Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
2043 | 1bbx RC | 5910 | cing | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
1 1H5* C 1 1H5* CYT 1 -3.897 -17.617 -17.617
2 2H5* C 1 2H5* CYT 1 -4.131 -18.648 -18.648
3 H4* C 1 H4* CYT 1 -2.737 -17.289 -17.289
4 H3* C 1 H3* CYT 1 -3.424 -15.204 -15.204
5 1H2* C 1 1H2* CYT 1 -1.339 -14.339 -14.339
6 2H2* C 1 2H2* CYT 1 -0.960 -14.621 -14.621
7 H1* C 1 H1* CYT 1 0.102 -16.538 -16.538
8 1H4 C 1 1H4 CYT 1 0.995 -15.780 -15.780
9 2H4 C 1 2H4 CYT 1 2.496 -16.395 -16.395
10 H5 C 1 H5 CYT 1 -0.978 -15.422 -15.422
11 H6 C 1 H6 CYT 1 -1.938 -15.577 -15.577
12 H5T C 1 H5T CYT 1 -5.196 -16.082 -16.082
13 1H5* T 2 1H5* THY 2 -0.677 -13.549 -13.549
14 2H5* T 2 2H5* THY 2 -1.801 -12.197 -12.197
15 H4* T 2 H4* THY 2 0.736 -11.629 -11.629
16 H3* T 2 H3* THY 2 -1.305 -10.621 -10.621
17 1H2* T 2 1H2* THY 2 0.151 -9.864 -9.864
18 2H2* T 2 2H2* THY 2 1.274 -9.347 -9.347
19 H1* T 2 H1* THY 2 2.493 -11.204 -11.204
20 H3 T 2 H3 THY 2 2.932 -13.032 -13.032
21 1H5M T 2 1H5 THY 2 -1.850 -11.691 -11.691
22 2H5M T 2 2H5 THY 2 -1.764 -13.467 -13.467
23 3H5M T 2 3H5 THY 2 -2.338 -12.601 -12.601
24 H6 T 2 H6 THY 2 -0.839 -11.769 -11.769
25 1H5* A 3 1H5* ADE 3 1.498 -7.717 -7.717
26 2H5* A 3 2H5* ADE 3 1.165 -6.003 -6.003
27 H4* A 3 H4* ADE 3 3.642 -6.986 -6.986
28 H3* A 3 H3* ADE 3 2.320 -4.662 -4.662
29 1H2* A 3 1H2* ADE 3 2.170 -5.114 -5.114
30 2H2* A 3 2H2* ADE 3 3.892 -4.862 -4.862
31 H1* A 3 H1* ADE 3 4.322 -7.059 -7.059
32 H8 A 3 H8 ADE 3 0.492 -7.282 -7.282
33 1H6 A 3 1H6 ADE 3 0.843 -9.882 -9.882
34 2H6 A 3 2H6 ADE 3 -0.231 -9.479 -9.479
35 H2 A 3 H2 ADE 3 4.970 -8.564 -8.564
36 1H5* G 4 1H5* GUA 4 6.588 -5.787 -5.787
37 2H5* G 4 2H5* GUA 4 7.375 -4.506 -4.506
38 H4* G 4 H4* GUA 4 8.299 -4.213 -4.213
39 H3* G 4 H3* GUA 4 6.065 -2.410 -2.410
40 1H2* G 4 1H2* GUA 4 5.000 -2.248 -2.248
41 2H2* G 4 2H2* GUA 4 6.532 -1.949 -1.949
42 H1* G 4 H1* GUA 4 6.502 -4.041 -4.041
43 H8 G 4 H8 GUA 4 3.579 -3.838 -3.838
44 H1 G 4 H1 GUA 4 2.306 -7.110 -7.110
45 1H2 G 4 1H2 GUA 4 5.653 -6.531 -6.531
46 2H2 G 4 2H2 GUA 4 4.128 -7.240 -7.240
47 1H5* C 5 1H5* CYT 5 9.349 -1.961 -1.961
48 2H5* C 5 2H5* CYT 5 10.062 -0.435 -0.435
49 H4* C 5 H4* CYT 5 10.438 -0.643 -0.643
50 H3* C 5 H3* CYT 5 8.968 1.524 1.524
51 1H2* C 5 1H2* CYT 5 7.037 1.624 1.624
52 2H2* C 5 2H2* CYT 5 8.019 1.838 1.838
53 H1* C 5 H1* CYT 5 7.553 -0.274 -0.274
54 1H4 C 5 1H4 CYT 5 2.118 -1.907 -1.907
55 2H4 C 5 2H4 CYT 5 1.936 -2.581 -2.581
56 H5 C 5 H5 CYT 5 4.060 -0.663 -0.663
57 H6 C 5 H6 CYT 5 6.290 0.117 0.117
58 1H5* G 6 1H5* GUA 6 8.927 5.395 5.395
59 2H5* G 6 2H5* GUA 6 7.383 5.279 5.279
60 H4* G 6 H4* GUA 6 8.258 4.026 4.026
61 H3* G 6 H3* GUA 6 6.740 6.345 6.345
62 1H2* G 6 1H2* GUA 6 4.742 5.380 5.380
63 2H2* G 6 2H2* GUA 6 4.549 5.202 5.202
64 H1* G 6 H1* GUA 6 5.061 3.011 3.011
65 H8 G 6 H8 GUA 6 5.072 3.765 3.765
66 H1 G 6 H1 GUA 6 0.303 0.087 0.087
67 1H2 G 6 1H2 GUA 6 1.714 0.628 0.628
68 2H2 G 6 2H2 GUA 6 0.441 -0.130 -0.130
69 1H5* C 7 1H5* CYT 7 6.186 8.416 8.416
70 2H5* C 7 2H5* CYT 7 4.924 9.069 9.069
71 H4* C 7 H4* CYT 7 5.176 6.323 6.323
72 H3* C 7 H3* CYT 7 3.345 8.502 8.502
73 1H2* C 7 1H2* CYT 7 2.261 8.189 8.189
74 2H2* C 7 2H2* CYT 7 1.343 7.079 7.079
75 H1* C 7 H1* CYT 7 2.623 5.211 5.211
76 1H4 C 7 1H4 CYT 7 1.505 6.689 6.689
77 2H4 C 7 2H4 CYT 7 0.284 5.525 5.525
78 H5 C 7 H5 CYT 7 3.137 7.580 7.580
79 H6 C 7 H6 CYT 7 3.897 7.548 7.548
80 1H5* G 8 1H5* GUA 8 2.699 9.225 9.225
81 2H5* G 8 2H5* GUA 8 2.810 8.968 8.968
82 H4* G 8 H4* GUA 8 0.550 7.899 7.899
83 H3* G 8 H3* GUA 8 1.065 10.673 10.673
84 1H2* G 8 1H2* GUA 8 -0.479 10.780 10.780
85 2H2* G 8 2H2* GUA 8 -1.674 10.183 10.183
86 H1* G 8 H1* GUA 8 -1.556 8.168 8.168
87 H8 G 8 H8 GUA 8 1.421 9.863 9.863
88 H1 G 8 H1 GUA 8 -3.055 7.514 7.514
89 1H2 G 8 1H2 GUA 8 -4.668 6.672 6.672
90 2H2 G 8 2H2 GUA 8 -4.695 6.658 6.658
91 1H5* C 9 1H5* CYT 9 -1.308 13.029 13.029
92 2H5* C 9 2H5* CYT 9 -0.942 14.173 14.173
93 H4* C 9 H4* CYT 9 -2.633 11.656 11.656
94 H3* C 9 H3* CYT 9 -3.040 14.532 14.532
95 1H2* C 9 1H2* CYT 9 -2.704 14.556 14.556
96 2H2* C 9 2H2* CYT 9 -4.307 13.819 13.819
97 H1* C 9 H1* CYT 9 -3.459 11.623 11.623
98 1H4 C 9 1H4 CYT 9 0.465 12.853 12.853
99 2H4 C 9 2H4 CYT 9 -1.034 12.245 12.245
100 H5 C 9 H5 CYT 9 0.781 13.292 13.292
101 H6 C 9 H6 CYT 9 -0.260 13.173 13.173
102 1H5* T 10 1H5* THY 10 -8.064 13.205 13.205
103 2H5* T 10 2H5* THY 10 -7.967 14.964 14.964
104 H4* T 10 H4* THY 10 -8.460 13.569 13.569
105 H3* T 10 H3* THY 10 -7.136 16.273 16.273
106 1H2* T 10 1H2* THY 10 -6.481 16.445 16.445
107 2H2* T 10 2H2* THY 10 -7.917 15.606 15.606
108 H1* T 10 H1* THY 10 -6.785 13.615 13.615
109 H3 T 10 H3 THY 10 -2.905 14.438 14.438
110 1H5M T 10 1H5 THY 10 -1.305 15.342 15.342
111 2H5M T 10 2H5 THY 10 -2.661 16.437 16.437
112 3H5M T 10 3H5 THY 10 -1.454 16.903 16.903
113 H6 T 10 H6 THY 10 -4.518 15.291 15.291
114 1H5* A 11 1H5* ADE 11 -12.204 17.596 17.596
115 2H5* A 11 2H5* ADE 11 -11.615 19.259 19.259
116 H4* A 11 H4* ADE 11 -11.924 17.359 17.359
117 H3* A 11 H3* ADE 11 -11.825 20.196 20.196
118 1H2* A 11 1H2* ADE 11 -9.466 20.407 20.407
119 2H2* A 11 2H2* ADE 11 -9.930 20.423 20.423
120 H1* A 11 H1* ADE 11 -9.483 18.165 18.165
121 H8 A 11 H8 ADE 11 -7.732 18.763 18.763
122 1H6 A 11 1H6 ADE 11 -2.438 18.534 18.534
123 2H6 A 11 2H6 ADE 11 -3.144 18.662 18.662
124 H2 A 11 H2 ADE 11 -5.848 18.239 18.239
125 1H5* G 12 1H5* GUA 12 -13.504 22.431 22.431
126 2H5* G 12 2H5* GUA 12 -13.172 22.875 22.875
127 H4* G 12 H4* GUA 12 -12.688 24.465 24.465
128 H3* G 12 H3* GUA 12 -11.416 24.204 24.204
129 1H2* G 12 1H2* GUA 12 -9.642 25.583 25.583
130 2H2* G 12 2H2* GUA 12 -10.486 26.376 26.376
131 H1* G 12 H1* GUA 12 -9.355 24.913 24.913
132 H8 G 12 H8 GUA 12 -9.566 23.041 23.041
133 H1 G 12 H1 GUA 12 -4.018 22.371 22.371
134 1H2 G 12 1H2 GUA 12 -5.571 24.160 24.160
135 2H2 G 12 2H2 GUA 12 -4.131 23.345 23.345
136 H3T G 12 H3T GUA 12 -12.437 26.524 26.524
137 1H5* C 13 1H5* CYT 13 3.216 23.100 23.100
138 2H5* C 13 2H5* CYT 13 3.342 24.467 24.467
139 H4* C 13 H4* CYT 13 1.825 23.495 23.495
140 H3* C 13 H3* CYT 13 2.661 20.952 20.952
141 1H2* C 13 1H2* CYT 13 0.592 20.036 20.036
142 2H2* C 13 2H2* CYT 13 0.075 20.748 20.748
143 H1* C 13 H1* CYT 13 -0.916 22.437 22.437
144 1H4 C 13 1H4 CYT 13 -1.267 20.005 20.005
145 2H4 C 13 2H4 CYT 13 -2.810 20.754 20.754
146 H5 C 13 H5 CYT 13 0.583 20.026 20.026
147 H6 C 13 H6 CYT 13 1.352 20.769 20.769
148 H5T C 13 H5T CYT 13 4.424 21.869 21.869
149 1H5* T 14 1H5* THY 14 -0.477 20.514 20.514
150 2H5* T 14 2H5* THY 14 0.646 19.168 19.168
151 H4* T 14 H4* THY 14 -1.904 18.638 18.638
152 H3* T 14 H3* THY 14 0.284 17.175 17.175
153 1H2* T 14 1H2* THY 14 -1.047 16.019 16.019
154 2H2* T 14 2H2* THY 14 -2.274 15.834 15.834
155 H1* T 14 H1* THY 14 -3.433 17.505 17.505
156 H3 T 14 H3 THY 14 -3.510 18.201 18.201
157 1H5M T 14 1H5 THY 14 1.267 16.874 16.874
158 2H5M T 14 2H5 THY 14 1.201 18.588 18.588
159 3H5M T 14 3H5 THY 14 1.643 18.137 18.137
160 H6 T 14 H6 THY 14 0.010 17.724 17.724
161 1H5* A 15 1H5* ADE 15 -2.751 14.993 14.993
162 2H5* A 15 2H5* ADE 15 -2.411 13.268 13.268
163 H4* A 15 H4* ADE 15 -4.849 14.124 14.124
164 H3* A 15 H3* ADE 15 -3.474 11.634 11.634
165 1H2* A 15 1H2* ADE 15 -3.132 11.484 11.484
166 2H2* A 15 2H2* ADE 15 -4.852 11.228 11.228
167 H1* A 15 H1* ADE 15 -5.243 13.302 13.302
168 H8 A 15 H8 ADE 15 -1.439 13.606 13.606
169 1H6 A 15 1H6 ADE 15 -1.294 14.659 14.659
170 2H6 A 15 2H6 ADE 15 -0.339 14.625 14.625
171 H2 A 15 H2 ADE 15 -5.524 13.653 13.653
172 1H5* G 16 1H5* GUA 16 -7.514 12.038 12.038
173 2H5* G 16 2H5* GUA 16 -8.390 11.041 11.041
174 H4* G 16 H4* GUA 16 -9.136 10.186 10.186
175 H3* G 16 H3* GUA 16 -6.984 8.642 8.642
176 1H2* G 16 1H2* GUA 16 -5.760 7.982 7.982
