MET 32 4.616 7.372 7.359
265 1HG MET 32 2HG MET 32 6.914 7.862 9.237
266 2HG MET 32 1HG MET 32 6.923 8.100 7.492
267 1HE MET 32 1HE MET 32 8.028 9.950 9.132
268 2HE MET 32 2HE MET 32 7.110 11.243 9.905
269 3HE MET 32 3HE MET 32 7.492 11.336 8.185
270 H THR 33 H THR 33 1.785 7.682 9.671
271 HA THR 33 HA THR 33 0.852 4.992 9.020
272 HB THR 33 HB THR 33 -0.053 5.699 11.078
273 HG1 THR 33 1HG THR 33 -1.840 4.940 10.288
274 1HG2 THR 33 1HG2 THR 33 -1.519 7.871 11.021
275 2HG2 THR 33 2HG2 THR 33 -0.383 8.334 9.752
276 3HG2 THR 33 3HG2 THR 33 0.209 7.942 11.366
277 H PHE 34 H PHE 34 1.079 5.103 6.773
278 HA PHE 34 HA PHE 34 -0.821 6.903 5.417
279 1HB PHE 34 2HB PHE 34 1.673 5.594 4.299
280 2HB PHE 34 1HB PHE 34 0.555 6.602 3.390
281 HD1 PHE 34 1HD PHE 34 1.629 8.521 2.795
282 HD2 PHE 34 2HD PHE 34 2.138 7.048 6.755
283 HE1 PHE 34 1HE PHE 34 2.951 10.514 3.364
284 HE2 PHE 34 2HE PHE 34 3.451 9.042 7.333
285 HZ PHE 34 HZ PHE 34 3.865 10.776 5.635
286 H ARG 35 H ARG 35 -2.631 5.794 5.060
287 HA ARG 35 HA ARG 35 -2.518 3.231 3.709
288 1HB ARG 35 2HB ARG 35 -2.707 2.670 6.086
289 2HB ARG 35 1HB ARG 35 -4.140 3.683 6.214
290 1HG ARG 35 2HG ARG 35 -4.747 1.342 6.070
291 2HG ARG 35 1HG ARG 35 -5.313 2.217 4.648
292 1HD ARG 35 2HD ARG 35 -3.370 1.404 3.389
293 2HD ARG 35 1HD ARG 35 -2.831 0.510 4.809
294 HE ARG 35 HE ARG 35 -4.964 -0.207 3.003
295 1HH1 ARG 35 1HH1 ARG 35 -3.579 -0.686 6.169
296 2HH1 ARG 35 2HH1 ARG 35 -4.324 -2.231 6.398
297 1HH2 ARG 35 1HH2 ARG 35 -5.943 -2.241 3.303
298 2HH2 ARG 35 2HH2 ARG 35 -5.667 -3.113 4.773
299 H LEU 36 H LEU 36 -3.402 4.158 1.823
300 HA LEU 36 HA LEU 36 -6.244 4.715 2.040
301 1HB LEU 36 2HB LEU 36 -4.289 6.765 1.603
302 2HB LEU 36 1HB LEU 36 -5.329 6.632 0.196
303 HG LEU 36 HG LEU 36 -6.801 6.628 2.727
304 1HD1 LEU 36 1HD1 LEU 36 -4.653 8.339 2.725
305 2HD1 LEU 36 2HD1 LEU 36 -6.125 8.526 3.678
306 3HD1 LEU 36 3HD1 LEU 36 -5.969 9.352 2.127
307 1HD2 LEU 36 1HD2 LEU 36 -7.668 8.723 1.171
308 2HD2 LEU 36 2HD2 LEU 36 -8.299 7.077 1.138
309 3HD2 LEU 36 3HD2 LEU 36 -7.060 7.568 -0.016
310 H LEU 37 H LEU 37 -6.570 2.748 0.960
311 HA LEU 37 HA LEU 37 -5.642 2.712 -1.833
312 1HB LEU 37 2HB LEU 37 -5.825 0.338 -1.816
313 2HB LEU 37 1HB LEU 37 -4.908 0.821 -0.397
314 HG LEU 37 HG LEU 37 -7.386 0.694 0.676
315 1HD1 LEU 37 1HD1 LEU 37 -8.552 -1.245 -0.173
316 2HD1 LEU 37 2HD1 LEU 37 -7.329 -1.465 -1.425
317 3HD1 LEU 37 3HD1 LEU 37 -8.375 -0.045 -1.454
318 1HD2 LEU 37 1HD2 LEU 37 -6.027 -1.915 0.444
319 2HD2 LEU 37 2HD2 LEU 37 -6.537 -1.021 1.876
320 3HD2 LEU 37 3HD2 LEU 37 -5.050 -0.574 1.042
321 H LEU 38 H LEU 38 -7.074 2.964 -3.394
322 HA LEU 38 HA LEU 38 -9.642 3.792 -3.109
323 1HB LEU 38 2HB LEU 38 -8.124 2.534 -5.306
324 2HB LEU 38 1HB LEU 38 -9.867 2.526 -5.483
325 HG LEU 38 HG LEU 38 -8.815 4.454 -6.596
326 1HD1 LEU 38 1HD1 LEU 38 -10.819 4.704 -4.444
327 2HD1 LEU 38 2HD1 LEU 38 -10.941 5.081 -6.162
328 3HD1 LEU 38 3HD1 LEU 38 -10.145 6.210 -5.068
329 1HD2 LEU 38 1HD2 LEU 38 -7.705 4.866 -3.869
330 2HD2 LEU 38 2HD2 LEU 38 -8.104 6.286 -4.837
331 3HD2 LEU 38 3HD2 LEU 38 -6.950 5.099 -5.447
332 H VAL 39 H VAL 39 -11.460 2.948 -2.393
333 HA VAL 39 HA VAL 39 -12.028 0.111 -2.826
334 HB VAL 39 HB VAL 39 -12.923 -0.028 -0.463
335 1HG1 VAL 39 1HG1 VAL 39 -10.512 -0.690 -1.466
336 2HG1 VAL 39 2HG1 VAL 39 -11.012 -1.033 0.190
337 3HG1 VAL 39 3HG1 VAL 39 -10.021 0.385 -0.157
338 1HG2 VAL 39 1HG2 VAL 39 -13.055 2.233 0.196
339 2HG2 VAL 39 2HG2 VAL 39 -11.379 2.543 -0.257
340 3HG2 VAL 39 3HG2 VAL 39 -11.742 1.538 1.147
341 H ASP 40 H ASP 40 -13.842 0.191 -3.991
342 HA ASP 40 HA ASP 40 -16.010 1.951 -3.052
343 1HB ASP 40 2HB ASP 40 -16.712 1.963 -5.535
344 2HB ASP 40 1HB ASP 40 -15.353 2.974 -5.057
345 H THR 41 H THR 41 -17.147 0.421 -1.939
346 HA THR 41 HA THR 41 -18.251 -1.784 -3.549
