Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
2345 | 1bqx RC | 4229 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
1 1H ALA 1 1H ALA 1 -6.311 1.856 8.239
2 2H ALA 1 2H ALA 1 -6.281 3.368 8.364
3 3H ALA 1 3H ALA 1 -7.569 2.665 7.979
4 HA ALA 1 HA ALA 1 -7.012 2.631 5.658
5 1HB ALA 1 1HB ALA 1 -5.927 4.705 6.224
6 2HB ALA 1 2HB ALA 1 -4.406 3.843 6.571
7 3HB ALA 1 3HB ALA 1 -5.094 3.812 4.926
8 H TYR 2 H TYR 2 -5.753 1.493 4.047
9 HA TYR 2 HA TYR 2 -4.496 -0.975 5.142
10 1HB TYR 2 1HB TYR 2 -6.081 -0.323 2.650
11 2HB TYR 2 2HB TYR 2 -5.003 -1.703 2.690
12 HD1 TYR 2 HD1 TYR 2 -7.821 -0.196 4.683
13 HD2 TYR 2 HD2 TYR 2 -5.787 -3.786 3.414
14 HE1 TYR 2 HE1 TYR 2 -9.519 -1.557 5.830
15 HE2 TYR 2 HE2 TYR 2 -7.528 -5.153 4.519
16 HH TYR 2 HH TYR 2 -10.305 -3.679 6.216
17 H VAL 3 H VAL 3 -2.495 -1.563 4.567
18 HA VAL 3 HA VAL 3 -0.993 0.197 2.680
19 HB VAL 3 HB VAL 3 -0.024 -0.579 5.463
20 1HG1 VAL 3 1HG1 VAL 3 0.945 1.369 3.321
21 2HG1 VAL 3 2HG1 VAL 3 1.598 1.305 4.966
22 3HG1 VAL 3 3HG1 VAL 3 1.815 -0.068 3.893
23 1HG2 VAL 3 1HG2 VAL 3 -1.240 2.010 4.438
24 2HG2 VAL 3 2HG2 VAL 3 -1.903 0.990 5.739
25 3HG2 VAL 3 3HG2 VAL 3 -0.390 1.861 5.991
26 H ILE 4 H ILE 4 0.718 -0.674 1.598
27 HA ILE 4 HA ILE 4 0.933 -3.497 1.201
28 HB ILE 4 HB ILE 4 2.700 -2.832 -0.308
29 1HG1 ILE 4 1HG1 ILE 4 3.157 -0.341 -0.649
30 2HG1 ILE 4 2HG1 ILE 4 2.590 -0.079 0.994
31 1HG2 ILE 4 1HG2 ILE 4 0.310 -2.464 -0.965
32 2HG2 ILE 4 2HG2 ILE 4 0.522 -0.746 -0.569
33 3HG2 ILE 4 3HG2 ILE 4 1.487 -1.490 -1.853
34 1HD1 ILE 4 1HD1 ILE 4 4.851 -2.003 0.267
35 2HD1 ILE 4 2HD1 ILE 4 5.105 -0.276 0.597
36 3HD1 ILE 4 3HD1 ILE 4 4.502 -1.322 1.870
37 H THR 5 H THR 5 3.313 -4.480 1.333
38 HA THR 5 HA THR 5 4.852 -3.358 3.583
39 HB THR 5 HB THR 5 4.990 -5.560 4.729
40 HG1 THR 5 HG1 THR 5 2.609 -6.229 3.345
41 1HG2 THR 5 1HG2 THR 5 3.536 -3.707 5.524
42 2HG2 THR 5 2HG2 THR 5 2.154 -4.470 4.697
43 3HG2 THR 5 3HG2 THR 5 2.987 -5.344 5.987
44 H GLU 6 H GLU 6 5.211 -6.634 2.670
45 HA GLU 6 HA GLU 6 7.887 -6.010 1.435
46 1HB GLU 6 1HB GLU 6 8.108 -6.228 3.688
47 2HB GLU 6 2HB GLU 6 7.231 -7.727 3.806
48 1HG GLU 6 1HG GLU 6 9.017 -8.914 2.820
49 2HG GLU 6 2HG GLU 6 9.671 -7.476 2.073
50 HA PRO 7 HA PRO 7 6.730 -10.001 -0.715
51 1HB PRO 7 1HB PRO 7 4.037 -10.970 -0.155
52 2HB PRO 7 2HB PRO 7 5.597 -11.760 0.150
53 1HG PRO 7 1HG PRO 7 3.803 -10.643 2.086
54 2HG PRO 7 2HG PRO 7 5.444 -11.286 2.355
55 1HD PRO 7 1HD PRO 7 4.538 -8.478 2.207
56 2HD PRO 7 2HD PRO 7 6.040 -9.177 2.878
57 H CYS 8 H CYS 8 5.900 -7.232 -0.991
58 HA CYS 8 HA CYS 8 4.071 -7.344 -3.289
59 1HB CYS 8 1HB CYS 8 3.089 -5.972 -1.619
60 2HB CYS 8 2HB CYS 8 4.665 -5.355 -1.117