177 2H2* G 16 2H2* GUA 16 -7.225 7.472 7.472
178 H1* G 16 H1* GUA 16 -7.103 9.277 9.277
179 H8 G 16 H8 GUA 16 -4.400 9.761 9.761
180 H1 G 16 H1 GUA 16 -2.650 11.551 11.551
181 1H2 G 16 1H2 GUA 16 -5.926 10.752 10.752
182 2H2 G 16 2H2 GUA 16 -4.357 11.330 11.330
183 1H5* C 17 1H5* CYT 17 -9.983 7.308 7.308
184 2H5* C 17 2H5* CYT 17 -10.757 5.968 5.968
185 H4* C 17 H4* CYT 17 -10.926 5.541 5.541
186 H3* C 17 H3* CYT 17 -9.586 3.778 3.778
187 1H2* C 17 1H2* CYT 17 -7.564 3.397 3.397
188 2H2* C 17 2H2* CYT 17 -8.424 2.803 2.803
189 H1* C 17 H1* CYT 17 -7.882 4.672 4.672
190 1H4 C 17 1H4 CYT 17 -2.736 7.208 7.208
191 2H4 C 17 2H4 CYT 17 -2.414 7.442 7.442
192 H5 C 17 H5 CYT 17 -4.741 6.165 6.165
193 H6 C 17 H6 CYT 17 -6.920 5.220 5.220
194 1H5* G 18 1H5* GUA 18 -9.346 -0.705 -0.705
195 2H5* G 18 2H5* GUA 18 -7.880 -0.347 -0.347
196 H4* G 18 H4* GUA 18 -8.517 0.162 0.162
197 H3* G 18 H3* GUA 18 -7.087 -1.885 -1.885
198 1H2* G 18 1H2* GUA 18 -5.138 -0.767 -0.767
199 2H2* G 18 2H2* GUA 18 -4.799 -1.042 -1.042
200 H1* G 18 H1* GUA 18 -5.287 1.079 1.079
201 H8 G 18 H8 GUA 18 -5.619 1.322 1.322
202 H1 G 18 H1 GUA 18 -0.658 4.400 4.400
203 1H2 G 18 1H2 GUA 18 -1.809 3.044 3.044
204 2H2 G 18 2H2 GUA 18 -0.610 4.031 4.031
205 1H5* C 19 1H5* CYT 19 -6.190 -5.028 -5.028
206 2H5* C 19 2H5* CYT 19 -5.027 -5.369 -5.369
207 H4* C 19 H4* CYT 19 -5.147 -3.038 -3.038
208 H3* C 19 H3* CYT 19 -3.329 -5.176 -5.176
209 1H2* C 19 1H2* CYT 19 -2.416 -4.327 -4.327
210 2H2* C 19 2H2* CYT 19 -1.405 -3.512 -3.512
211 H1* C 19 H1* CYT 19 -2.715 -1.548 -1.548
212 1H4 C 19 1H4 CYT 19 -2.145 -1.307 -1.307
213 2H4 C 19 2H4 CYT 19 -0.879 -0.287 -0.287
214 H5 C 19 H5 CYT 19 -3.651 -2.591 -2.591
215 H6 C 19 H6 CYT 19 -4.214 -3.177 -3.177
216 1H5* G 20 1H5* GUA 20 -2.373 -6.851 -6.851
217 2H5* G 20 2H5* GUA 20 -2.630 -6.149 -6.149
218 H4* G 20 H4* GUA 20 -0.221 -5.540 -5.540
219 H3* G 20 H3* GUA 20 -0.836 -7.981 -7.981
220 1H2* G 20 1H2* GUA 20 0.562 -7.653 -7.653
221 2H2* G 20 2H2* GUA 20 1.855 -7.349 -7.349
222 H1* G 20 H1* GUA 20 1.675 -5.155 -5.155
223 H8 G 20 H8 GUA 20 -1.451 -6.388 -6.388
224 H1 G 20 H1 GUA 20 2.706 -3.053 -3.053
225 1H2 G 20 1H2 GUA 20 4.570 -2.992 -2.992
226 2H2 G 20 2H2 GUA 20 4.452 -2.524 -2.524
227 1H5* C 21 1H5* CYT 21 1.721 -11.195 -11.195
228 2H5* C 21 2H5* CYT 21 1.229 -11.838 -11.838
229 H4* C 21 H4* CYT 21 2.974 -9.434 -9.434
230 H3* C 21 H3* CYT 21 3.336 -12.081 -12.081
231 1H2* C 21 1H2* CYT 21 2.812 -11.500 -11.500
232 2H2* C 21 2H2* CYT 21 4.425 -10.783 -10.783
233 H1* C 21 H1* CYT 21 3.620 -8.645 -8.645
234 1H4 C 21 1H4 CYT 21 -0.778 -8.542 -8.542
235 2H4 C 21 2H4 CYT 21 0.661 -7.759 -7.759
236 H5 C 21 H5 CYT 21 -0.886 -9.586 -9.586
237 H6 C 21 H6 CYT 21 0.359 -10.031 -10.031
238 1H5* T 22 1H5* THY 22 8.216 -10.294 -10.294
239 2H5* T 22 2H5* THY 22 8.097 -12.013 -12.013
240 H4* T 22 H4* THY 22 8.417 -10.058 -10.058
241 H3* T 22 H3* THY 22 7.115 -12.825 -12.825
242 1H2* T 22 1H2* THY 22 6.275 -12.426 -12.426
243 2H2* T 22 2H2* THY 22 7.666 -11.449 -11.449
244 H1* T 22 H1* THY 22 6.556 -9.522 -9.522
245 H3 T 22 H3 THY 22 2.506 -9.815 -9.815
246 1H5M T 22 1H5 THY 22 1.287 -11.909 -11.909
247 2H5M T 22 2H5 THY 22 2.662 -13.047 -13.047
248 3H5M T 22 3H5 THY 22 1.354 -13.198 -13.198
249 H6 T 22 H6 THY 22 4.473 -11.768 -11.768
250 1H5* A 23 1H5* ADE 23 12.163 -14.086 -14.086
251 2H5* A 23 2H5* ADE 23 11.554 -15.682 -15.682
252 H4* A 23 H4* ADE 23 11.702 -13.282 -13.282
253 H3* A 23 H3* ADE 23 11.595 -16.092 -16.092
254 1H2* A 23 1H2* ADE 23 9.225 -16.270 -16.270
255 2H2* A 23 2H2* ADE 23 9.547 -15.842 -15.842
256 H1* A 23 H1* ADE 23 9.106 -13.603 -13.603
257 H8 A 23 H8 ADE 23 7.631 -15.060 -15.060
258 1H6 A 23 1H6 ADE 23 2.095 -14.078 -14.078
259 2H6 A 23 2H6 ADE 23 2.929 -14.608 -14.608
260 H2 A 23 H2 ADE 23 5.251 -12.998 -12.998
261 1H5* G 24 1H5* GUA 24 12.982 -17.414 -17.414
262 2H5* G 24 2H5* GUA 24 12.785 -18.286 -18.286
263 H4* G 24 H4* GUA 24 12.105 -19.253 -19.253
264 H3* G 24 H3* GUA 24 11.066 -19.726 -19.726
265 1H2* G 24 1H2* GUA 24 9.245 -20.954 -20.954
266 2H2* G 24 2H2* GUA 24 9.967 -21.362 -21.362
267 H1* G 24 H1* GUA 24 8.746 -19.623 -19.623
268 H8 G 24 H8 GUA 24 9.256 -18.677 -18.677
269 H1 G 24 H1 GUA 24 3.477 -17.303 -17.303
270 1H2 G 24 1H2 GUA 24 4.791 -18.350 -18.350
271 2H2 G 24 2H2 GUA 24 3.411 -17.728 -17.728
272 H3T G 24 H3T GUA 24 11.963 -21.636 -21.636
273 1H ALA 1 HT1 ALA 1 24.822 -4.048 -4.048
274 2H ALA 1 HT3 ALA 1 25.672 -3.840 -3.840
275 3H ALA 1 HT2 ALA 1 24.023 -3.443 -3.443
276 HA ALA 1 HA ALA 1 25.232 -1.406 -1.406
277 1HB ALA 1 HB3 ALA 1 27.303 -2.738 -2.738
278 2HB ALA 1 HB2 ALA 1 26.698 -2.652 -2.652
279 3HB ALA 1 HB1 ALA 1 27.117 -1.173 -1.173
280 H THR 2 HN THR 2 22.989 -2.994 -2.994
281 HA THR 2 HA THR 2 22.804 -1.209 -1.209
282 HB THR 2 HB THR 2 21.635 -3.804 -3.804
283 HG1 THR 2 HG1 THR 2 22.992 -2.634 -2.634
284 1HG2 THR 2 HG23 THR 2 19.690 -2.338 -2.338
285 2HG2 THR 2 HG22 THR 2 20.453 -2.042 -2.042
286 3HG2 THR 2 HG21 THR 2 19.932 -3.670 -3.670
287 H VAL 3 HN VAL 3 21.302 -2.049 -2.049
288 HA VAL 3 HA VAL 3 19.632 0.418 0.418
289 HB VAL 3 HB VAL 3 18.284 -1.327 -1.327
290 1HG1 VAL 3 HG12 VAL 3 19.779 -3.089 -3.089
291 2HG1 VAL 3 HG11 VAL 3 18.392 -3.032 -3.032
292 3HG1 VAL 3 HG13 VAL 3 18.170 -3.500 -3.500
293 1HG2 VAL 3 HG21 VAL 3 17.432 0.201 0.201
294 2HG2 VAL 3 HG23 VAL 3 16.390 -1.026 -1.026
295 3HG2 VAL 3 HG22 VAL 3 17.246 -1.367 -1.367
296 H LYS 4 HN LYS 4 18.713 0.873 0.873
297 HA LYS 4 HA LYS 4 19.860 -0.694 -0.694
298 1HB LYS 4 HB2 LYS 4 20.008 2.198 2.198
299 2HB LYS 4 HB1 LYS 4 21.235 0.970 0.970
300 1HG LYS 4 HG2 LYS 4 21.545 0.968 0.968
301 2HG LYS 4 HG1 LYS 4 20.632 2.476 2.476
302 1HD LYS 4 HD2 LYS 4 22.258 3.445 3.445
303 2HD LYS 4 HD1 LYS 4 23.174 1.938 1.938
304 1HE LYS 4 HE2 LYS 4 23.232 2.288 2.288
305 2HE LYS 4 HE1 LYS 4 22.861 3.977 3.977
306 1HZ LYS 4 HZ2 LYS 4 25.002 2.433 2.433
307 2HZ LYS 4 HZ1 LYS 4 25.294 3.390 3.390
308 3HZ LYS 4 HZ3 LYS 4 24.733 4.110 4.110
309 H PHE 5 HN PHE 5 18.879 0.161 0.161
310 HA PHE 5 HA PHE 5 16.533 1.798 1.798
311 1HB PHE 5 HB2 PHE 5 14.776 0.195 0.195
312 2HB PHE 5 HB1 PHE 5 15.867 -0.180 -0.180
313 HD1 PHE 5 HD2 PHE 5 17.625 -2.010 -2.010
314 HD2 PHE 5 HD1 PHE 5 14.295 -1.408 -1.408
315 HE1 PHE 5 HE2 PHE 5 17.920 -4.304 -4.304
316 HE2 PHE 5 HE1 PHE 5 14.590 -3.702 -3.702
317 HZ PHE 5 HZ PHE 5 16.402 -5.149 -5.149
318 H LYS 6 HN LYS 6 15.006 0.278 0.278
319 HA LYS 6 HA LYS 6 16.770 -0.656 -0.656
320 1HB LYS 6 HB2 LYS 6 16.925 1.854 1.854
321 2HB LYS 6 HB1 LYS 6 15.187 1.916 1.916
322 1HG LYS 6 HG2 LYS 6 15.492 0.611 0.611
323 2HG LYS 6 HG1 LYS 6 17.232 0.564 0.564
324 1HD LYS 6 HD2 LYS 6 17.466 2.896 2.896
325 2HD LYS 6 HD1 LYS 6 15.734 3.180 3.180
326 1HE LYS 6 HE2 LYS 6 15.271 2.082 2.082
327 2HE LYS 6 HE1 LYS 6 16.972 1.598 1.598
328 1HZ LYS 6 HZ2 LYS 6 16.446 4.415 4.415
329 2HZ LYS 6 HZ1 LYS 6 16.045 3.856 3.856
330 3HZ LYS 6 HZ3 LYS 6 17.634 3.701 3.701
331 H TYR 7 HN TYR 7 15.599 -2.154 -2.154
332 HA TYR 7 HA TYR 7 12.608 -1.897 -1.897
333 1HB TYR 7 HB2 TYR 7 13.178 -3.585 -3.585
334 2HB TYR 7 HB1 TYR 7 14.412 -4.267 -4.267
335 HD1 TYR 7 HD2 TYR 7 13.808 -5.652 -5.652
336 HD2 TYR 7 HD1 TYR 7 10.796 -4.009 -4.009
337 HE1 TYR 7 HE2 TYR 7 12.128 -7.191 -7.191
338 HE2 TYR 7 HE1 TYR 7 9.113 -5.553 -5.553
339 HH TYR 7 HH TYR 7 9.297 -6.963 -6.963
340 H LYS 8 HN LYS 8 11.687 -2.227 -2.227
341 HA LYS 8 HA LYS 8 11.551 -2.735 -2.735
342 1HB LYS 8 HB2 LYS 8 12.788 -4.810 -4.810
343 2HB LYS 8 HB1 LYS 8 14.134 -4.190 -4.190
344 1HG LYS 8 HG2 LYS 8 12.572 -4.159 -4.159
345 2HG LYS 8 HG1 LYS 8 11.429 -5.071 -5.071
346 1HD LYS 8 HD2 LYS 8 13.108 -6.841 -6.841
347 2HD LYS 8 HD1 LYS 8 14.268 -5.929 -5.929
348 1HE LYS 8 HE2 LYS 8 13.287 -6.548 -6.548
349 2HE LYS 8 HE1 LYS 8 11.647 -6.391 -6.391