347 HB THR 41 HB THR 41 -18.078 -2.166 -0.617
348 HG1 THR 41 1HG THR 41 -16.020 -1.330 -1.065
349 1HG2 THR 41 1HG2 THR 41 -17.114 -4.408 -1.594
350 2HG2 THR 41 2HG2 THR 41 -17.931 -3.847 -3.053
351 3HG2 THR 41 3HG2 THR 41 -18.845 -4.080 -1.563
352 HA PRO 42 HA PRO 42 -22.311 -0.279 -2.730
353 1HB PRO 42 2HB PRO 42 -22.960 -3.101 -2.009
354 2HB PRO 42 1HB PRO 42 -23.767 -2.016 -3.148
355 1HG PRO 42 2HG PRO 42 -22.192 -3.971 -4.027
356 2HG PRO 42 1HG PRO 42 -22.194 -2.381 -4.814
357 1HD PRO 42 2HD PRO 42 -20.183 -3.580 -2.966
358 2HD PRO 42 1HD PRO 42 -19.940 -2.503 -4.357
359 H GLU 43 H GLU 43 -23.130 0.691 -0.984
360 HA GLU 43 HA GLU 43 -23.042 -0.671 1.604
361 1HB GLU 43 2HB GLU 43 -21.576 1.783 0.868
362 2HB GLU 43 1HB GLU 43 -22.453 1.861 2.389
363 1HG GLU 43 2HG GLU 43 -20.603 -0.408 1.760
364 2HG GLU 43 1HG GLU 43 -20.017 1.107 2.445
365 H THR 44 H THR 44 -24.081 1.139 3.250
366 HA THR 44 HA THR 44 -26.798 1.350 2.339
367 HB THR 44 HB THR 44 -27.286 2.127 4.595
368 HG1 THR 44 1HG THR 44 -24.474 2.332 4.797
369 1HG2 THR 44 1HG2 THR 44 -27.209 0.010 5.214
370 2HG2 THR 44 2HG2 THR 44 -25.530 0.253 5.696
371 3HG2 THR 44 3HG2 THR 44 -25.907 -0.326 4.073
372 H LYS 45 H LYS 45 -28.040 3.264 2.209
373 HA LYS 45 HA LYS 45 -28.479 5.420 1.636
374 1HB LYS 45 2HB LYS 45 -26.182 5.634 3.452
375 2HB LYS 45 1HB LYS 45 -26.338 6.987 2.342
376 1HG LYS 45 2HG LYS 45 -28.827 6.166 3.670
377 2HG LYS 45 1HG LYS 45 -27.579 6.822 4.731
378 1HD LYS 45 2HD LYS 45 -27.475 8.851 3.469
379 2HD LYS 45 1HD LYS 45 -28.518 8.183 2.211
380 1HE LYS 45 2HE LYS 45 -30.418 8.399 3.481
381 2HE LYS 45 1HE LYS 45 -29.539 8.289 5.006
382 1HZ LYS 45 1HZ LYS 45 -30.498 10.564 4.030
383 2HZ LYS 45 2HZ LYS 45 -28.947 10.609 3.358
384 3HZ LYS 45 3HZ LYS 45 -29.138 10.490 5.035
385 H HIS 46 H HIS 46 -24.949 5.597 1.324
386 HA HIS 46 HA HIS 46 -25.136 6.680 -1.306
387 1HB HIS 46 2HB HIS 46 -22.905 5.904 0.525
388 2HB HIS 46 1HB HIS 46 -22.550 6.165 -1.179
389 HD1 HIS 46 1HD HIS 46 -21.788 7.957 1.464
390 HD2 HIS 46 2HD HIS 46 -24.492 8.833 -1.569
391 HE1 HIS 46 1HE HIS 46 -22.020 10.462 1.471
392 HE2 HIS 46 2HE HIS 46 -23.727 10.961 -0.313
393 HA PRO 47 HA PRO 47 -25.344 2.584 -3.186
394 1HB PRO 47 2HB PRO 47 -25.991 3.403 -5.666
395 2HB PRO 47 1HB PRO 47 -27.169 3.389 -4.349
396 1HG PRO 47 2HG PRO 47 -25.599 5.681 -5.462
397 2HG PRO 47 1HG PRO 47 -27.307 5.619 -4.987
398 1HD PRO 47 2HD PRO 47 -25.340 6.672 -3.410
399 2HD PRO 47 1HD PRO 47 -26.828 5.950 -2.768
400 H LYS 48 H LYS 48 -23.517 1.547 -3.660
401 HA LYS 48 HA LYS 48 -21.661 2.772 -5.589
402 1HB LYS 48 2HB LYS 48 -20.963 2.709 -3.069
403 2HB LYS 48 1HB LYS 48 -20.658 1.007 -3.384
404 1HG LYS 48 2HG LYS 48 -18.749 1.445 -4.434
405 2HG LYS 48 1HG LYS 48 -19.486 2.715 -5.411
406 1HD LYS 48 2HD LYS 48 -19.172 3.505 -2.633
407 2HD LYS 48 1HD LYS 48 -17.636 3.063 -3.379
408 1HE LYS 48 2HE LYS 48 -19.608 4.996 -4.584
409 2HE LYS 48 1HE LYS 48 -18.236 5.479 -3.586
410 1HZ LYS 48 1HZ LYS 48 -16.769 5.027 -5.227
411 2HZ LYS 48 2HZ LYS 48 -18.107 5.328 -6.217
412 3HZ LYS 48 3HZ LYS 48 -17.666 3.736 -5.853
413 H LYS 49 H LYS 49 -20.277 1.205 -6.716
414 HA LYS 49 HA LYS 49 -20.805 -1.574 -6.636
415 1HB LYS 49 2HB LYS 49 -22.819 -0.218 -7.893
416 2HB LYS 49 1HB LYS 49 -21.768 -0.615 -9.245
417 1HG LYS 49 2HG LYS 49 -22.370 -2.796 -7.344
418 2HG LYS 49 1HG LYS 49 -23.694 -2.237 -8.370
419 1HD LYS 49 2HD LYS 49 -22.199 -2.548 -10.343
420 2HD LYS 49 1HD LYS 49 -21.001 -3.264 -9.264
421 1HE LYS 49 2HE LYS 49 -22.204 -5.052 -10.270
422 2HE LYS 49 1HE LYS 49 -22.738 -4.939 -8.594
423 1HZ LYS 49 1HZ LYS 49 -24.665 -3.635 -9.410
424 2HZ LYS 49 2HZ LYS 49 -24.641 -5.229 -9.974
425 3HZ LYS 49 3HZ LYS 49 -24.180 -3.963 -10.997
426 H GLY 50 H GLY 50 -18.480 -0.093 -6.608
427 1HA GLY 50 2HA GLY 50 -17.336 -0.064 -9.272