350 1HZ LYS 8 HZ2 LYS 8 13.462 -8.510 -8.510
351 2HZ LYS 8 HZ1 LYS 8 12.549 -8.742 -8.742
352 3HZ LYS 8 HZ3 LYS 8 11.765 -8.452 -8.452
353 H GLY 9 HN GLY 9 15.028 -2.409 -2.409
354 1HA GLY 9 HA2 GLY 9 15.446 0.167 0.167
355 2HA GLY 9 HA1 GLY 9 15.609 -0.911 -0.911
356 H GLU 10 HN GLU 10 16.510 -1.745 -1.745
357 HA GLU 10 HA GLU 10 19.395 -1.498 -1.498
358 1HB GLU 10 HB2 GLU 10 18.245 -3.795 -3.795
359 2HB GLU 10 HB1 GLU 10 18.295 -4.008 -4.008
360 1HG GLU 10 HG2 GLU 10 20.381 -4.833 -4.833
361 2HG GLU 10 HG1 GLU 10 20.839 -3.133 -3.133
362 H GLU 11 HN GLU 11 20.591 -0.804 -0.804
363 HA GLU 11 HA GLU 11 19.226 -0.213 -0.213
364 1HB GLU 11 HB2 GLU 11 21.854 0.280 0.280
365 2HB GLU 11 HB1 GLU 11 21.810 0.397 0.397
366 1HG GLU 11 HG2 GLU 11 19.509 1.743 1.743
367 2HG GLU 11 HG1 GLU 11 20.743 2.234 2.234
368 H LYS 12 HN LYS 12 19.708 -1.187 -1.187
369 HA LYS 12 HA LYS 12 21.595 -3.451 -3.451
370 1HB LYS 12 HB2 LYS 12 18.598 -3.574 -3.574
371 2HB LYS 12 HB1 LYS 12 19.599 -4.776 -4.776
372 1HG LYS 12 HG2 LYS 12 19.770 -4.135 -4.135
373 2HG LYS 12 HG1 LYS 12 18.868 -5.492 -5.492
374 1HD LYS 12 HD2 LYS 12 20.978 -6.320 -6.320
375 2HD LYS 12 HD1 LYS 12 21.852 -5.018 -5.018
376 1HE LYS 12 HE2 LYS 12 21.997 -7.126 -7.126
377 2HE LYS 12 HE1 LYS 12 21.086 -5.896 -5.896
378 1HZ LYS 12 HZ1 LYS 12 19.780 -7.817 -7.817
379 2HZ LYS 12 HZ3 LYS 12 19.995 -8.153 -8.153
380 3HZ LYS 12 HZ2 LYS 12 19.048 -6.826 -6.826
381 H GLN 13 HN GLN 13 22.245 -3.958 -3.958
382 HA GLN 13 HA GLN 13 20.998 -2.447 -2.447
383 1HB GLN 13 HB2 GLN 13 22.715 -0.995 -0.995
384 2HB GLN 13 HB1 GLN 13 23.921 -2.253 -2.253
385 1HG GLN 13 HG2 GLN 13 23.056 -2.079 -2.079
386 2HG GLN 13 HG1 GLN 13 22.569 -0.465 -0.465
387 1HE2 GLN 13 HE22 GLN 13 26.592 -1.333 -1.333
388 2HE2 GLN 13 HE21 GLN 13 25.466 -2.552 -2.552
389 H VAL 14 HN VAL 14 21.349 -3.491 -3.491
390 HA VAL 14 HA VAL 14 23.259 -5.771 -5.771
391 HB VAL 14 HB VAL 14 21.319 -6.848 -6.848
392 1HG1 VAL 14 HG11 VAL 14 19.996 -4.660 -4.660
393 2HG1 VAL 14 HG13 VAL 14 19.229 -6.191 -6.191
394 3HG1 VAL 14 HG12 VAL 14 19.375 -5.711 -5.711
395 1HG2 VAL 14 HG22 VAL 14 22.282 -7.458 -7.458
396 2HG2 VAL 14 HG21 VAL 14 21.088 -8.427 -8.427
397 3HG2 VAL 14 HG23 VAL 14 20.564 -7.247 -7.247
398 H ASP 15 HN ASP 15 23.873 -6.296 -6.296
399 HA ASP 15 HA ASP 15 23.407 -4.207 -4.207
400 1HB ASP 15 HB2 ASP 15 25.101 -5.564 -5.564
401 2HB ASP 15 HB1 ASP 15 25.620 -5.220 -5.220
402 H ILE 16 HN ILE 16 22.921 -5.119 -5.119
403 HA ILE 16 HA ILE 16 20.373 -6.260 -6.260
404 HB ILE 16 HB ILE 16 20.790 -6.180 -6.180
405 1HG1 ILE 16 HG12 ILE 16 22.846 -7.622 -7.622
406 2HG1 ILE 16 HG11 ILE 16 22.950 -6.276 -6.276
407 1HG2 ILE 16 HG22 ILE 16 21.105 -4.016 -4.016
408 2HG2 ILE 16 HG21 ILE 16 22.768 -4.134 -4.134
409 3HG2 ILE 16 HG23 ILE 16 21.444 -4.000 -4.000
410 1HD1 ILE 16 HD12 ILE 16 24.067 -4.951 -4.951
411 2HD1 ILE 16 HD11 ILE 16 24.186 -6.473 -6.473
412 3HD1 ILE 16 HD13 ILE 16 25.014 -6.283 -6.283
413 H SER 17 HN SER 17 23.427 -7.771 -7.771
414 HA SER 17 HA SER 17 22.936 -10.303 -10.303
415 1HB SER 17 HB2 SER 17 25.040 -10.748 -10.748
416 2HB SER 17 HB1 SER 17 25.050 -9.009 -9.009
417 HG SER 17 HG SER 17 24.889 -11.119 -11.119
418 H LYS 18 HN LYS 18 21.278 -8.966 -8.966
419 HA LYS 18 HA LYS 18 20.543 -11.686 -11.686
420 1HB LYS 18 HB2 LYS 18 21.825 -9.421 -9.421
421 2HB LYS 18 HB1 LYS 18 20.527 -10.239 -10.239
422 1HG LYS 18 HG2 LYS 18 22.831 -11.702 -11.702
423 2HG LYS 18 HG1 LYS 18 22.833 -11.214 -11.214
424 1HD LYS 18 HD2 LYS 18 20.917 -12.585 -12.585
425 2HD LYS 18 HD1 LYS 18 20.648 -12.908 -12.908
426 1HE LYS 18 HE2 LYS 18 23.135 -13.846 -13.846
427 2HE LYS 18 HE1 LYS 18 22.720 -14.056 -14.056
428 1HZ LYS 18 HZ3 LYS 18 20.753 -14.824 -14.824
429 2HZ LYS 18 HZ2 LYS 18 22.059 -15.871 -15.871
430 3HZ LYS 18 HZ1 LYS 18 20.996 -15.460 -15.460
431 H ILE 19 HN ILE 19 19.443 -8.977 -8.977
432 HA ILE 19 HA ILE 19 16.925 -8.806 -8.806
433 HB ILE 19 HB ILE 19 18.036 -7.046 -7.046
434 1HG1 ILE 19 HG12 ILE 19 17.996 -6.430 -6.430
435 2HG1 ILE 19 HG11 ILE 19 19.366 -7.251 -7.251
436 1HG2 ILE 19 HG23 ILE 19 15.703 -6.807 -6.807
437 2HG2 ILE 19 HG22 ILE 19 16.406 -5.400 -5.400
438 3HG2 ILE 19 HG21 ILE 19 15.686 -6.692 -6.692
439 1HD1 ILE 19 HD13 ILE 19 18.278 -4.683 -4.683
440 2HD1 ILE 19 HD12 ILE 19 19.458 -4.668 -4.668
441 3HD1 ILE 19 HD11 ILE 19 19.869 -5.405 -5.405
442 H LYS 20 HN LYS 20 14.918 -9.266 -9.266
443 HA LYS 20 HA LYS 20 14.735 -9.748 -9.748
444 1HB LYS 20 HB2 LYS 20 15.431 -11.855 -11.855
445 2HB LYS 20 HB1 LYS 20 13.972 -12.247 -12.247
446 1HG LYS 20 HG2 LYS 20 16.012 -11.073 -11.073
447 2HG LYS 20 HG1 LYS 20 16.606 -12.521 -12.521
448 1HD LYS 20 HD2 LYS 20 14.191 -13.437 -13.437
449 2HD LYS 20 HD1 LYS 20 14.403 -12.235 -12.235
450 1HE LYS 20 HE2 LYS 20 16.874 -13.437 -13.437
451 2HE LYS 20 HE1 LYS 20 15.804 -14.802 -14.802
452 1HZ LYS 20 HZ1 LYS 20 15.320 -12.848 -12.848
453 2HZ LYS 20 HZ3 LYS 20 16.017 -14.377 -14.377
454 3HZ LYS 20 HZ2 LYS 20 14.418 -14.250 -14.250
455 H LYS 21 HN LYS 21 13.180 -10.744 -10.744
456 HA LYS 21 HA LYS 21 10.511 -10.346 -10.346
457 1HB LYS 21 HB2 LYS 21 11.737 -11.564 -11.564
458 2HB LYS 21 HB1 LYS 21 10.106 -10.926 -10.926
459 1HG LYS 21 HG2 LYS 21 10.917 -12.825 -12.825
460 2HG LYS 21 HG1 LYS 21 10.141 -13.329 -13.329
461 1HD LYS 21 HD2 LYS 21 8.614 -11.167 -11.167
462 2HD LYS 21 HD1 LYS 21 8.917 -12.265 -12.265
463 1HE LYS 21 HE2 LYS 21 7.769 -14.028 -14.028
464 2HE LYS 21 HE1 LYS 21 8.066 -13.422 -13.422
465 1HZ LYS 21 HZ2 LYS 21 6.699 -11.435 -11.435
466 2HZ LYS 21 HZ1 LYS 21 6.216 -12.320 -12.320
467 3HZ LYS 21 HZ3 LYS 21 5.835 -12.885 -12.885
468 H VAL 22 HN VAL 22 9.930 -8.191 -8.191
469 HA VAL 22 HA VAL 22 10.034 -6.586 -6.586
470 HB VAL 22 HB VAL 22 11.151 -4.786 -4.786
471 1HG1 VAL 22 HG13 VAL 22 12.474 -6.863 -6.863
472 2HG1 VAL 22 HG12 VAL 22 12.562 -7.278 -7.278
473 3HG1 VAL 22 HG11 VAL 22 13.276 -5.773 -5.773
474 1HG2 VAL 22 HG22 VAL 22 10.305 -6.329 -6.329
475 2HG2 VAL 22 HG21 VAL 22 10.478 -4.586 -4.586
476 3HG2 VAL 22 HG23 VAL 22 11.899 -5.582 -5.582
477 H TRP 23 HN TRP 23 7.886 -6.130 -6.130
478 HA TRP 23 HA TRP 23 6.284 -5.268 -5.268
479 1HB TRP 23 HB2 TRP 23 4.366 -6.080 -6.080
480 2HB TRP 23 HB1 TRP 23 5.600 -7.327 -7.327
481 HD1 TRP 23 HD1 TRP 23 3.625 -4.923 -4.923
482 HE1 TRP 23 HE1 TRP 23 4.210 -5.324 -5.324
483 HE3 TRP 23 HE3 TRP 23 7.582 -8.061 -8.061
484 HZ2 TRP 23 HZ2 TRP 23 6.130 -6.800 -6.800
485 HZ3 TRP 23 HZ3 TRP 23 8.782 -8.958 -8.958
486 HH2 TRP 23 HH2 TRP 23 8.060 -8.330 -8.330
487 H ARG 24 HN ARG 24 4.264 -3.886 -3.886
488 HA ARG 24 HA ARG 24 5.553 -1.990 -1.990
489 1HB ARG 24 HB2 ARG 24 5.361 -0.104 -0.104
490 2HB ARG 24 HB1 ARG 24 6.529 -1.335 -1.335
491 1HG ARG 24 HG2 ARG 24 4.474 -2.397 -2.397
492 2HG ARG 24 HG1 ARG 24 3.807 -0.768 -0.768
493 1HD ARG 24 HD2 ARG 24 6.614 -1.188 -1.188
494 2HD ARG 24 HD1 ARG 24 5.217 -1.339 -1.339
495 HE ARG 24 HE ARG 24 5.669 1.111 1.111
496 1HH1 ARG 24 HH21 ARG 24 3.736 -0.297 -0.297
497 2HH1 ARG 24 HH22 ARG 24 3.794 1.036 1.036
498 1HH2 ARG 24 HH11 ARG 24 6.222 2.752 2.752
499 2HH2 ARG 24 HH12 ARG 24 5.202 2.762 2.762
500 H VAL 25 HN VAL 25 3.623 -2.096 -2.096
501 HA VAL 25 HA VAL 25 0.926 -2.080 -2.080
502 HB VAL 25 HB VAL 25 2.180 -0.575 -0.575
503 1HG1 VAL 25 HG12 VAL 25 -0.644 -1.521 -1.521
504 2HG1 VAL 25 HG11 VAL 25 -0.088 -1.021 -1.021
505 3HG1 VAL 25 HG13 VAL 25 -0.107 0.137 0.137
506 1HG2 VAL 25 HG22 VAL 25 2.178 -3.319 -3.319
507 2HG2 VAL 25 HG21 VAL 25 2.497 -2.544 -2.544
508 3HG2 VAL 25 HG23 VAL 25 0.857 -3.088 -3.088
509 H GLY 26 HN GLY 26 2.650 0.789 0.789
510 1HA GLY 26 HA2 GLY 26 2.237 2.390 2.390
511 2HA GLY 26 HA1 GLY 26 1.033 2.783 2.783
512 H LYS 27 HN LYS 27 4.337 1.704 1.704
513 HA LYS 27 HA LYS 27 4.924 4.313 4.313
514 1HB LYS 27 HB2 LYS 27 4.637 2.436 2.436
515 2HB LYS 27 HB1 LYS 27 5.697 1.430 1.430
516 1HG LYS 27 HG2 LYS 27 7.431 3.368 3.368
517 2HG LYS 27 HG1 LYS 27 6.407 3.662 3.662
518 1HD LYS 27 HD2 LYS 27 7.922 1.141 1.141
519 2HD LYS 27 HD1 LYS 27 8.058 2.136 2.136
520 1HE LYS 27 HE2 LYS 27 6.389 0.990 0.990
521 2HE LYS 27 HE1 LYS 27 5.322 1.164 1.164
522 1HZ LYS 27 HZ2 LYS 27 7.018 -0.499 -0.499
523 2HZ LYS 27 HZ1 LYS 27 7.305 -0.922 -0.922
524 3HZ LYS 27 HZ3 LYS 27 5.746 -1.070 -1.070
525 H MET 28 HN MET 28 6.345 1.531 1.531
526 HA MET 28 HA MET 28 8.143 3.070 3.070
527 1HB MET 28 HB2 MET 28 10.176 2.100 2.100
528 2HB MET 28 HB1 MET 28 9.369 3.502 3.502
529 1HG MET 28 HG2 MET 28 8.001 1.904 1.904
530 2HG MET 28 HG1 MET 28 9.030 0.605 0.605
531 1HE MET 28 HE2 MET 28 9.328 4.215 4.215
532 2HE MET 28 HE1 MET 28 8.926 3.790 3.790
533 3HE MET 28 HE3 MET 28 10.553 4.353 4.353
534 H ILE 29 HN ILE 29 9.768 0.344 0.344
535 HA ILE 29 HA ILE 29 8.197 -1.557 -1.557
536 HB ILE 29 HB ILE 29 11.175 -1.530 -1.530
537 1HG1 ILE 29 HG12 ILE 29 10.430 0.892 0.892
538 2HG1 ILE 29 HG11 ILE 29 11.158 0.207 0.207
539 1HG2 ILE 29 HG21 ILE 29 8.729 -2.239 -2.239
540 2HG2 ILE 29 HG23 ILE 29 10.250 -1.937 -1.937
541 3HG2 ILE 29 HG22 ILE 29 10.148 -3.223 -3.223
542 1HD1 ILE 29 HD13 ILE 29 8.285 -0.275 -0.275
543 2HD1 ILE 29 HD12 ILE 29 8.667 1.446 1.446
544 3HD1 ILE 29 HD11 ILE 29 9.255 0.454 0.454
545 H SER 30 HN SER 30 7.736 -2.505 -2.505
546 HA SER 30 HA SER 30 9.613 -3.209 -3.209
547 1HB SER 30 HB2 SER 30 6.932 -3.827 -3.827
548 2HB SER 30 HB1 SER 30 7.748 -5.360 -5.360
549 HG SER 30 HG SER 30 8.433 -4.499 -4.499
550 H PHE 31 HN PHE 31 11.605 -3.895 -3.895
551 HA PHE 31 HA PHE 31 11.561 -6.210 -6.210
552 1HB PHE 31 HB2 PHE 31 13.563 -5.366 -5.366
553 2HB PHE 31 HB1 PHE 31 12.851 -3.887 -3.887
554 HD1 PHE 31 HD2 PHE 31 13.196 -4.242 -4.242
555 HD2 PHE 31 HD1 PHE 31 15.871 -5.132 -5.132
556 HE1 PHE 31 HE2 PHE 31 15.129 -3.989 -3.989
557 HE2 PHE 31 HE1 PHE 31 17.803 -4.885 -4.885
558 HZ PHE 31 HZ PHE 31 17.435 -4.312 -4.312
559 H THR 32 HN THR 32 13.056 -7.998 -7.998
560 HA THR 32 HA THR 32 13.710 -8.502 -8.502
561 HB THR 32 HB THR 32 13.108 -10.838 -10.838
562 HG1 THR 32 HG1 THR 32 13.753 -10.905 -10.905
563 1HG2 THR 32 HG21 THR 32 11.265 -8.597 -8.597
564 2HG2 THR 32 HG23 THR 32 10.687 -10.084 -10.084
565 3HG2 THR 32 HG22 THR 32 11.074 -10.057 -10.057
566 H TYR 33 HN TYR 33 15.914 -8.686 -8.686
567 HA TYR 33 HA TYR 33 17.520 -9.630 -9.630
568 1HB TYR 33 HB2 TYR 33 19.245 -8.069 -8.069
569 2HB TYR 33 HB1 TYR 33 17.724 -7.220 -7.220
570 HD1 TYR 33 HD2 TYR 33 16.261 -6.595 -6.595
571 HD2 TYR 33 HD1 TYR 33 20.142 -8.338 -8.338
572 HE1 TYR 33 HE2 TYR 33 16.229 -5.870 -5.870
573 HE2 TYR 33 HE1 TYR 33 20.111 -7.613 -7.613
574 HH TYR 33 HH TYR 33 18.617 -6.952 -6.952
575 H ASP 34 HN ASP 34 17.437 -9.471 -9.471
576 HA ASP 34 HA ASP 34 18.324 -12.201 -12.201
577 1HB ASP 34 HB2 ASP 34 20.293 -10.511 -10.511
578 2HB ASP 34 HB1 ASP 34 20.475 -10.372 -10.372
579 H GLU 35 HN GLU 35 19.145 -12.489 -12.489
580 HA GLU 35 HA GLU 35 18.157 -10.425 -10.425
581 1HB GLU 35 HB2 GLU 35 16.558 -12.090 -12.090
582 2HB GLU 35 HB1 GLU 35 16.129 -11.614 -11.614
583 1HG GLU 35 HG2 GLU 35 16.414 -13.712 -13.712
584 2HG GLU 35 HG1 GLU 35 17.960 -13.889 -13.889
585 H GLY 36 HN GLY 36 20.737 -11.777 -11.777
586 1HA GLY 36 HA2 GLY 36 22.293 -12.058 -12.058
587 2HA GLY 36 HA1 GLY 36 21.094 -13.172 -13.172
588 H GLY 37 HN GLY 37 20.550 -14.283 -14.283
589 1HA GLY 37 HA2 GLY 37 23.131 -15.665 -15.665
590 2HA GLY 37 HA1 GLY 37 21.701 -16.636 -16.636
591 H GLY 38 HN GLY 38 19.695 -15.593 -15.593
592 1HA GLY 38 HA2 GLY 38 19.962 -14.444 -14.444
593 2HA GLY 38 HA1 GLY 38 20.430 -16.122 -16.122
594 H LYS 39 HN LYS 39 17.984 -14.991 -14.991
595 HA LYS 39 HA LYS 39 16.006 -16.769 -16.769
596 1HB LYS 39 HB2 LYS 39 16.720 -16.330 -16.330
597 2HB LYS 39 HB1 LYS 39 15.339 -15.242 -15.242
598 1HG LYS 39 HG2 LYS 39 14.657 -17.518 -17.518
599 2HG LYS 39 HG1 LYS 39 13.942 -17.081 -17.081
600 1HD LYS 39 HD2 LYS 39 15.376 -18.494 -18.494
601 2HD LYS 39 HD1 LYS 39 16.564 -18.555 -18.555
602 1HE LYS 39 HE2 LYS 39 15.605 -20.491 -20.491
603 2HE LYS 39 HE1 LYS 39 14.146 -19.564 -19.564
604 1HZ LYS 39 HZ1 LYS 39 14.814 -20.551 -20.551
605 2HZ LYS 39 HZ3 LYS 39 13.727 -21.317 -21.317
606 3HZ LYS 39 HZ2 LYS 39 13.386 -19.758 -19.758
607 H THR 40 HN THR 40 16.456 -14.590 -14.590
608 HA THR 40 HA THR 40 15.254 -12.885 -12.885
609 HB THR 40 HB THR 40 12.907 -13.191 -13.191
610 HG1 THR 40 HG1 THR 40 12.584 -15.290 -15.290
611 1HG2 THR 40 HG22 THR 40 13.509 -12.556 -12.556
612 2HG2 THR 40 HG21 THR 40 12.507 -14.008 -14.008
613 3HG2 THR 40 HG23 THR 40 11.934 -12.543 -12.543
614 H GLY 41 HN GLY 41 13.877 -12.669 -12.669
615 1HA GLY 41 HA2 GLY 41 13.945 -10.924 -10.924
616 2HA GLY 41 HA1 GLY 41 15.494 -10.469 -10.469
617 H ARG 42 HN ARG 42 11.992 -10.047 -10.047
618 HA ARG 42 HA ARG 42 11.944 -8.245 -8.245
619 1HB ARG 42 HB2 ARG 42 9.878 -9.044 -9.044
620 2HB ARG 42 HB1 ARG 42 10.246 -9.017 -9.017
621 1HG ARG 42 HG2 ARG 42 10.095 -6.482 -6.482
622 2HG ARG 42 HG1 ARG 42 9.470 -6.671 -6.671
623 1HD ARG 42 HD2 ARG 42 7.540 -7.887 -7.887
624 2HD ARG 42 HD1 ARG 42 8.228 -8.007 -8.007
625 HE ARG 42 HE ARG 42 7.296 -5.467 -5.467
626 1HH1 ARG 42 HH11 ARG 42 9.090 -6.844 -6.844
627 2HH1 ARG 42 HH12 ARG 42 8.390 -5.856 -5.856
628 1HH2 ARG 42 HH21 ARG 42 6.068 -4.385 -4.385
629 2HH2 ARG 42 HH22 ARG 42 6.680 -4.464 -4.464
630 H GLY 43 HN GLY 43 11.203 -5.889 -5.889
631 1HA GLY 43 HA2 GLY 43 11.894 -4.345 -4.345
632 2HA GLY 43 HA1 GLY 43 13.334 -4.418 -4.418
633 H ALA 44 HN ALA 44 11.607 -2.038 -2.038
634 HA ALA 44 HA ALA 44 10.272 -1.709 -1.709
635 1HB ALA 44 HB2 ALA 44 9.754 -0.911 -0.911
636 2HB ALA 44 HB1 ALA 44 10.229 0.573 0.573
637 3HB ALA 44 HB3 ALA 44 8.889 -0.390 -0.390
638 H VAL 45 HN VAL 45 11.610 -1.013 -1.013
639 HA VAL 45 HA VAL 45 13.768 0.917 0.917
640 HB VAL 45 HB VAL 45 14.876 0.047 0.047
641 1HG1 VAL 45 HG11 VAL 45 13.703 -2.088 -2.088
642 2HG1 VAL 45 HG13 VAL 45 15.036 -2.370 -2.370
643 3HG1 VAL 45 HG12 VAL 45 15.232 -1.238 -1.238
644 1HG2 VAL 45 HG21 VAL 45 12.148 -0.973 -0.973
645 2HG2 VAL 45 HG23 VAL 45 13.414 -0.531 -0.531
646 3HG2 VAL 45 HG22 VAL 45 13.442 -2.114 -2.114
647 H SER 46 HN SER 46 13.001 2.965 2.965
648 HA SER 46 HA SER 46 11.097 3.500 3.500
649 1HB SER 46 HB2 SER 46 10.475 5.070 5.070
650 2HB SER 46 HB1 SER 46 11.793 4.573 4.573
651 HG SER 46 HG SER 46 11.673 6.631 6.631
652 H GLU 47 HN GLU 47 11.533 4.899 4.899
653 HA GLU 47 HA GLU 47 13.908 4.692 4.692
654 1HB GLU 47 HB2 GLU 47 11.965 7.008 7.008
655 2HB GLU 47 HB1 GLU 47 13.164 6.864 6.864
656 1HG GLU 47 HG2 GLU 47 12.157 4.528 4.528
657 2HG GLU 47 HG1 GLU 47 10.803 5.071 5.071
658 H LYS 48 HN LYS 48 13.250 6.865 6.865
659 HA LYS 48 HA LYS 48 15.781 8.341 8.341
660 1HB LYS 48 HB2 LYS 48 13.286 8.880 8.880
661 2HB LYS 48 HB1 LYS 48 14.275 8.657 8.657
662 1HG LYS 48 HG2 LYS 48 15.798 10.198 10.198
663 2HG LYS 48 HG1 LYS 48 14.191 10.919 10.919
664 1HD LYS 48 HD2 LYS 48 15.170 11.961 11.961
665 2HD LYS 48 HD1 LYS 48 14.576 10.506 10.506
666 1HE LYS 48 HE2 LYS 48 16.704 9.994 9.994
667 2HE LYS 48 HE1 LYS 48 17.125 9.882 9.882
668 1HZ LYS 48 HZ2 LYS 48 16.810 12.510 12.510
669 2HZ LYS 48 HZ1 LYS 48 18.282 11.670 11.670
670 3HZ LYS 48 HZ3 LYS 48 17.682 12.113 12.113
671 H ASP 49 HN ASP 49 14.754 5.471 5.471
672 HA ASP 49 HA ASP 49 16.588 5.539 5.539
673 1HB ASP 49 HB2 ASP 49 14.763 3.567 3.567
674 2HB ASP 49 HB1 ASP 49 15.909 2.997 2.997
675 H ALA 50 HN ALA 50 16.555 3.951 3.951
676 HA ALA 50 HA ALA 50 19.201 2.753 2.753
677 1HB ALA 50 HB2 ALA 50 17.205 1.878 1.878
678 2HB ALA 50 HB1 ALA 50 17.636 3.088 3.088
679 3HB ALA 50 HB3 ALA 50 18.777 1.808 1.808
680 HA PRO 51 HA PRO 51 21.585 6.090 6.090