428 2HA GLY 50 1HA GLY 50 -16.516 0.364 -7.777
429 H VAL 51 H VAL 51 -16.020 -1.502 -6.302
430 HA VAL 51 HA VAL 51 -14.634 -3.512 -7.803
431 HB VAL 51 HB VAL 51 -14.057 -4.421 -5.515
432 1HG1 VAL 51 1HG1 VAL 51 -13.281 -1.594 -5.370
433 2HG1 VAL 51 2HG1 VAL 51 -12.991 -2.362 -6.930
434 3HG1 VAL 51 3HG1 VAL 51 -12.283 -3.044 -5.465
435 1HG2 VAL 51 1HG2 VAL 51 -14.932 -3.593 -3.621
436 2HG2 VAL 51 2HG2 VAL 51 -16.226 -3.013 -4.670
437 3HG2 VAL 51 3HG2 VAL 51 -14.907 -1.933 -4.218
438 H GLU 52 H GLU 52 -14.788 -5.861 -7.040
439 HA GLU 52 HA GLU 52 -17.583 -6.661 -7.260
440 1HB GLU 52 2HB GLU 52 -16.677 -8.907 -7.711
441 2HB GLU 52 1HB GLU 52 -16.000 -7.697 -8.793
442 1HG GLU 52 2HG GLU 52 -13.927 -8.093 -8.101
443 2HG GLU 52 1HG GLU 52 -14.398 -8.050 -6.403
444 H LYS 53 H LYS 53 -18.495 -8.298 -5.890
445 HA LYS 53 HA LYS 53 -18.132 -7.826 -3.160
446 1HB LYS 53 2HB LYS 53 -19.753 -9.588 -4.821
447 2HB LYS 53 1HB LYS 53 -19.294 -10.347 -3.303
448 1HG LYS 53 2HG LYS 53 -20.650 -9.040 -2.096
449 2HG LYS 53 1HG LYS 53 -20.246 -7.594 -3.023
450 1HD LYS 53 2HD LYS 53 -21.850 -9.629 -4.435
451 2HD LYS 53 1HD LYS 53 -22.655 -8.799 -3.102
452 1HE LYS 53 2HE LYS 53 -23.101 -7.573 -5.099
453 2HE LYS 53 1HE LYS 53 -21.961 -6.634 -4.137
454 1HZ LYS 53 1HZ LYS 53 -20.190 -7.254 -5.543
455 2HZ LYS 53 2HZ LYS 53 -21.454 -6.797 -6.570
456 3HZ LYS 53 3HZ LYS 53 -21.111 -8.435 -6.332
457 H TYR 54 H TYR 54 -15.976 -8.064 -2.584
458 HA TYR 54 HA TYR 54 -14.824 -10.754 -2.809
459 1HB TYR 54 2HB TYR 54 -13.731 -8.156 -3.110
460 2HB TYR 54 1HB TYR 54 -12.993 -8.858 -1.675
461 HD1 TYR 54 1HD TYR 54 -12.285 -8.310 -4.897
462 HD2 TYR 54 2HD TYR 54 -12.630 -11.625 -2.252
463 HE1 TYR 54 1HE TYR 54 -10.753 -9.601 -6.325
464 HE2 TYR 54 2HE TYR 54 -11.099 -12.924 -3.673
465 HH TYR 54 HH TYR 54 -10.362 -12.926 -6.066
466 H GLY 55 H GLY 55 -15.867 -8.334 -0.512
467 1HA GLY 55 2HA GLY 55 -16.446 -8.613 1.710
468 2HA GLY 55 1HA GLY 55 -15.985 -10.302 1.579
469 HA PRO 56 HA PRO 56 -12.791 -8.586 4.340
470 1HB PRO 56 2HB PRO 56 -12.067 -10.983 5.399
471 2HB PRO 56 1HB PRO 56 -13.464 -10.060 5.966
472 1HG PRO 56 2HG PRO 56 -13.368 -12.384 4.081
473 2HG PRO 56 1HG PRO 56 -14.498 -12.069 5.412
474 1HD PRO 56 2HD PRO 56 -15.136 -11.590 2.831
475 2HD PRO 56 1HD PRO 56 -15.756 -10.594 4.162
476 H GLU 57 H GLU 57 -12.654 -10.726 1.687
477 HA GLU 57 HA GLU 57 -10.030 -11.622 1.688
478 1HB GLU 57 2HB GLU 57 -12.088 -11.109 -0.373
479 2HB GLU 57 1HB GLU 57 -10.429 -11.184 -0.954
480 1HG GLU 57 2HG GLU 57 -11.474 -13.331 0.835
481 2HG GLU 57 1HG GLU 57 -11.890 -13.330 -0.878
482 H ALA 58 H ALA 58 -11.329 -8.472 0.850
483 HA ALA 58 HA ALA 58 -9.100 -7.388 -0.444
484 1HB ALA 58 1HB ALA 58 -11.504 -6.451 -0.113
485 2HB ALA 58 2HB ALA 58 -10.144 -5.339 -0.267
486 3HB ALA 58 3HB ALA 58 -10.815 -5.700 1.325
487 H SER 59 H SER 59 -10.009 -7.261 2.995
488 HA SER 59 HA SER 59 -7.563 -5.954 3.741
489 1HB SER 59 2HB SER 59 -9.823 -5.754 4.929
490 2HB SER 59 1HB SER 59 -9.470 -7.335 5.626
491 HG SER 59 HG SER 59 -8.809 -5.372 6.846
492 H ALA 60 H ALA 60 -8.475 -9.186 3.164
493 HA ALA 60 HA ALA 60 -7.043 -10.675 4.982
494 1HB ALA 60 1HB ALA 60 -7.214 -11.311 2.043
495 2HB ALA 60 2HB ALA 60 -8.539 -11.547 3.181
496 3HB ALA 60 3HB ALA 60 -7.035 -12.444 3.382
497 H PHE 61 H PHE 61 -5.847 -8.758 2.324
498 HA PHE 61 HA PHE 61 -3.303 -9.854 1.997
499 1HB PHE 61 2HB PHE 61 -4.581 -7.242 1.441
500 2HB PHE 61 1HB PHE 61 -2.823 -7.227 1.538
501 HD1 PHE 61 1HD PHE 61 -1.675 -9.222 0.195
502 HD2 PHE 61 2HD PHE 61 -5.527 -7.603 -0.611
503 HE1 PHE 61 1HE PHE 61 -1.539 -10.061 -2.114
504 HE2 PHE 61 2HE PHE 61 -5.399 -8.437 -2.921
505 HZ PHE 61 HZ PHE 61 -3.403 -9.668 -3.676
506 H THR 62 H THR 62 -4.547 -7.631 4.402
507 HA THR 62 HA THR 62 -1.914 -7.242 5.581
508 HB THR 62 HB THR 62 -2.970 -5.629 7.016