681 1HB PRO 51 HB2 PRO 51 23.643 4.730 4.730
682 2HB PRO 51 HB1 PRO 51 23.458 4.859 4.859
683 1HG PRO 51 HG2 PRO 51 22.786 2.601 2.601
684 2HG PRO 51 HG1 PRO 51 23.458 2.574 2.574
685 1HD PRO 51 HD2 PRO 51 20.830 2.073 2.073
686 2HD PRO 51 HD1 PRO 51 21.400 2.695 2.695
687 H LYS 52 HN LYS 52 19.510 6.048 6.048
688 HA LYS 52 HA LYS 52 18.860 6.562 6.562
689 1HB LYS 52 HB2 LYS 52 21.268 7.605 7.605
690 2HB LYS 52 HB1 LYS 52 21.746 6.306 6.306
691 1HG LYS 52 HG2 LYS 52 20.020 7.059 7.059
692 2HG LYS 52 HG1 LYS 52 19.611 8.391 8.391
693 1HD LYS 52 HD2 LYS 52 22.488 8.136 8.136
694 2HD LYS 52 HD1 LYS 52 21.455 8.580 8.580
695 1HE LYS 52 HE2 LYS 52 21.048 10.006 10.006
696 2HE LYS 52 HE1 LYS 52 22.424 10.470 10.470
697 1HZ LYS 52 HZ2 LYS 52 19.761 10.059 10.059
698 2HZ LYS 52 HZ1 LYS 52 20.133 11.542 11.542
699 3HZ LYS 52 HZ3 LYS 52 21.056 10.997 10.997
700 H GLU 53 HN GLU 53 19.874 3.686 3.686
701 HA GLU 53 HA GLU 53 20.053 2.368 2.368
702 1HB GLU 53 HB2 GLU 53 21.666 2.017 2.017
703 2HB GLU 53 HB1 GLU 53 20.345 1.125 1.125
704 1HG GLU 53 HG2 GLU 53 21.790 -0.438 -0.438
705 2HG GLU 53 HG1 GLU 53 20.231 -0.341 -0.341
706 H LEU 54 HN LEU 54 17.534 3.472 3.472
707 HA LEU 54 HA LEU 54 15.927 0.992 0.992
708 1HB LEU 54 HB2 LEU 54 16.358 1.452 1.452
709 2HB LEU 54 HB1 LEU 54 15.726 3.086 3.086
710 HG LEU 54 HG LEU 54 13.595 1.871 1.871
711 1HD1 LEU 54 HD11 LEU 54 14.923 -0.363 -0.363
712 2HD1 LEU 54 HD13 LEU 54 14.581 -0.297 -0.297
713 3HD1 LEU 54 HD12 LEU 54 13.254 -0.356 -0.356
714 1HD2 LEU 54 HD22 LEU 54 14.416 2.812 2.812
715 2HD2 LEU 54 HD21 LEU 54 12.762 2.603 2.603
716 3HD2 LEU 54 HD23 LEU 54 13.565 1.297 1.297
717 H LEU 55 HN LEU 55 15.658 4.538 4.538
718 HA LEU 55 HA LEU 55 13.123 4.985 4.985
719 1HB LEU 55 HB2 LEU 55 14.067 7.207 7.207
720 2HB LEU 55 HB1 LEU 55 14.594 6.703 6.703
721 HG LEU 55 HG LEU 55 16.586 5.616 5.616
722 1HD1 LEU 55 HD12 LEU 55 15.191 7.038 7.038
723 2HD1 LEU 55 HD11 LEU 55 16.557 8.079 8.079
724 3HD1 LEU 55 HD13 LEU 55 16.839 6.423 6.423
725 1HD2 LEU 55 HD23 LEU 55 16.338 8.531 8.531
726 2HD2 LEU 55 HD22 LEU 55 16.895 7.203 7.203
727 3HD2 LEU 55 HD21 LEU 55 17.865 7.724 7.724
728 H GLN 56 HN GLN 56 16.017 3.967 3.967
729 HA GLN 56 HA GLN 56 15.076 4.636 4.636
730 1HB GLN 56 HB2 GLN 56 17.440 4.518 4.518
731 2HB GLN 56 HB1 GLN 56 17.278 2.896 2.896
732 1HG GLN 56 HG2 GLN 56 17.763 2.107 2.107
733 2HG GLN 56 HG1 GLN 56 16.178 2.694 2.694
734 1HE2 GLN 56 HE22 GLN 56 17.509 5.664 5.664
735 2HE2 GLN 56 HE21 GLN 56 16.135 5.063 5.063
736 H MET 57 HN MET 57 14.703 1.952 1.952
737 HA MET 57 HA MET 57 14.030 -0.083 -0.083
738 1HB MET 57 HB2 MET 57 14.658 -0.640 -0.640
739 2HB MET 57 HB1 MET 57 13.396 0.398 0.398
740 1HG MET 57 HG2 MET 57 11.729 -1.120 -1.120
741 2HG MET 57 HG1 MET 57 12.526 -1.748 -1.748
742 1HE MET 57 HE3 MET 57 11.004 -3.268 -3.268
743 2HE MET 57 HE2 MET 57 11.689 -4.223 -4.223
744 3HE MET 57 HE1 MET 57 11.997 -4.688 -4.688
745 H LEU 58 HN LEU 58 12.232 2.488 2.488
746 HA LEU 58 HA LEU 58 9.654 1.546 1.546
747 1HB LEU 58 HB2 LEU 58 10.111 2.630 2.630
748 2HB LEU 58 HB1 LEU 58 10.313 4.145 4.145
749 HG LEU 58 HG LEU 58 8.006 3.558 3.558
750 1HD1 LEU 58 HD13 LEU 58 8.202 1.224 1.224
751 2HD1 LEU 58 HD12 LEU 58 7.590 2.104 2.104
752 3HD1 LEU 58 HD11 LEU 58 6.636 2.030 2.030
753 1HD2 LEU 58 HD23 LEU 58 8.809 4.951 4.951
754 2HD2 LEU 58 HD22 LEU 58 7.436 5.293 5.293
755 3HD2 LEU 58 HD21 LEU 58 7.249 4.190 4.190
756 H GLU 59 HN GLU 59 12.271 3.512 3.512
757 HA GLU 59 HA GLU 59 10.871 5.466 5.466
758 1HB GLU 59 HB2 GLU 59 13.430 5.018 5.018
759 2HB GLU 59 HB1 GLU 59 13.516 4.400 4.400
760 1HG GLU 59 HG2 GLU 59 13.536 6.491 6.491
761 2HG GLU 59 HG1 GLU 59 12.043 6.879 6.879
762 H LYS 60 HN LYS 60 12.159 2.221 2.221
763 HA LYS 60 HA LYS 60 11.100 2.263 2.263
764 1HB LYS 60 HB2 LYS 60 12.753 0.377 0.377
765 2HB LYS 60 HB1 LYS 60 12.188 -0.070 -0.070
766 1HG LYS 60 HG2 LYS 60 13.364 1.787 1.787
767 2HG LYS 60 HG1 LYS 60 13.781 2.441 2.441
768 1HD LYS 60 HD2 LYS 60 15.680 1.234 1.234
769 2HD LYS 60 HD1 LYS 60 14.691 -0.223 -0.223
770 1HE LYS 60 HE2 LYS 60 14.560 0.722 0.722
771 2HE LYS 60 HE1 LYS 60 16.267 0.652 0.652
772 1HZ LYS 60 HZ3 LYS 60 15.611 -1.563 -1.563
773 2HZ LYS 60 HZ2 LYS 60 14.241 -1.498 -1.498
774 3HZ LYS 60 HZ1 LYS 60 15.797 -1.528 -1.528
775 H GLN 61 HN GLN 61 10.105 1.295 1.295
776 HA GLN 61 HA GLN 61 8.243 -0.790 -0.790
777 1HB GLN 61 HB2 GLN 61 9.250 0.225 0.225
778 2HB GLN 61 HB1 GLN 61 7.708 -0.630 -0.630
779 1HG GLN 61 HG2 GLN 61 10.073 -1.804 -1.804
780 2HG GLN 61 HG1 GLN 61 9.935 -1.989 -1.989
781 1HE2 GLN 61 HE22 GLN 61 7.819 -4.440 -4.440
782 2HE2 GLN 61 HE21 GLN 61 9.164 -3.550 -3.550
783 H LYS 62 HN LYS 62 7.108 1.135 1.135
784 HA LYS 62 HA LYS 62 4.695 1.882 1.882
785 1HB LYS 62 HB2 LYS 62 5.421 1.632 1.632
786 2HB LYS 62 HB1 LYS 62 5.741 3.359 3.359
787 1HG LYS 62 HG2 LYS 62 3.171 2.499 2.499
788 2HG LYS 62 HG1 LYS 62 3.284 2.284 2.284
789 1HD LYS 62 HD2 LYS 62 3.299 4.522 4.522
790 2HD LYS 62 HD1 LYS 62 4.348 4.855 4.855
791 1HE LYS 62 HE2 LYS 62 2.241 4.281 4.281
792 2HE LYS 62 HE1 LYS 62 1.346 4.591 4.591
793 1HZ LYS 62 HZ1 LYS 62 3.468 6.461 6.461
794 2HZ LYS 62 HZ3 LYS 62 1.999 6.551 6.551
795 3HZ LYS 62 HZ2 LYS 62 2.022 6.752 6.752
796 H LYS 63 HN LYS 63 7.861 3.099 3.099
797 HA LYS 63 HA LYS 63 8.839 4.965 4.965
798 1HB LYS 63 HB2 LYS 63 7.345 4.219 4.219
799 2HB LYS 63 HB1 LYS 63 6.038 5.193 5.193
800 1HG LYS 63 HG2 LYS 63 7.740 7.164 7.164
801 2HG LYS 63 HG1 LYS 63 8.589 6.110 6.110
802 1HD LYS 63 HD2 LYS 63 6.874 6.170 6.170
803 2HD LYS 63 HD1 LYS 63 5.638 6.491 6.491
804 1HE LYS 63 HE2 LYS 63 6.586 8.789 8.789
805 2HE LYS 63 HE1 LYS 63 7.716 8.460 8.460
806 1HZ LYS 63 HZ2 LYS 63 4.755 8.246 8.246
807 2HZ LYS 63 HZ1 LYS 63 5.681 9.519 9.519
808 3HZ LYS 63 HZ3 LYS 63 5.849 7.953 7.953
809 1H ALA 1 HT1 ALA 1 -24.371 6.001 6.001
810 2H ALA 1 HT3 ALA 1 -25.342 6.168 6.168
811 3H ALA 1 HT2 ALA 1 -23.697 5.784 5.784
812 HA ALA 1 HA ALA 1 -24.916 3.782 3.782
813 1HB ALA 1 HB3 ALA 1 -26.906 4.865 4.865
814 2HB ALA 1 HB2 ALA 1 -26.165 4.358 4.358
815 3HB ALA 1 HB1 ALA 1 -26.672 3.150 3.150
816 H THR 2 HN THR 2 -22.531 4.930 4.930
817 HA THR 2 HA THR 2 -22.172 2.606 2.606
818 HB THR 2 HB THR 2 -21.041 5.322 5.322
819 HG1 THR 2 HG1 THR 2 -22.234 3.618 3.618
820 1HG2 THR 2 HG23 THR 2 -19.069 3.774 3.774
821 2HG2 THR 2 HG22 THR 2 -19.702 3.071 3.071
822 3HG2 THR 2 HG21 THR 2 -19.201 4.762 4.762
823 H VAL 3 HN VAL 3 -20.905 4.186 4.186
824 HA VAL 3 HA VAL 3 -19.268 1.817 1.817
825 HB VAL 3 HB VAL 3 -17.818 3.245 3.245
826 1HG1 VAL 3 HG12 VAL 3 -19.402 5.283 5.283
827 2HG1 VAL 3 HG11 VAL 3 -18.112 5.527 5.527
828 3HG1 VAL 3 HG13 VAL 3 -17.743 5.542 5.542
829 1HG2 VAL 3 HG21 VAL 3 -17.154 2.306 2.306
830 2HG2 VAL 3 HG23 VAL 3 -16.043 3.318 3.318
831 3HG2 VAL 3 HG22 VAL 3 -17.019 4.027 4.027
832 H LYS 4 HN LYS 4 -18.537 1.948 1.948
833 HA LYS 4 HA LYS 4 -19.849 4.037 4.037
834 1HB LYS 4 HB2 LYS 4 -20.069 1.355 1.355
835 2HB LYS 4 HB1 LYS 4 -21.299 2.600 2.600
836 1HG LYS 4 HG2 LYS 4 -21.394 1.930 1.930
837 2HG LYS 4 HG1 LYS 4 -20.502 0.489 0.489
838 1HD LYS 4 HD2 LYS 4 -22.265 -0.057 -0.057
839 2HD LYS 4 HD1 LYS 4 -23.160 1.384 1.384
840 1HE LYS 4 HE2 LYS 4 -23.006 0.373 0.373
841 2HE LYS 4 HE1 LYS 4 -22.688 -1.150 -1.150
842 1HZ LYS 4 HZ2 LYS 4 -24.918 0.668 0.668
843 2HZ LYS 4 HZ1 LYS 4 -25.104 -0.617 -0.617
844 3HZ LYS 4 HZ3 LYS 4 -24.672 -0.933 -0.933
845 H PHE 5 HN PHE 5 -19.058 3.771 3.771
846 HA PHE 5 HA PHE 5 -16.742 2.231 2.231
847 1HB PHE 5 HB2 PHE 5 -14.959 3.749 3.749
848 2HB PHE 5 HB1 PHE 5 -15.931 3.754 3.754
849 HD1 PHE 5 HD2 PHE 5 -17.691 5.591 5.591
850 HD2 PHE 5 HD1 PHE 5 -14.603 5.736 5.736
851 HE1 PHE 5 HE2 PHE 5 -18.036 8.035 8.035
852 HE2 PHE 5 HE1 PHE 5 -14.948 8.180 8.180
853 HZ PHE 5 HZ PHE 5 -16.663 9.329 9.329