509 HG1 THR 62 1HG THR 62 -5.397 -6.706 6.033
510 1HG2 THR 62 1HG2 THR 62 -3.067 -5.398 4.239
511 2HG2 THR 62 2HG2 THR 62 -3.139 -4.101 5.432
512 3HG2 THR 62 3HG2 THR 62 -4.629 -4.821 4.821
513 H LYS 63 H LYS 63 -4.562 -9.354 5.901
514 HA LYS 63 HA LYS 63 -4.072 -9.931 8.702
515 1HB LYS 63 2HB LYS 63 -6.373 -9.895 7.801
516 2HB LYS 63 1HB LYS 63 -5.969 -11.253 6.758
517 1HG LYS 63 2HG LYS 63 -5.351 -11.770 9.551
518 2HG LYS 63 1HG LYS 63 -7.056 -11.399 9.282
519 1HD LYS 63 2HD LYS 63 -5.607 -13.369 7.545
520 2HD LYS 63 1HD LYS 63 -6.281 -13.853 9.103
521 1HE LYS 63 2HE LYS 63 -8.058 -12.330 7.292
522 2HE LYS 63 1HE LYS 63 -7.657 -13.977 6.808
523 1HZ LYS 63 1HZ LYS 63 -8.952 -13.109 9.332
524 2HZ LYS 63 2HZ LYS 63 -8.381 -14.680 9.072
525 3HZ LYS 63 3HZ LYS 63 -9.623 -14.061 8.105
526 H LYS 64 H LYS 64 -4.075 -11.851 5.685
527 HA LYS 64 HA LYS 64 -2.572 -13.948 7.012
528 1HB LYS 64 2HB LYS 64 -4.504 -14.363 5.435
529 2HB LYS 64 1HB LYS 64 -3.438 -13.869 4.127
530 1HG LYS 64 2HG LYS 64 -2.301 -15.917 5.876
531 2HG LYS 64 1HG LYS 64 -3.760 -16.421 5.022
532 1HD LYS 64 2HD LYS 64 -2.628 -15.461 2.927
533 2HD LYS 64 1HD LYS 64 -1.145 -15.481 3.884
534 1HE LYS 64 2HE LYS 64 -0.994 -17.740 3.852
535 2HE LYS 64 1HE LYS 64 -2.743 -17.964 3.900
536 1HZ LYS 64 1HZ LYS 64 -1.704 -18.672 1.790
537 2HZ LYS 64 2HZ LYS 64 -1.244 -17.070 1.499
538 3HZ LYS 64 3HZ LYS 64 -2.884 -17.477 1.579
539 H MET 65 H MET 65 -2.164 -12.306 3.881
540 HA MET 65 HA MET 65 0.464 -13.114 3.472
541 1HB MET 65 2HB MET 65 -1.438 -11.547 2.117
542 2HB MET 65 1HB MET 65 0.007 -10.552 2.251
543 1HG MET 65 2HG MET 65 1.320 -12.413 1.284
544 2HG MET 65 1HG MET 65 -0.182 -13.306 1.053
545 1HE MET 65 1HE MET 65 -0.617 -13.233 -1.978
546 2HE MET 65 2HE MET 65 0.867 -13.626 -1.108
547 3HE MET 65 3HE MET 65 0.908 -12.482 -2.451
548 H TRP 66 H TRP 66 -0.725 -10.631 5.546
549 HA TRP 66 HA TRP 66 1.910 -9.384 5.671
550 1HB TRP 66 2HB TRP 66 -0.104 -7.945 5.438
551 2HB TRP 66 1HB TRP 66 -0.630 -8.497 7.022
552 HD1 TRP 66 HD TRP 66 1.470 -5.901 5.377
553 HE1 TRP 66 1HE TRP 66 2.703 -4.500 7.153
554 HE3 TRP 66 3HE TRP 66 0.576 -8.821 9.480
555 HZ2 TRP 66 2HZ TRP 66 3.223 -4.618 9.923
556 HZ3 TRP 66 3HZ TRP 66 1.477 -8.104 11.655
557 HH2 TRP 66 HH TRP 66 2.773 -6.047 11.870
558 H GLU 67 H GLU 67 -0.324 -11.230 7.662
559 HA GLU 67 HA GLU 67 1.444 -10.963 9.967
560 1HB GLU 67 2HB GLU 67 -1.126 -12.527 9.817
561 2HB GLU 67 1HB GLU 67 -0.285 -11.982 11.260
562 1HG GLU 67 2HG GLU 67 -1.153 -9.910 9.333
563 2HG GLU 67 1HG GLU 67 -2.402 -10.723 10.275
564 H ASN 68 H ASN 68 -0.026 -13.643 8.111
565 HA ASN 68 HA ASN 68 1.707 -15.569 9.359
566 1HB ASN 68 2HB ASN 68 -0.736 -15.690 8.062
567 2HB ASN 68 1HB ASN 68 0.366 -16.468 6.929
568 1HD2 ASN 68 1HD2 ASN 68 1.572 -18.291 7.651
569 2HD2 ASN 68 2HD2 ASN 68 0.987 -19.269 8.948
570 H ALA 69 H ALA 69 1.729 -13.712 6.413
571 HA ALA 69 HA ALA 69 4.080 -15.220 5.486
572 1HB ALA 69 1HB ALA 69 2.292 -13.366 3.927
573 2HB ALA 69 2HB ALA 69 2.222 -15.127 3.901
574 3HB ALA 69 3HB ALA 69 3.647 -14.292 3.281
575 H LYS 70 H LYS 70 5.936 -14.095 4.770
576 HA LYS 70 HA LYS 70 6.303 -11.525 6.119
577 1HB LYS 70 2HB LYS 70 8.133 -13.714 5.237
578 2HB LYS 70 1HB LYS 70 8.780 -12.086 5.389
579 1HG LYS 70 2HG LYS 70 8.353 -12.009 7.690
580 2HG LYS 70 1HG LYS 70 7.262 -13.394 7.619
581 1HD LYS 70 2HD LYS 70 10.101 -13.753 6.787
582 2HD LYS 70 1HD LYS 70 9.726 -13.650 8.508
583 1HE LYS 70 2HE LYS 70 9.369 -15.858 8.352
584 2HE LYS 70 1HE LYS 70 7.826 -15.396 7.633
585 1HZ LYS 70 1HZ LYS 70 9.409 -17.055 6.425
586 2HZ LYS 70 2HZ LYS 70 10.178 -15.644 5.896
587 3HZ LYS 70 3HZ LYS 70 8.544 -15.900 5.538
588 H LYS 71 H LYS 71 5.457 -10.033 4.715
589 HA LYS 71 HA LYS 71 7.108 -9.261 2.512
590 1HB LYS 71 2HB LYS 71 5.201 -9.303 0.846