854 H LYS 6 HN LYS 6 -15.360 4.199 4.199
855 HA LYS 6 HA LYS 6 -17.287 5.644 5.644
856 1HB LYS 6 HB2 LYS 6 -17.473 3.222 3.222
857 2HB LYS 6 HB1 LYS 6 -15.765 3.256 3.256
858 1HG LYS 6 HG2 LYS 6 -16.226 5.055 5.055
859 2HG LYS 6 HG1 LYS 6 -17.935 5.007 5.007
860 1HD LYS 6 HD2 LYS 6 -18.223 2.838 2.838
861 2HD LYS 6 HD1 LYS 6 -16.486 2.535 2.535
862 1HE LYS 6 HE2 LYS 6 -16.188 4.152 4.152
863 2HE LYS 6 HE1 LYS 6 -17.890 4.642 4.642
864 1HZ LYS 6 HZ2 LYS 6 -17.354 1.789 1.789
865 2HZ LYS 6 HZ1 LYS 6 -17.074 2.736 2.736
866 3HZ LYS 6 HZ3 LYS 6 -18.610 2.721 2.721
867 H TYR 7 HN TYR 7 -16.202 7.403 7.403
868 HA TYR 7 HA TYR 7 -13.225 7.197 7.197
869 1HB TYR 7 HB2 TYR 7 -13.647 8.405 8.405
870 2HB TYR 7 HB1 TYR 7 -14.956 9.325 9.325
871 HD1 TYR 7 HD2 TYR 7 -14.497 11.169 11.169
872 HD2 TYR 7 HD1 TYR 7 -11.301 8.941 8.941
873 HE1 TYR 7 HE2 TYR 7 -12.886 12.927 12.927
874 HE2 TYR 7 HE1 TYR 7 -9.687 10.703 10.703
875 HH TYR 7 HH TYR 7 -10.079 12.776 12.776
876 H LYS 8 HN LYS 8 -12.473 8.051 8.051
877 HA LYS 8 HA LYS 8 -12.524 9.143 9.143
878 1HB LYS 8 HB2 LYS 8 -13.647 10.841 10.841
879 2HB LYS 8 HB1 LYS 8 -15.070 10.472 10.472
880 1HG LYS 8 HG2 LYS 8 -13.678 10.985 10.985
881 2HG LYS 8 HG1 LYS 8 -12.448 11.618 11.618
882 1HD LYS 8 HD2 LYS 8 -14.070 13.224 13.224
883 2HD LYS 8 HD1 LYS 8 -15.319 12.583 12.583
884 1HE LYS 8 HE2 LYS 8 -14.503 13.700 13.700
885 2HE LYS 8 HE1 LYS 8 -12.815 13.396 13.396
886 1HZ LYS 8 HZ2 LYS 8 -14.520 15.176 15.176
887 2HZ LYS 8 HZ1 LYS 8 -13.724 15.774 15.774
888 3HZ LYS 8 HZ3 LYS 8 -12.825 15.121 15.121
889 H GLY 9 HN GLY 9 -15.926 8.580 8.580
890 1HA GLY 9 HA2 GLY 9 -16.454 6.351 6.351
891 2HA GLY 9 HA1 GLY 9 -16.721 7.750 7.750
892 H GLU 10 HN GLU 10 -17.332 7.678 7.678
893 HA GLU 10 HA GLU 10 -20.269 7.597 7.597
894 1HB GLU 10 HB2 GLU 10 -19.143 9.959 9.959
895 2HB GLU 10 HB1 GLU 10 -19.044 9.708 9.708
896 1HG GLU 10 HG2 GLU 10 -21.146 10.576 10.576
897 2HG GLU 10 HG1 GLU 10 -21.629 8.960 8.960
898 H GLU 11 HN GLU 11 -21.323 6.459 6.459
899 HA GLU 11 HA GLU 11 -19.762 5.250 5.250
900 1HB GLU 11 HB2 GLU 11 -22.495 5.086 5.086
901 2HB GLU 11 HB1 GLU 11 -22.308 4.519 4.519
902 1HG GLU 11 HG2 GLU 11 -20.097 3.459 3.459
903 2HG GLU 11 HG1 GLU 11 -21.427 3.272 3.272
904 H LYS 12 HN LYS 12 -20.062 5.658 5.658
905 HA LYS 12 HA LYS 12 -21.911 7.803 7.803
906 1HB LYS 12 HB2 LYS 12 -18.904 7.895 7.895
907 2HB LYS 12 HB1 LYS 12 -19.822 8.832 8.832
908 1HG LYS 12 HG2 LYS 12 -20.246 8.980 8.980
909 2HG LYS 12 HG1 LYS 12 -19.273 10.124 10.124
910 1HD LYS 12 HD2 LYS 12 -21.275 10.631 10.631
911 2HD LYS 12 HD1 LYS 12 -22.232 9.574 9.574
912 1HE LYS 12 HE2 LYS 12 -22.463 11.943 11.943
913 2HE LYS 12 HE1 LYS 12 -21.641 11.000 11.000
914 1HZ LYS 12 HZ1 LYS 12 -20.168 12.393 12.393
915 2HZ LYS 12 HZ3 LYS 12 -20.517 13.143 13.143
916 3HZ LYS 12 HZ2 LYS 12 -19.547 11.749 11.749
917 H GLN 13 HN GLN 13 -22.373 7.724 7.724
918 HA GLN 13 HA GLN 13 -20.961 5.697 5.697
919 1HB GLN 13 HB2 GLN 13 -22.777 4.554 4.554
920 2HB GLN 13 HB1 GLN 13 -23.942 5.685 5.685
921 1HG GLN 13 HG2 GLN 13 -22.875 4.878 4.878
922 2HG GLN 13 HG1 GLN 13 -22.449 3.459 3.459
923 1HE2 GLN 13 HE22 GLN 13 -26.469 4.311 4.311
924 2HE2 GLN 13 HE21 GLN 13 -25.364 5.594 5.594
925 H VAL 14 HN VAL 14 -21.131 6.177 6.177
926 HA VAL 14 HA VAL 14 -23.002 8.334 8.334
927 HB VAL 14 HB VAL 14 -21.125 9.607 9.607
928 1HG1 VAL 14 HG11 VAL 14 -19.717 7.158 7.158
929 2HG1 VAL 14 HG13 VAL 14 -18.901 8.537 8.537
930 3HG1 VAL 14 HG12 VAL 14 -19.195 8.509 8.509
931 1HG2 VAL 14 HG22 VAL 14 -21.871 9.538 9.538
932 2HG2 VAL 14 HG21 VAL 14 -20.741 10.711 10.711
933 3HG2 VAL 14 HG23 VAL 14 -20.133 9.264 9.264
934 H ASP 15 HN ASP 15 -23.432 8.281 8.281
935 HA ASP 15 HA ASP 15 -22.820 5.739 5.739
936 1HB ASP 15 HB2 ASP 15 -24.390 6.717 6.717
937 2HB ASP 15 HB1 ASP 15 -25.051 6.804 6.804
938 H ILE 16 HN ILE 16 -22.131 6.021 6.021
939 HA ILE 16 HA ILE 16 -19.572 7.127 7.127
940 HB ILE 16 HB ILE 16 -19.793 6.442 6.442
941 1HG1 ILE 16 HG12 ILE 16 -21.835 7.828 7.828
942 2HG1 ILE 16 HG11 ILE 16 -21.857 6.234 6.234
943 1HG2 ILE 16 HG22 ILE 16 -20.247 4.714 4.714
944 2HG2 ILE 16 HG21 ILE 16 -21.855 4.660 4.660
945 3HG2 ILE 16 HG23 ILE 16 -20.440 4.246 4.246
946 1HD1 ILE 16 HD12 ILE 16 -23.139 5.427 5.427
947 2HD1 ILE 16 HD11 ILE 16 -23.318 7.125 7.125
948 3HD1 ILE 16 HD13 ILE 16 -24.015 6.529 6.529
949 H SER 17 HN SER 17 -22.641 8.680 8.680
950 HA SER 17 HA SER 17 -22.020 10.800 10.800
951 1HB SER 17 HB2 SER 17 -24.178 11.412 11.412
952 2HB SER 17 HB1 SER 17 -24.229 9.807 9.807
953 HG SER 17 HG SER 17 -24.191 12.310 12.310
954 H LYS 18 HN LYS 18 -20.595 10.195 10.195
955 HA LYS 18 HA LYS 18 -19.915 13.088 13.088
956 1HB LYS 18 HB2 LYS 18 -21.336 11.258 11.258
957 2HB LYS 18 HB1 LYS 18 -20.106 12.290 12.290
958 1HG LYS 18 HG2 LYS 18 -22.278 13.334 13.334
959 2HG LYS 18 HG1 LYS 18 -22.425 13.305 13.305
960 1HD LYS 18 HD2 LYS 18 -20.539 14.774 14.774
961 2HD LYS 18 HD1 LYS 18 -20.128 14.643 14.643
962 1HE LYS 18 HE2 LYS 18 -22.605 15.554 15.554
963 2HE LYS 18 HE1 LYS 18 -22.332 16.205 16.205
964 1HZ LYS 18 HZ3 LYS 18 -20.193 16.441 16.441
965 2HZ LYS 18 HZ2 LYS 18 -21.508 17.512 17.512
966 3HZ LYS 18 HZ1 LYS 18 -20.560 17.456 17.456
967 H ILE 19 HN ILE 19 -18.728 10.115 10.115
968 HA ILE 19 HA ILE 19 -16.357 10.397 10.397
969 HB ILE 19 HB ILE 19 -17.296 8.107 8.107
970 1HG1 ILE 19 HG12 ILE 19 -17.512 8.285 8.285
971 2HG1 ILE 19 HG11 ILE 19 -18.805 8.865 8.865
972 1HG2 ILE 19 HG23 ILE 19 -15.136 8.400 8.400
973 2HG2 ILE 19 HG22 ILE 19 -15.783 6.826 6.826
974 3HG2 ILE 19 HG21 ILE 19 -14.971 7.833 7.833
975 1HD1 ILE 19 HD13 ILE 19 -17.651 6.100 6.100
976 2HD1 ILE 19 HD12 ILE 19 -18.936 6.412 6.412
977 3HD1 ILE 19 HD11 ILE 19 -19.209 6.717 6.717
978 H LYS 20 HN LYS 20 -14.266 10.596 10.596
979 HA LYS 20 HA LYS 20 -13.838 10.316 10.316
980 1HB LYS 20 HB2 LYS 20 -14.666 12.836 12.836
981 2HB LYS 20 HB1 LYS 20 -13.133 12.993 12.993
982 1HG LYS 20 HG2 LYS 20 -15.038 11.392 11.392
983 2HG LYS 20 HG1 LYS 20 -15.680 12.996 12.996
984 1HD LYS 20 HD2 LYS 20 -13.203 13.718 13.718
985 2HD LYS 20 HD1 LYS 20 -13.323 12.224 12.224
986 1HE LYS 20 HE2 LYS 20 -15.771 13.365 13.365
987 2HE LYS 20 HE1 LYS 20 -14.719 14.791 14.791
988 1HZ LYS 20 HZ1 LYS 20 -14.077 12.341 12.341
989 2HZ LYS 20 HZ3 LYS 20 -14.735 13.750 13.750
990 3HZ LYS 20 HZ2 LYS 20 -13.190 13.790 13.790
991 H LYS 21 HN LYS 21 -12.536 12.097 12.097
992 HA LYS 21 HA LYS 21 -9.780 11.430 11.430
993 1HB LYS 21 HB2 LYS 21 -11.190 13.220 13.220
994 2HB LYS 21 HB1 LYS 21 -9.589 12.677 12.677
995 1HG LYS 21 HG2 LYS 21 -10.192 13.923 13.923
996 2HG LYS 21 HG1 LYS 21 -9.539 14.810 14.810
997 1HD LYS 21 HD2 LYS 21 -7.954 12.473 12.473
998 2HD LYS 21 HD1 LYS 21 -8.132 13.179 13.179
999 1HE LYS 21 HE2 LYS 21 -7.053 15.155 15.155
1000 2HE LYS 21 HE1 LYS 21 -7.491 14.993 14.993
1001 1HZ LYS 21 HZ2 LYS 21 -6.094 12.916 12.916
1002 2HZ LYS 21 HZ1 LYS 21 -5.492 13.418 13.418
1003 3HZ LYS 21 HZ3 LYS 21 -5.232 14.374 14.374
1004 H VAL 22 HN VAL 22 -9.210 9.316 9.316
1005 HA VAL 22 HA VAL 22 -9.541 8.414 8.414
1006 HB VAL 22 HB VAL 22 -10.578 6.367 6.367
1007 1HG1 VAL 22 HG13 VAL 22 -11.937 8.554 8.554
1008 2HG1 VAL 22 HG12 VAL 22 -11.875 8.510 8.510
1009 3HG1 VAL 22 HG11 VAL 22 -12.654 7.200 7.200
1010 1HG2 VAL 22 HG22 VAL 22 -9.517 7.248 7.248
1011 2HG2 VAL 22 HG21 VAL 22 -9.724 5.617 5.617
1012 3HG2 VAL 22 HG23 VAL 22 -11.104 6.479 6.479
1013 H TRP 23 HN TRP 23 -7.428 8.075 8.075
1014 HA TRP 23 HA TRP 23 -5.643 6.640 6.640
1015 1HB TRP 23 HB2 TRP 23 -3.826 7.767 7.767
1016 2HB TRP 23 HB1 TRP 23 -5.050 8.979 8.979
1017 HD1 TRP 23 HD1 TRP 23 -3.285 7.235 7.235
1018 HE1 TRP 23 HE1 TRP 23 -4.071 8.259 8.259
1019 HE3 TRP 23 HE3 TRP 23 -7.148 10.072 10.072
1020 HZ2 TRP 23 HZ2 TRP 23 -6.098 10.063 10.063