591 2HB LYS 71 1HB LYS 71 5.913 -10.855 1.227
592 1HG LYS 71 2HG LYS 71 3.629 -10.078 2.897
593 2HG LYS 71 1HG LYS 71 3.262 -10.342 1.194
594 1HD LYS 71 2HD LYS 71 4.605 -12.294 3.061
595 2HD LYS 71 1HD LYS 71 2.961 -12.398 2.433
596 1HE LYS 71 2HE LYS 71 4.314 -12.210 0.122
597 2HE LYS 71 1HE LYS 71 5.536 -13.000 1.118
598 1HZ LYS 71 1HZ LYS 71 3.654 -14.322 -0.197
599 2HZ LYS 71 2HZ LYS 71 2.849 -14.100 1.274
600 3HZ LYS 71 3HZ LYS 71 4.343 -14.891 1.240
601 H ILE 72 H ILE 72 7.260 -7.253 3.376
602 HA ILE 72 HA ILE 72 4.782 -5.677 3.415
603 HB ILE 72 HB ILE 72 5.843 -4.370 5.341
604 1HG1 ILE 72 2HG1 ILE 72 8.003 -5.900 4.948
605 2HG1 ILE 72 1HG1 ILE 72 7.607 -5.223 6.520
606 1HG2 ILE 72 1HG2 ILE 72 4.790 -5.795 6.988
607 2HG2 ILE 72 2HG2 ILE 72 4.850 -7.166 5.878
608 3HG2 ILE 72 3HG2 ILE 72 3.833 -5.775 5.505
609 1HD1 ILE 72 1HD1 ILE 72 7.082 -7.239 7.407
610 2HD1 ILE 72 2HD1 ILE 72 8.233 -7.770 6.179
611 3HD1 ILE 72 3HD1 ILE 72 6.499 -7.889 5.872
612 H GLU 73 H GLU 73 4.903 -3.894 2.259
613 HA GLU 73 HA GLU 73 7.278 -2.309 2.068
614 1HB GLU 73 2HB GLU 73 6.722 -4.305 0.018
615 2HB GLU 73 1HB GLU 73 6.836 -2.681 -0.648
616 1HG GLU 73 2HG GLU 73 9.043 -2.580 -0.336
617 2HG GLU 73 1HG GLU 73 8.952 -3.324 1.259
618 H VAL 74 H VAL 74 6.936 -0.330 0.842
619 HA VAL 74 HA VAL 74 4.109 0.255 0.285
620 HB VAL 74 HB VAL 74 4.506 2.551 1.282
621 1HG1 VAL 74 1HG1 VAL 74 4.010 1.823 3.548
622 2HG1 VAL 74 2HG1 VAL 74 4.588 0.200 3.171
623 3HG1 VAL 74 3HG1 VAL 74 3.144 0.829 2.375
624 1HG2 VAL 74 1HG2 VAL 74 7.098 1.835 1.404
625 2HG2 VAL 74 2HG2 VAL 74 6.589 1.434 3.045
626 3HG2 VAL 74 3HG2 VAL 74 6.378 3.074 2.432
627 H GLU 75 H GLU 75 3.738 1.967 -1.196
628 HA GLU 75 HA GLU 75 5.963 3.246 -2.512
629 1HB GLU 75 2HB GLU 75 5.157 0.763 -3.491
630 2HB GLU 75 1HB GLU 75 4.378 1.923 -4.558
631 1HG GLU 75 2HG GLU 75 6.587 2.994 -4.915
632 2HG GLU 75 1HG GLU 75 7.318 1.701 -3.964
633 H PHE 76 H PHE 76 4.975 5.188 -2.022
634 HA PHE 76 HA PHE 76 2.660 5.841 -3.684
635 1HB PHE 76 2HB PHE 76 1.579 7.037 -1.796
636 2HB PHE 76 1HB PHE 76 1.672 5.297 -1.539
637 HD1 PHE 76 1HD PHE 76 2.700 8.561 -0.367
638 HD2 PHE 76 2HD PHE 76 3.311 4.372 0.056
639 HE1 PHE 76 1HE PHE 76 3.822 8.948 1.787
640 HE2 PHE 76 2HE PHE 76 4.434 4.749 2.213
641 HZ PHE 76 HZ PHE 76 4.691 7.039 3.082
642 H ASP 77 H ASP 77 3.191 7.540 -4.863
643 HA ASP 77 HA ASP 77 5.288 9.350 -3.952
644 1HB ASP 77 2HB ASP 77 4.053 8.675 -6.573
645 2HB ASP 77 1HB ASP 77 4.685 10.307 -6.380
646 H LYS 78 H LYS 78 4.267 10.583 -2.383
647 HA LYS 78 HA LYS 78 1.842 12.031 -3.119
648 1HB LYS 78 2HB LYS 78 2.160 10.880 -0.870
649 2HB LYS 78 1HB LYS 78 3.295 12.166 -0.481
650 1HG LYS 78 2HG LYS 78 1.543 13.274 0.316
651 2HG LYS 78 1HG LYS 78 1.087 13.542 -1.368
652 1HD LYS 78 2HD LYS 78 0.176 11.263 0.387
653 2HD LYS 78 1HD LYS 78 -0.792 12.657 -0.092
654 1HE LYS 78 2HE LYS 78 0.450 10.837 -2.129
655 2HE LYS 78 1HE LYS 78 -1.103 10.458 -1.386
656 1HZ LYS 78 1HZ LYS 78 -1.014 13.151 -2.317
657 2HZ LYS 78 2HZ LYS 78 -2.120 11.925 -2.682
658 3HZ LYS 78 3HZ LYS 78 -0.686 12.060 -3.568
659 H GLY 79 H GLY 79 4.818 12.994 -1.392
660 1HA GLY 79 2HA GLY 79 6.120 14.876 -1.575
661 2HA GLY 79 1HA GLY 79 5.553 15.000 -3.235
662 H GLN 80 H GLN 80 3.313 14.998 -0.568
663 HA GLN 80 HA GLN 80 2.963 17.904 -0.865
664 1HB GLN 80 2HB GLN 80 0.842 15.760 -0.874
665 2HB GLN 80 1HB GLN 80 0.477 17.450 -0.551
666 1HG GLN 80 2HG GLN 80 1.290 18.080 -2.739
667 2HG GLN 80 1HG GLN 80 1.773 16.416 -3.064
668 1HE2 GLN 80 1HE2 GLN 80 0.277 14.964 -3.737
669 2HE2 GLN 80 2HE2 GLN 80 -1.374 15.358 -4.063
670 H ARG 81 H ARG 81 3.347 18.846 1.012
671 HA ARG 81 HA ARG 81 3.568 17.521 3.468
672 1HB ARG 81 2HB ARG 81 3.428 19.897 4.420
673 2HB ARG 81 1HB ARG 81 4.724 19.562 3.278
674 1HG ARG 81 2HG ARG 81 3.632 20.721 1.542
675 2HG ARG 81 1HG ARG 81 2.112 20.779 2.436
676 1HD ARG 81 2HD ARG 81 4.194 21.989 3.989
677 2HD ARG 81 1HD ARG 81 4.167 22.702 2.378
678 HE ARG 81 HE ARG 81 1.542 22.617 3.242
679 1HH1 ARG 81 1HH1 ARG 81 4.523 24.123 4.252
680 2HH1 ARG 81 2HH1 ARG 81 3.738 25.491 4.965
681 1HH2 ARG 81 1HH2 ARG 81 0.506 24.418 4.179
682 2HH2 ARG 81 2HH2 ARG 81 1.457 25.659 4.924
683 H THR 82 H THR 82 1.852 16.408 4.242
684 HA THR 82 HA THR 82 -0.841 17.124 3.982
685 HB THR 82 HB THR 82 0.380 15.490 6.214
686 HG1 THR 82 1HG THR 82 1.025 14.608 4.279
687 1HG2 THR 82 1HG2 THR 82 -2.392 15.743 5.141
688 2HG2 THR 82 2HG2 THR 82 -1.836 15.708 6.814
689 3HG2 THR 82 3HG2 THR 82 -1.843 14.228 5.855
690 H ASP 83 H ASP 83 -2.319 18.061 5.441
691 HA ASP 83 HA ASP 83 -1.056 19.828 7.433
692 1HB ASP 83 2HB ASP 83 -2.819 20.407 5.244
693 2HB ASP 83 1HB ASP 83 -3.602 20.855 6.758
694 H LYS 84 H LYS 84 -4.079 18.093 6.720
695 HA LYS 84 HA LYS 84 -5.562 18.464 8.926
696 1HB LYS 84 2HB LYS 84 -6.198 15.967 8.727
697 2HB LYS 84 1HB LYS 84 -6.504 17.032 7.363
698 1HG LYS 84 2HG LYS 84 -4.001 16.124 6.793
699 2HG LYS 84 1HG LYS 84 -4.722 14.726 7.591
700 1HD LYS 84 2HD LYS 84 -6.562 14.726 6.038
701 2HD LYS 84 1HD LYS 84 -5.993 16.228 5.306
702 1HE LYS 84 2HE LYS 84 -4.553 15.145 3.989
703 2HE LYS 84 1HE LYS 84 -3.941 14.177 5.328
704 1HZ LYS 84 1HZ LYS 84 -4.914 12.739 3.707
705 2HZ LYS 84 2HZ LYS 84 -6.356 13.623 3.693
706 3HZ LYS 84 3HZ LYS 84 -5.918 12.742 5.069
707 H TYR 85 H TYR 85 -3.241 15.744 8.803
708 HA TYR 85 HA TYR 85 -2.774 16.151 11.675
709 1HB TYR 85 2HB TYR 85 -4.386 14.208 11.048
710 2HB TYR 85 1HB TYR 85 -2.923 13.380 10.527
711 HD1 TYR 85 1HD TYR 85 -5.101 13.849 13.208
712 HD2 TYR 85 2HD TYR 85 -0.956 13.463 12.337
713 HE1 TYR 85 1HE TYR 85 -4.686 13.141 15.526
714 HE2 TYR 85 2HE TYR 85 -0.528 12.753 14.651
715 HH TYR 85 HH TYR 85 -2.774 11.662 16.683
716 H GLY 86 H GLY 86 -1.618 14.889 8.605
717 1HA GLY 86 2HA GLY 86 0.739 15.488 8.106
718 2HA GLY 86 1HA GLY 86 1.119 14.899 9.718
719 H ARG 87 H ARG 87 -1.143 13.382 7.499
720 HA ARG 87 HA ARG 87 0.796 11.256 6.947
721 1HB ARG 87 2HB ARG 87 -1.284 9.669 7.304
722 2HB ARG 87 1HB ARG 87 -0.242 10.116 8.646
723 1HG ARG 87 2HG ARG 87 -1.889 11.179 9.707
724 2HG ARG 87 1HG ARG 87 -2.430 11.991 8.236
725 1HD ARG 87 2HD ARG 87 -3.582 9.931 7.548
726 2HD ARG 87 1HD ARG 87 -3.070 9.156 9.047
727 HE ARG 87 HE ARG 87 -4.380 11.358 9.910
728 1HH1 ARG 87 1HH1 ARG 87 -5.223 8.794 7.698
729 2HH1 ARG 87 2HH1 ARG 87 -6.917 8.887 8.037
730 1HH2 ARG 87 1HH2 ARG 87 -6.612 11.483 10.358
731 2HH2 ARG 87 2HH2 ARG 87 -7.708 10.415 9.545
732 H GLY 88 H GLY 88 0.873 10.908 4.861
733 1HA GLY 88 2HA GLY 88 -1.083 11.982 3.072
734 2HA GLY 88 1HA GLY 88 0.335 11.046 2.626
735 H LEU 89 H LEU 89 -0.541 9.635 1.227
736 HA LEU 89 HA LEU 89 -2.593 7.794 2.274
737 1HB LEU 89 2HB LEU 89 -2.334 8.694 -0.594
738 2HB LEU 89 1HB LEU 89 -3.599 7.690 0.081
739 HG LEU 89 HG LEU 89 -3.988 9.847 1.596
740 1HD1 LEU 89 1HD1 LEU 89 -3.580 11.891 0.439
741 2HD1 LEU 89 2HD1 LEU 89 -2.966 11.033 -0.975
742 3HD1 LEU 89 3HD1 LEU 89 -2.054 11.013 0.535
743 1HD2 LEU 89 1HD2 LEU 89 -5.011 10.038 -1.194
744 2HD2 LEU 89 2HD2 LEU 89 -5.865 10.234 0.337
745 3HD2 LEU 89 3HD2 LEU 89 -5.424 8.623 -0.227
746 H ALA 90 H ALA 90 -1.698 5.776 2.476
747 HA ALA 90 HA ALA 90 -0.040 4.889 0.271
748 1HB ALA 90 1HB ALA 90 1.678 3.942 1.600
749 2HB ALA 90 2HB ALA 90 0.818 4.354 3.079
750 3HB ALA 90 3HB ALA 90 1.484 5.629 2.062
751 H TYR 91 H TYR 91 0.338 2.548 0.165
752 HA TYR 91 HA TYR 91 -1.842 1.018 1.407
753 1HB TYR 91 2HB TYR 91 -1.201 0.058 -1.263
754 2HB TYR 91 1HB TYR 91 -2.766 0.479 -0.573
755 HD1 TYR 91 1HD TYR 91 -2.873 3.227 -0.183
756 HD2 TYR 91 2HD TYR 91 -0.749 1.165 -3.236
757 HE1 TYR 91 1HE TYR 91 -2.929 5.250 -1.568