1021 HZ3 TRP 23 HZ3 TRP 23 -8.502 11.439 11.439
1022 HH2 TRP 23 HH2 TRP 23 -7.981 11.434 11.434
1023 H ARG 24 HN ARG 24 -3.765 5.701 5.701
1024 HA ARG 24 HA ARG 24 -5.223 4.338 4.338
1025 1HB ARG 24 HB2 ARG 24 -4.924 2.092 2.092
1026 2HB ARG 24 HB1 ARG 24 -6.029 3.144 3.144
1027 1HG ARG 24 HG2 ARG 24 -3.861 3.861 3.861
1028 2HG ARG 24 HG1 ARG 24 -3.230 2.324 2.324
1029 1HD ARG 24 HD2 ARG 24 -5.935 2.436 2.436
1030 2HD ARG 24 HD1 ARG 24 -4.451 2.316 2.316
1031 HE ARG 24 HE ARG 24 -5.069 0.375 0.375
1032 1HH1 ARG 24 HH21 ARG 24 -2.931 1.151 1.151
1033 2HH1 ARG 24 HH22 ARG 24 -2.909 -0.423 -0.423
1034 1HH2 ARG 24 HH11 ARG 24 -5.494 -1.648 -1.648
1035 2HH2 ARG 24 HH12 ARG 24 -4.361 -2.008 -2.008
1036 H VAL 25 HN VAL 25 -3.413 4.818 4.818
1037 HA VAL 25 HA VAL 25 -0.654 4.608 4.608
1038 HB VAL 25 HB VAL 25 -2.113 3.749 3.749
1039 1HG1 VAL 25 HG12 VAL 25 0.757 4.550 4.550
1040 2HG1 VAL 25 HG11 VAL 25 0.067 4.475 4.475
1041 3HG1 VAL 25 HG13 VAL 25 0.181 3.012 3.012
1042 1HG2 VAL 25 HG22 VAL 25 -2.034 6.262 6.262
1043 2HG2 VAL 25 HG21 VAL 25 -2.493 5.912 5.912
1044 3HG2 VAL 25 HG23 VAL 25 -0.819 6.352 6.352
1045 H GLY 26 HN GLY 26 -2.499 2.123 2.123
1046 1HA GLY 26 HA2 GLY 26 -1.911 -0.029 -0.029
1047 2HA GLY 26 HA1 GLY 26 -0.818 -0.075 -0.075
1048 H LYS 27 HN LYS 27 -4.145 1.074 1.074
1049 HA LYS 27 HA LYS 27 -4.873 -1.093 -1.093
1050 1HB LYS 27 HB2 LYS 27 -4.692 1.121 1.121
1051 2HB LYS 27 HB1 LYS 27 -5.659 1.820 1.820
1052 1HG LYS 27 HG2 LYS 27 -7.441 0.046 0.046
1053 2HG LYS 27 HG1 LYS 27 -6.538 0.137 0.137
1054 1HD LYS 27 HD2 LYS 27 -7.968 2.379 2.379
1055 2HD LYS 27 HD1 LYS 27 -8.232 1.793 1.793
1056 1HE LYS 27 HE2 LYS 27 -6.642 3.185 3.185
1057 2HE LYS 27 HE1 LYS 27 -5.464 2.664 2.664
1058 1HZ LYS 27 HZ2 LYS 27 -7.048 3.975 3.975
1059 2HZ LYS 27 HZ1 LYS 27 -7.468 4.801 4.801
1060 3HZ LYS 27 HZ3 LYS 27 -5.858 4.796 4.796
1061 H MET 28 HN MET 28 -6.119 1.145 1.145
1062 HA MET 28 HA MET 28 -7.791 -0.798 -0.798
1063 1HB MET 28 HB2 MET 28 -9.912 0.465 0.465
1064 2HB MET 28 HB1 MET 28 -9.186 -0.708 -0.708
1065 1HG MET 28 HG2 MET 28 -7.914 1.204 1.204
1066 2HG MET 28 HG1 MET 28 -8.871 2.304 2.304
1067 1HE MET 28 HE2 MET 28 -9.289 -0.958 -0.958
1068 2HE MET 28 HE1 MET 28 -9.024 -0.113 -0.113
1069 3HE MET 28 HE3 MET 28 -10.617 -0.778 -0.778
1070 H ILE 29 HN ILE 29 -9.455 2.130 2.130
1071 HA ILE 29 HA ILE 29 -7.745 3.548 3.548
1072 HB ILE 29 HB ILE 29 -10.683 3.394 3.394
1073 1HG1 ILE 29 HG12 ILE 29 -9.941 1.005 1.005
1074 2HG1 ILE 29 HG11 ILE 29 -10.560 1.281 1.281
1075 1HG2 ILE 29 HG21 ILE 29 -8.109 3.682 3.682
1076 2HG2 ILE 29 HG23 ILE 29 -9.565 3.164 3.164
1077 3HG2 ILE 29 HG22 ILE 29 -9.536 4.719 4.719
1078 1HD1 ILE 29 HD13 ILE 29 -7.697 1.800 1.800
1079 2HD1 ILE 29 HD12 ILE 29 -8.097 0.148 0.148
1080 3HD1 ILE 29 HD11 ILE 29 -8.581 0.755 0.755
1081 H SER 30 HN SER 30 -7.463 5.021 5.021
1082 HA SER 30 HA SER 30 -9.491 6.189 6.189
1083 1HB SER 30 HB2 SER 30 -6.751 6.626 6.626
1084 2HB SER 30 HB1 SER 30 -7.573 8.172 8.172
1085 HG SER 30 HG SER 30 -8.429 7.855 7.855
1086 H PHE 31 HN PHE 31 -11.396 6.605 6.605
1087 HA PHE 31 HA PHE 31 -11.167 8.348 8.348
1088 1HB PHE 31 HB2 PHE 31 -13.106 7.307 7.307
1089 2HB PHE 31 HB1 PHE 31 -12.465 6.051 6.051
1090 HD1 PHE 31 HD2 PHE 31 -13.049 7.147 7.147
1091 HD2 PHE 31 HD1 PHE 31 -15.434 7.138 7.138
1092 HE1 PHE 31 HE2 PHE 31 -15.106 7.280 7.280
1093 HE2 PHE 31 HE1 PHE 31 -17.489 7.276 7.276
1094 HZ PHE 31 HZ PHE 31 -17.328 7.345 7.345
1095 H THR 32 HN THR 32 -12.664 10.146 10.146
1096 HA THR 32 HA THR 32 -13.552 11.377 11.377
1097 HB THR 32 HB THR 32 -12.886 13.519 13.519
1098 HG1 THR 32 HG1 THR 32 -13.348 13.008 13.008
1099 1HG2 THR 32 HG21 THR 32 -11.045 11.279 11.279
1100 2HG2 THR 32 HG23 THR 32 -10.389 12.523 12.523
1101 3HG2 THR 32 HG22 THR 32 -10.918 12.945 12.945
1102 H TYR 33 HN TYR 33 -15.768 11.593 11.593
1103 HA TYR 33 HA TYR 33 -17.161 11.875 11.875
1104 1HB TYR 33 HB2 TYR 33 -18.965 10.561 10.561
1105 2HB TYR 33 HB1 TYR 33 -17.435 9.686 9.686
1106 HD1 TYR 33 HD2 TYR 33 -16.144 9.599 9.599
1107 HD2 TYR 33 HD1 TYR 33 -20.043 11.387 11.387
1108 HE1 TYR 33 HE2 TYR 33 -16.317 9.516 9.516
1109 HE2 TYR 33 HE1 TYR 33 -20.217 11.304 11.304
1110 HH TYR 33 HH TYR 33 -18.876 11.127 11.127
1111 H ASP 34 HN ASP 34 -17.378 12.655 12.655
1112 HA ASP 34 HA ASP 34 -18.259 15.360 15.360
1113 1HB ASP 34 HB2 ASP 34 -20.168 13.485 13.485
1114 2HB ASP 34 HB1 ASP 34 -20.496 13.802 13.802
1115 H GLU 35 HN GLU 35 -19.275 16.253 16.253
1116 HA GLU 35 HA GLU 35 -18.470 14.758 14.758
1117 1HB GLU 35 HB2 GLU 35 -16.942 16.644 16.644
1118 2HB GLU 35 HB1 GLU 35 -16.381 15.761 15.761
1119 1HG GLU 35 HG2 GLU 35 -16.573 17.581 17.581
1120 2HG GLU 35 HG1 GLU 35 -18.183 17.950 17.950
1121 H GLY 36 HN GLY 36 -20.979 15.891 15.891
1122 1HA GLY 36 HA2 GLY 36 -22.691 16.657 16.657
1123 2HA GLY 36 HA1 GLY 36 -21.539 17.918 17.918
1124 H GLY 37 HN GLY 37 -20.755 18.290 18.290
1125 1HA GLY 37 HA2 GLY 37 -23.266 19.452 19.452
1126 2HA GLY 37 HA1 GLY 37 -21.859 20.496 20.496
1127 H GLY 38 HN GLY 38 -19.757 19.148 19.148
1128 1HA GLY 38 HA2 GLY 38 -19.828 17.387 17.387
1129 2HA GLY 38 HA1 GLY 38 -20.253 18.928 18.928
1130 H LYS 39 HN LYS 39 -18.020 18.464 18.464
1131 HA LYS 39 HA LYS 39 -15.920 19.859 19.859
1132 1HB LYS 39 HB2 LYS 39 -16.854 20.102 20.102
1133 2HB LYS 39 HB1 LYS 39 -15.476 19.032 19.032
1134 1HG LYS 39 HG2 LYS 39 -14.835 21.427 21.427
1135 2HG LYS 39 HG1 LYS 39 -13.997 20.611 20.611
1136 1HD LYS 39 HD2 LYS 39 -15.314 21.643 21.643
1137 2HD LYS 39 HD1 LYS 39 -16.603 22.030 22.030
1138 1HE LYS 39 HE2 LYS 39 -15.681 24.087 24.087
1139 2HE LYS 39 HE1 LYS 39 -14.271 23.313 23.313
1140 1HZ LYS 39 HZ1 LYS 39 -14.701 23.545 23.545
1141 2HZ LYS 39 HZ3 LYS 39 -13.697 24.573 24.573
1142 3HZ LYS 39 HZ2 LYS 39 -13.325 22.920 22.920
1143 H THR 40 HN THR 40 -16.256 17.329 17.329
1144 HA THR 40 HA THR 40 -14.985 15.405 15.405
1145 HB THR 40 HB THR 40 -12.790 16.188 16.188
1146 HG1 THR 40 HG1 THR 40 -12.410 18.106 18.106
1147 1HG2 THR 40 HG22 THR 40 -13.175 14.867 14.867
1148 2HG2 THR 40 HG21 THR 40 -12.158 16.277 16.277
1149 3HG2 THR 40 HG23 THR 40 -11.671 15.074 15.074
1150 H GLY 41 HN GLY 41 -13.889 16.068 16.068
1151 1HA GLY 41 HA2 GLY 41 -14.108 14.790 14.790
1152 2HA GLY 41 HA1 GLY 41 -15.595 14.148 14.148
1153 H ARG 42 HN ARG 42 -12.086 13.707 13.707
1154 HA ARG 42 HA ARG 42 -11.874 11.399 11.399
1155 1HB ARG 42 HB2 ARG 42 -9.856 12.351 12.351
1156 2HB ARG 42 HB1 ARG 42 -10.367 12.769 12.769
1157 1HG ARG 42 HG2 ARG 42 -10.235 10.293 10.293
1158 2HG ARG 42 HG1 ARG 42 -9.475 10.054 10.054
1159 1HD ARG 42 HD2 ARG 42 -7.605 11.459 11.459
1160 2HD ARG 42 HD1 ARG 42 -8.423 11.991 11.991
1161 HE ARG 42 HE ARG 42 -7.414 9.221 9.221
1162 1HH1 ARG 42 HH11 ARG 42 -9.401 11.188 11.188
1163 2HH1 ARG 42 HH12 ARG 42 -8.819 10.565 10.565
1164 1HH2 ARG 42 HH21 ARG 42 -6.343 8.623 8.623
1165 2HH2 ARG 42 HH22 ARG 42 -7.089 9.112 9.112
1166 H GLY 43 HN GLY 43 -11.195 9.227 9.227
1167 1HA GLY 43 HA2 GLY 43 -12.088 8.312 8.312
1168 2HA GLY 43 HA1 GLY 43 -13.436 8.101 8.101
1169 H ALA 44 HN ALA 44 -11.777 5.950 5.950
1170 HA ALA 44 HA ALA 44 -10.231 4.962 4.962
1171 1HB ALA 44 HB2 ALA 44 -9.942 4.882 4.882
1172 2HB ALA 44 HB1 ALA 44 -10.366 3.229 3.229
1173 3HB ALA 44 HB3 ALA 44 -8.968 4.009 4.009
1174 H VAL 45 HN VAL 45 -11.441 3.855 3.855
1175 HA VAL 45 HA VAL 45 -13.665 2.143 2.143
1176 HB VAL 45 HB VAL 45 -14.594 2.449 2.449
1177 1HG1 VAL 45 HG11 VAL 45 -13.553 4.995 4.995
1178 2HG1 VAL 45 HG13 VAL 45 -14.785 4.959 4.959
1179 3HG1 VAL 45 HG12 VAL 45 -15.104 4.213 4.213
1180 1HG2 VAL 45 HG21 VAL 45 -11.823 3.335 3.335
1181 2HG2 VAL 45 HG23 VAL 45 -12.994 2.596 2.596
1182 3HG2 VAL 45 HG22 VAL 45 -13.069 4.326 4.326
1183 H SER 46 HN SER 46 -12.896 0.074 0.074
1184 HA SER 46 HA SER 46 -10.818 -0.992 -0.992