758 HE2 TYR 91 2HE TYR 91 -0.809 3.182 -4.644
759 HH TYR 91 HH TYR 91 -2.771 5.554 -4.384
760 H ILE 92 H ILE 92 -1.457 -1.307 1.471
761 HA ILE 92 HA ILE 92 1.288 -1.877 2.129
762 HB ILE 92 HB ILE 92 0.470 -4.090 2.800
763 1HG1 ILE 92 2HG1 ILE 92 -2.259 -4.000 2.756
764 2HG1 ILE 92 1HG1 ILE 92 -1.869 -3.227 1.223
765 1HG2 ILE 92 1HG2 ILE 92 0.255 -2.787 4.630
766 2HG2 ILE 92 2HG2 ILE 92 -1.465 -3.055 4.350
767 3HG2 ILE 92 3HG2 ILE 92 -0.701 -1.569 3.787
768 1HD1 ILE 92 1HD1 ILE 92 -0.412 -5.219 0.729
769 2HD1 ILE 92 2HD1 ILE 92 -2.149 -5.519 0.773
770 3HD1 ILE 92 3HD1 ILE 92 -1.138 -5.988 2.140
771 H TYR 93 H TYR 93 2.620 -3.441 1.193
772 HA TYR 93 HA TYR 93 1.762 -4.595 -1.355
773 1HB TYR 93 2HB TYR 93 4.007 -2.666 -0.946
774 2HB TYR 93 1HB TYR 93 4.203 -3.947 -2.136
775 HD1 TYR 93 1HD TYR 93 2.504 -0.831 -1.327
776 HD2 TYR 93 2HD TYR 93 2.749 -4.029 -4.123
777 HE1 TYR 93 1HE TYR 93 1.254 0.511 -2.964
778 HE2 TYR 93 2HE TYR 93 1.500 -2.695 -5.767
779 HH TYR 93 HH TYR 93 0.930 0.641 -5.376
780 H ALA 94 H ALA 94 2.370 -6.643 -1.573
781 HA ALA 94 HA ALA 94 3.969 -7.870 0.496
782 1HB ALA 94 1HB ALA 94 2.409 -8.961 -1.830
783 2HB ALA 94 2HB ALA 94 2.040 -9.084 -0.109
784 3HB ALA 94 3HB ALA 94 3.400 -9.980 -0.785
785 H ASP 95 H ASP 95 6.123 -7.778 0.340
786 HA ASP 95 HA ASP 95 8.240 -7.948 -0.477
787 1HB ASP 95 2HB ASP 95 6.983 -10.145 -1.389
788 2HB ASP 95 1HB ASP 95 7.395 -9.395 -2.929
789 H GLY 96 H GLY 96 6.261 -5.876 -1.470
790 1HA GLY 96 2HA GLY 96 6.371 -4.026 -2.829
791 2HA GLY 96 1HA GLY 96 8.040 -4.469 -3.154
792 H LYS 97 H LYS 97 5.234 -3.821 -4.628
793 HA LYS 97 HA LYS 97 5.417 -5.888 -6.679
794 1HB LYS 97 2HB LYS 97 3.206 -5.108 -5.737
795 2HB LYS 97 1HB LYS 97 3.482 -3.575 -6.551
796 1HG LYS 97 2HG LYS 97 2.323 -4.515 -8.217
797 2HG LYS 97 1HG LYS 97 3.853 -5.307 -8.597
798 1HD LYS 97 2HD LYS 97 3.189 -7.251 -7.286
799 2HD LYS 97 1HD LYS 97 1.680 -6.451 -6.841
800 1HE LYS 97 2HE LYS 97 2.230 -6.620 -9.730
801 2HE LYS 97 1HE LYS 97 1.942 -8.160 -8.921
802 1HZ LYS 97 1HZ LYS 97 0.129 -5.839 -9.152
803 2HZ LYS 97 2HZ LYS 97 -0.099 -7.010 -7.955
804 3HZ LYS 97 3HZ LYS 97 -0.155 -7.449 -9.587
805 H MET 98 H MET 98 6.991 -5.553 -8.122
806 HA MET 98 HA MET 98 7.814 -2.897 -8.884
807 1HB MET 98 2HB MET 98 9.474 -4.020 -10.268
808 2HB MET 98 1HB MET 98 9.457 -4.710 -8.651
809 1HG MET 98 2HG MET 98 9.269 -6.706 -9.581
810 2HG MET 98 1HG MET 98 7.650 -6.248 -10.111
811 1HE MET 98 1HE MET 98 8.570 -8.388 -11.855
812 2HE MET 98 2HE MET 98 8.518 -7.712 -13.483
813 3HE MET 98 3HE MET 98 7.243 -7.326 -12.327
814 H VAL 99 H VAL 99 7.695 -1.995 -10.964
815 HA VAL 99 HA VAL 99 5.952 -3.311 -12.907
816 HB VAL 99 HB VAL 99 4.680 -1.188 -13.251
817 1HG1 VAL 99 1HG1 VAL 99 3.724 -3.061 -12.007
818 2HG1 VAL 99 2HG1 VAL 99 3.175 -1.516 -11.356
819 3HG1 VAL 99 3HG1 VAL 99 4.425 -2.432 -10.515
820 1HG2 VAL 99 1HG2 VAL 99 4.943 0.662 -11.970
821 2HG2 VAL 99 2HG2 VAL 99 6.575 0.016 -11.788
822 3HG2 VAL 99 3HG2 VAL 99 5.370 -0.262 -10.530
823 H ASN 100 H ASN 100 8.241 -3.445 -13.757
824 HA ASN 100 HA ASN 100 9.136 -0.950 -15.006
825 1HB ASN 100 2HB ASN 100 10.530 -3.026 -13.788
826 2HB ASN 100 1HB ASN 100 10.804 -3.284 -15.509
827 1HD2 ASN 100 1HD2 ASN 100 12.683 -2.473 -13.461
828 2HD2 ASN 100 2HD2 ASN 100 13.322 -0.948 -13.962
829 H GLU 101 H GLU 101 9.879 -1.051 -17.271
830 HA GLU 101 HA GLU 101 8.351 -2.991 -18.873
831 1HB GLU 101 2HB GLU 101 8.307 -0.024 -18.961
832 2HB GLU 101 1HB GLU 101 8.297 -0.860 -20.508
833 1HG GLU 101 2HG GLU 101 6.320 -2.128 -19.794
834 2HG GLU 101 1HG GLU 101 6.320 -1.240 -18.270
835 H ALA 102 H ALA 102 11.158 -2.970 -18.090
836 HA ALA 102 HA ALA 102 12.363 -2.787 -20.773
837 1HB ALA 102 1HB ALA 102 14.391 -2.569 -18.785
838 2HB ALA 102 2HB ALA 102 13.130 -1.386 -18.436