1185 1HB SER 46 HB2 SER 46 -10.340 -2.116 -2.116
1186 2HB SER 46 HB1 SER 46 -11.734 -1.373 -1.373
1187 HG SER 46 HG SER 46 -11.484 -3.853 -3.853
1188 H GLU 47 HN GLU 47 -11.123 -2.801 -2.801
1189 HA GLU 47 HA GLU 47 -13.370 -2.992 -2.992
1190 1HB GLU 47 HB2 GLU 47 -11.478 -5.149 -5.149
1191 2HB GLU 47 HB1 GLU 47 -12.564 -5.356 -5.356
1192 1HG GLU 47 HG2 GLU 47 -11.498 -3.202 -3.202
1193 2HG GLU 47 HG1 GLU 47 -10.239 -3.451 -3.451
1194 H LYS 48 HN LYS 48 -12.963 -4.380 -4.380
1195 HA LYS 48 HA LYS 48 -15.470 -5.933 -5.933
1196 1HB LYS 48 HB2 LYS 48 -13.079 -6.149 -6.149
1197 2HB LYS 48 HB1 LYS 48 -14.182 -5.569 -5.569
1198 1HG LYS 48 HG2 LYS 48 -15.563 -7.555 -7.555
1199 2HG LYS 48 HG1 LYS 48 -13.977 -8.208 -8.208
1200 1HD LYS 48 HD2 LYS 48 -15.115 -8.755 -8.755
1201 2HD LYS 48 HD1 LYS 48 -14.572 -7.135 -7.135
1202 1HE LYS 48 HE2 LYS 48 -16.734 -6.512 -6.512
1203 2HE LYS 48 HE1 LYS 48 -17.011 -6.856 -6.856
1204 1HZ LYS 48 HZ2 LYS 48 -16.835 -9.051 -9.051
1205 2HZ LYS 48 HZ1 LYS 48 -18.303 -8.225 -8.225
1206 3HZ LYS 48 HZ3 LYS 48 -17.581 -9.044 -9.044
1207 H ASP 49 HN ASP 49 -14.542 -2.749 -2.749
1208 HA ASP 49 HA ASP 49 -16.559 -2.248 -2.248
1209 1HB ASP 49 HB2 ASP 49 -14.604 -0.675 -0.675
1210 2HB ASP 49 HB1 ASP 49 -15.842 0.180 0.180
1211 H ALA 50 HN ALA 50 -16.242 -1.545 -1.545
1212 HA ALA 50 HA ALA 50 -18.899 -0.315 -0.315
1213 1HB ALA 50 HB2 ALA 50 -16.789 0.199 0.199
1214 2HB ALA 50 HB1 ALA 50 -17.129 -1.290 -1.290
1215 3HB ALA 50 HB3 ALA 50 -18.288 0.038 0.038
1216 HA PRO 51 HA PRO 51 -21.180 -3.972 -3.972
1217 1HB PRO 51 HB2 PRO 51 -23.117 -2.991 -2.991
1218 2HB PRO 51 HB1 PRO 51 -23.081 -2.656 -2.656
1219 1HG PRO 51 HG2 PRO 51 -22.236 -0.938 -0.938
1220 2HG PRO 51 HG1 PRO 51 -23.042 -0.495 -0.495
1221 1HD PRO 51 HD2 PRO 51 -20.370 -0.132 -0.132
1222 2HD PRO 51 HD1 PRO 51 -21.075 -0.333 -0.333
1223 H LYS 52 HN LYS 52 -18.977 -4.335 -4.335
1224 HA LYS 52 HA LYS 52 -18.149 -5.400 -5.400
1225 1HB LYS 52 HB2 LYS 52 -20.586 -6.356 -6.356
1226 2HB LYS 52 HB1 LYS 52 -20.956 -5.392 -5.392
1227 1HG LYS 52 HG2 LYS 52 -19.110 -6.522 -6.522
1228 2HG LYS 52 HG1 LYS 52 -18.807 -7.521 -7.521
1229 1HD LYS 52 HD2 LYS 52 -21.618 -7.474 -7.474
1230 2HD LYS 52 HD1 LYS 52 -20.481 -8.244 -8.244
1231 1HE LYS 52 HE2 LYS 52 -20.308 -8.938 -8.938
1232 2HE LYS 52 HE1 LYS 52 -21.597 -9.668 -9.668
1233 1HZ LYS 52 HZ2 LYS 52 -18.838 -9.549 -9.549
1234 2HZ LYS 52 HZ1 LYS 52 -19.288 -10.793 -10.793
1235 3HZ LYS 52 HZ3 LYS 52 -20.090 -10.619 -10.619
1236 H GLU 53 HN GLU 53 -19.217 -2.364 -2.364
1237 HA GLU 53 HA GLU 53 -19.158 -1.788 -1.788
1238 1HB GLU 53 HB2 GLU 53 -20.926 -0.951 -0.951
1239 2HB GLU 53 HB1 GLU 53 -19.662 0.121 0.121
1240 1HG GLU 53 HG2 GLU 53 -20.986 1.303 1.303
1241 2HG GLU 53 HG1 GLU 53 -19.365 1.014 1.014
1242 H LEU 54 HN LEU 54 -16.777 -2.460 -2.460
1243 HA LEU 54 HA LEU 54 -15.124 -0.123 -0.123
1244 1HB LEU 54 HB2 LEU 54 -15.757 0.048 0.048
1245 2HB LEU 54 HB1 LEU 54 -15.129 -1.576 -1.576
1246 HG LEU 54 HG LEU 54 -12.916 -0.615 -0.615
1247 1HD1 LEU 54 HD11 LEU 54 -14.226 1.558 1.558
1248 2HD1 LEU 54 HD13 LEU 54 -14.028 1.947 1.947
1249 3HD1 LEU 54 HD12 LEU 54 -12.609 1.717 1.717
1250 1HD2 LEU 54 HD22 LEU 54 -13.954 -0.876 -0.876
1251 2HD2 LEU 54 HD21 LEU 54 -12.256 -0.803 -0.803
1252 3HD2 LEU 54 HD23 LEU 54 -13.115 0.675 0.675
1253 H LEU 55 HN LEU 55 -14.933 -3.423 -3.423
1254 HA LEU 55 HA LEU 55 -12.323 -4.104 -4.104
1255 1HB LEU 55 HB2 LEU 55 -13.234 -6.426 -6.426
1256 2HB LEU 55 HB1 LEU 55 -13.888 -5.529 -5.529
1257 HG LEU 55 HG LEU 55 -15.742 -4.871 -4.871
1258 1HD1 LEU 55 HD12 LEU 55 -14.205 -6.737 -6.737
1259 2HD1 LEU 55 HD11 LEU 55 -15.608 -7.655 -7.655
1260 3HD1 LEU 55 HD13 LEU 55 -15.830 -6.199 -6.199
1261 1HD2 LEU 55 HD23 LEU 55 -15.597 -7.473 -7.473
1262 2HD2 LEU 55 HD22 LEU 55 -16.221 -5.932 -5.932
1263 3HD2 LEU 55 HD21 LEU 55 -17.078 -6.802 -6.802
1264 H GLN 56 HN GLN 56 -15.056 -3.588 -3.588
1265 HA GLN 56 HA GLN 56 -13.902 -4.920 -4.920
1266 1HB GLN 56 HB2 GLN 56 -16.296 -4.710 -4.710
1267 2HB GLN 56 HB1 GLN 56 -16.173 -2.967 -2.967
1268 1HG GLN 56 HG2 GLN 56 -16.474 -2.745 -2.745
1269 2HG GLN 56 HG1 GLN 56 -14.860 -3.427 -3.427
1270 1HE2 GLN 56 HE22 GLN 56 -16.090 -6.710 -6.710
1271 2HE2 GLN 56 HE21 GLN 56 -14.781 -5.908 -5.908
1272 H MET 57 HN MET 57 -13.686 -1.749 -1.749
1273 HA MET 57 HA MET 57 -12.834 -0.279 -0.279
1274 1HB MET 57 HB2 MET 57 -13.643 0.841 0.841
1275 2HB MET 57 HB1 MET 57 -12.449 0.028 0.028
1276 1HG MET 57 HG2 MET 57 -10.740 1.403 1.403
1277 2HG MET 57 HG1 MET 57 -11.408 1.622 1.622
1278 1HE MET 57 HE3 MET 57 -10.065 3.698 3.698
1279 2HE MET 57 HE2 MET 57 -10.628 4.280 4.280
1280 3HE MET 57 HE1 MET 57 -11.067 5.153 5.153
1281 H LEU 58 HN LEU 58 -11.201 -2.326 -2.326
1282 HA LEU 58 HA LEU 58 -8.534 -1.662 -1.662
1283 1HB LEU 58 HB2 LEU 58 -9.191 -2.120 -2.120
1284 2HB LEU 58 HB1 LEU 58 -9.335 -3.814 -3.814
1285 HG LEU 58 HG LEU 58 -6.941 -3.497 -3.497
1286 1HD1 LEU 58 HD13 LEU 58 -7.213 -0.935 -0.935
1287 2HD1 LEU 58 HD12 LEU 58 -6.728 -1.414 -1.414
1288 3HD1 LEU 58 HD11 LEU 58 -5.653 -1.716 -1.716
1289 1HD2 LEU 58 HD23 LEU 58 -7.956 -4.230 -4.230
1290 2HD2 LEU 58 HD22 LEU 58 -6.509 -4.827 -4.827
1291 3HD2 LEU 58 HD21 LEU 58 -6.413 -3.405 -3.405
1292 H GLU 59 HN GLU 59 -11.080 -3.850 -3.850
1293 HA GLU 59 HA GLU 59 -9.574 -6.135 -6.135
1294 1HB GLU 59 HB2 GLU 59 -12.184 -5.524 -5.524
1295 2HB GLU 59 HB1 GLU 59 -12.124 -5.358 -5.358
1296 1HG GLU 59 HG2 GLU 59 -12.102 -7.592 -7.592
1297 2HG GLU 59 HG1 GLU 59 -10.689 -7.729 -7.729
1298 H LYS 60 HN LYS 60 -10.768 -3.188 -3.188
1299 HA LYS 60 HA LYS 60 -9.482 -3.934 -3.934
1300 1HB LYS 60 HB2 LYS 60 -11.252 -1.693 -1.693
1301 2HB LYS 60 HB1 LYS 60 -10.548 -1.670 -1.670
1302 1HG LYS 60 HG2 LYS 60 -11.654 -3.737 -3.737
1303 2HG LYS 60 HG1 LYS 60 -12.209 -3.965 -3.965
1304 1HD LYS 60 HD2 LYS 60 -14.082 -2.841 -2.841
1305 2HD LYS 60 HD1 LYS 60 -13.091 -1.395 -1.395
1306 1HE LYS 60 HE2 LYS 60 -12.750 -3.010 -3.010
1307 2HE LYS 60 HE1 LYS 60 -14.489 -2.831 -2.831
1308 1HZ LYS 60 HZ3 LYS 60 -13.892 -0.408 -0.408
1309 2HZ LYS 60 HZ2 LYS 60 -12.448 -0.720 -0.720
1310 3HZ LYS 60 HZ1 LYS 60 -13.945 -0.882 -0.882
1311 H GLN 61 HN GLN 61 -8.743 -2.168 -2.168
1312 HA GLN 61 HA GLN 61 -6.782 -0.395 -0.395
1313 1HB GLN 61 HB2 GLN 61 -8.015 -0.701 -0.701
1314 2HB GLN 61 HB1 GLN 61 -6.468 0.135 0.135
1315 1HG GLN 61 HG2 GLN 61 -8.692 0.870 0.870
1316 2HG GLN 61 HG1 GLN 61 -8.696 1.507 1.507
1317 1HE2 GLN 61 HE22 GLN 61 -6.369 3.291 3.291
1318 2HE2 GLN 61 HE21 GLN 61 -7.678 2.282 2.282
1319 H LYS 62 HN LYS 62 -5.890 -1.556 -1.556
1320 HA LYS 62 HA LYS 62 -3.379 -2.607 -2.607
1321 1HB LYS 62 HB2 LYS 62 -4.313 -1.708 -1.708
1322 2HB LYS 62 HB1 LYS 62 -4.636 -3.422 -3.422
1323 1HG LYS 62 HG2 LYS 62 -1.970 -2.864 -2.864
1324 2HG LYS 62 HG1 LYS 62 -2.225 -2.201 -2.201
1325 1HD LYS 62 HD2 LYS 62 -2.301 -4.258 -4.258
1326 2HD LYS 62 HD1 LYS 62 -3.233 -4.950 -4.950
1327 1HE LYS 62 HE2 LYS 62 -1.004 -4.746 -4.746
1328 2HE LYS 62 HE1 LYS 62 -0.245 -4.648 -4.648
1329 1HZ LYS 62 HZ1 LYS 62 -2.317 -6.672 -6.672
1330 2HZ LYS 62 HZ3 LYS 62 -0.786 -6.963 -6.963
1331 3HZ LYS 62 HZ2 LYS 62 -0.948 -6.723 -6.723
1332 H LYS 63 HN LYS 63 -6.544 -3.829 -3.829
1333 HA LYS 63 HA LYS 63 -7.455 -5.901 -5.901
1334 1HB LYS 63 HB2 LYS 63 -5.805 -5.640 -5.640
1335 2HB LYS 63 HB1 LYS 63 -4.569 -6.392 -6.392
1336 1HG LYS 63 HG2 LYS 63 -6.273 -8.358 -8.358
1337 2HG LYS 63 HG1 LYS 63 -7.013 -7.644 -7.644
1338 1HD LYS 63 HD2 LYS 63 -5.175 -8.088 -8.088
1339 2HD LYS 63 HD1 LYS 63 -4.048 -8.068 -8.068
1340 1HE LYS 63 HE2 LYS 63 -5.044 -10.218 -10.218
1341 2HE LYS 63 HE1 LYS 63 -6.056 -10.257 -10.257
1342 1HZ LYS 63 HZ2 LYS 63 -3.089 -10.058 -10.058
1343 2HZ LYS 63 HZ1 LYS 63 -3.969 -11.467 -11.467
1344 3HZ LYS 63 HZ3 LYS 63 -4.072 -10.123 -10.123