839 3HB ALA 102 3HB ALA 102 13.915 -1.395 -20.014
840 H LEU 103 H LEU 103 11.814 -5.015 -21.064
841 HA LEU 103 HA LEU 103 13.289 -6.903 -19.367
842 1HB LEU 103 2HB LEU 103 11.056 -7.342 -21.349
843 2HB LEU 103 1HB LEU 103 11.885 -8.633 -20.499
844 HG LEU 103 HG LEU 103 11.134 -7.400 -18.348
845 1HD1 LEU 103 1HD1 LEU 103 10.376 -5.345 -19.295
846 2HD1 LEU 103 2HD1 LEU 103 8.969 -6.207 -18.674
847 3HD1 LEU 103 3HD1 LEU 103 9.299 -6.191 -20.407
848 1HD2 LEU 103 1HD2 LEU 103 8.758 -8.503 -19.700
849 2HD2 LEU 103 2HD2 LEU 103 9.497 -8.943 -18.161
850 3HD2 LEU 103 3HD2 LEU 103 10.186 -9.537 -19.672
851 H VAL 104 H VAL 104 15.083 -7.829 -20.088
852 HA VAL 104 HA VAL 104 16.014 -7.289 -22.764
853 HB VAL 104 HB VAL 104 18.057 -8.485 -22.077
854 1HG1 VAL 104 1HG1 VAL 104 16.921 -6.198 -20.604
855 2HG1 VAL 104 2HG1 VAL 104 18.417 -6.325 -21.529
856 3HG1 VAL 104 3HG1 VAL 104 18.343 -6.951 -19.882
857 1HG2 VAL 104 1HG2 VAL 104 16.294 -9.405 -19.938
858 2HG2 VAL 104 2HG2 VAL 104 17.859 -8.831 -19.363
859 3HG2 VAL 104 3HG2 VAL 104 17.780 -10.116 -20.568
860 H ARG 105 H ARG 105 15.764 -8.563 -24.477
861 HA ARG 105 HA ARG 105 15.432 -11.446 -24.087
862 1HB ARG 105 2HB ARG 105 13.311 -9.714 -24.744
863 2HB ARG 105 1HB ARG 105 13.728 -10.549 -26.234
864 1HG ARG 105 2HG ARG 105 13.003 -12.548 -25.479
865 2HG ARG 105 1HG ARG 105 13.502 -12.226 -23.817
866 1HD ARG 105 2HD ARG 105 11.155 -12.273 -23.753
867 2HD ARG 105 1HD ARG 105 11.584 -10.563 -23.725
868 HE ARG 105 HE ARG 105 10.577 -10.308 -25.769
869 1HH1 ARG 105 1HH1 ARG 105 11.009 -13.711 -25.131
870 2HH1 ARG 105 2HH1 ARG 105 10.060 -14.214 -26.487
871 1HH2 ARG 105 1HH2 ARG 105 9.328 -10.969 -27.555
872 2HH2 ARG 105 2HH2 ARG 105 9.106 -12.658 -27.865
873 H GLN 106 H GLN 106 17.570 -9.617 -25.105
874 HA GLN 106 HA GLN 106 19.122 -9.558 -26.764
875 1HB GLN 106 2HB GLN 106 18.242 -12.260 -26.543
876 2HB GLN 106 1HB GLN 106 18.509 -11.916 -28.246
877 1HG GLN 106 2HG GLN 106 20.716 -11.929 -28.005
878 2HG GLN 106 1HG GLN 106 20.648 -10.898 -26.578
879 1HE2 GLN 106 1HE2 GLN 106 19.586 -12.177 -24.648
880 2HE2 GLN 106 2HE2 GLN 106 20.319 -13.710 -24.336
881 H GLY 107 H GLY 107 18.715 -7.948 -28.154
882 1HA GLY 107 2HA GLY 107 18.331 -7.413 -30.472
883 2HA GLY 107 1HA GLY 107 17.016 -8.579 -30.479
884 H LEU 108 H LEU 108 15.229 -7.454 -30.919
885 HA LEU 108 HA LEU 108 14.820 -4.754 -30.164
886 1HB LEU 108 2HB LEU 108 12.428 -5.237 -30.844
887 2HB LEU 108 1HB LEU 108 13.657 -5.478 -32.071
888 HG LEU 108 HG LEU 108 13.085 -7.910 -30.557
889 1HD1 LEU 108 1HD1 LEU 108 10.904 -8.067 -32.099
890 2HD1 LEU 108 2HD1 LEU 108 10.863 -6.345 -31.717
891 3HD1 LEU 108 3HD1 LEU 108 10.859 -7.537 -30.417
892 1HD2 LEU 108 1HD2 LEU 108 12.607 -7.728 -33.459
893 2HD2 LEU 108 2HD2 LEU 108 13.550 -8.895 -32.531
894 3HD2 LEU 108 3HD2 LEU 108 14.234 -7.317 -32.918
895 H ALA 109 H ALA 109 15.368 -5.030 -27.856
896 HA ALA 109 HA ALA 109 13.015 -5.882 -26.298
897 1HB ALA 109 1HB ALA 109 14.760 -6.153 -24.415
898 2HB ALA 109 2HB ALA 109 15.940 -6.181 -25.725
899 3HB ALA 109 3HB ALA 109 14.661 -7.394 -25.664
900 H LYS 110 H LYS 110 11.991 -4.275 -25.323
901 HA LYS 110 HA LYS 110 12.945 -1.616 -25.311
902 1HB LYS 110 2HB LYS 110 10.532 -3.024 -24.523
903 2HB LYS 110 1HB LYS 110 10.931 -1.749 -23.379
904 1HG LYS 110 2HG LYS 110 11.088 -1.016 -26.227
905 2HG LYS 110 1HG LYS 110 9.476 -1.363 -25.599
906 1HD LYS 110 2HD LYS 110 11.386 0.515 -24.230
907 2HD LYS 110 1HD LYS 110 10.245 1.051 -25.464
908 1HE LYS 110 2HE LYS 110 8.386 0.477 -24.143
909 2HE LYS 110 1HE LYS 110 9.365 -0.494 -23.043
910 1HZ LYS 110 1HZ LYS 110 10.487 1.608 -22.380
911 2HZ LYS 110 2HZ LYS 110 8.850 1.541 -21.964
912 3HZ LYS 110 3HZ LYS 110 9.346 2.461 -23.293
Contact the webmaster for help, if required. Thursday, May 23, 2024 10:40:39 AM GMT (wattos1)