61 H ILE 9 H ILE 9 7.300 -6.456 -2.034
62 HA ILE 9 HA ILE 9 8.093 -4.712 -4.136
63 HB ILE 9 HB ILE 9 9.444 -6.361 -1.971
64 1HG1 ILE 9 1HG1 ILE 9 10.336 -3.782 -1.752
65 2HG1 ILE 9 2HG1 ILE 9 8.782 -3.497 -2.506
66 1HG2 ILE 9 1HG2 ILE 9 10.955 -4.817 -4.116
67 2HG2 ILE 9 2HG2 ILE 9 11.641 -5.479 -2.621
68 3HG2 ILE 9 3HG2 ILE 9 11.011 -6.575 -3.847
69 1HD1 ILE 9 1HD1 ILE 9 9.302 -5.060 0.038
70 2HD1 ILE 9 2HD1 ILE 9 8.647 -3.417 -0.057
71 3HD1 ILE 9 3HD1 ILE 9 7.684 -4.773 -0.672
72 H GLY 10 H GLY 10 9.046 -5.071 -6.114
73 1HA GLY 10 1HA GLY 10 9.871 -7.420 -7.295
74 2HA GLY 10 2HA GLY 10 8.109 -7.598 -7.280
75 H THR 11 H THR 11 10.509 -5.036 -8.001
76 HA THR 11 HA THR 11 10.327 -3.372 -9.559
77 HB THR 11 HB THR 11 11.280 -5.758 -11.046
78 HG1 THR 11 HG1 THR 11 12.206 -4.455 -8.735
79 1HG2 THR 11 1HG2 THR 11 12.183 -2.836 -10.927
80 2HG2 THR 11 2HG2 THR 11 13.012 -4.124 -11.822
81 3HG2 THR 11 3HG2 THR 11 11.383 -3.620 -12.309
82 H LYS 12 H LYS 12 8.237 -2.812 -9.777
83 HA LYS 12 HA LYS 12 6.761 -1.821 -10.988
84 1HB LYS 12 1HB LYS 12 8.663 -1.832 -12.748
85 2HB LYS 12 2HB LYS 12 7.733 -3.085 -13.559
86 1HG LYS 12 1HG LYS 12 7.103 -1.026 -14.594
87 2HG LYS 12 2HG LYS 12 5.748 -1.512 -13.579
88 1HD LYS 12 1HD LYS 12 5.986 0.833 -13.254
89 2HD LYS 12 2HD LYS 12 6.625 0.117 -11.796
90 1HE LYS 12 1HE LYS 12 8.981 0.325 -13.014
91 2HE LYS 12 2HE LYS 12 8.114 1.433 -14.090
92 1HZ LYS 12 1HZ LYS 12 7.500 2.678 -12.022
93 2HZ LYS 12 2HZ LYS 12 8.411 1.644 -11.164
94 3HZ LYS 12 3HZ LYS 12 9.134 2.620 -12.217
95 H CYS 13 H CYS 13 5.711 -3.535 -9.602
96 HA CYS 13 HA CYS 13 4.008 -5.478 -10.870
97 1HB CYS 13 1HB CYS 13 4.471 -5.351 -8.439
98 2HB CYS 13 2HB CYS 13 3.636 -3.793 -8.447
99 H ALA 14 H ALA 14 1.691 -5.115 -11.370
100 HA ALA 14 HA ALA 14 0.672 -2.363 -11.464
101 1HB ALA 14 1HB ALA 14 0.970 -3.987 -14.027
102 2HB ALA 14 2HB ALA 14 0.043 -2.482 -13.845
103 3HB ALA 14 3HB ALA 14 1.805 -2.467 -13.636
104 H SER 15 H SER 15 -0.898 -3.009 -10.027
105 HA SER 15 HA SER 15 -3.164 -4.407 -11.157
106 1HB SER 15 1HB SER 15 -1.781 -5.655 -8.750
107 2HB SER 15 2HB SER 15 -3.408 -6.060 -9.293
108 HG SER 15 HG SER 15 -1.598 -6.214 -11.319
109 H CYS 16 H CYS 16 -1.788 -3.404 -7.949
110 HA CYS 16 HA CYS 16 -4.275 -2.142 -7.133
111 1HB CYS 16 1HB CYS 16 -2.980 -1.365 -5.235
112 2HB CYS 16 2HB CYS 16 -2.869 -3.127 -5.454
113 H VAL 17 H VAL 17 -4.158 -1.053 -9.423
114 HA VAL 17 HA VAL 17 -3.013 1.688 -9.093
115 HB VAL 17 HB VAL 17 -3.045 0.106 -11.623
116 1HG1 VAL 17 1HG1 VAL 17 -3.325 2.574 -11.969
117 2HG1 VAL 17 2HG1 VAL 17 -1.876 2.850 -10.980
118 3HG1 VAL 17 3HG1 VAL 17 -1.754 2.001 -12.535
119 1HG2 VAL 17 1HG2 VAL 17 -0.797 0.765 -9.748
120 2HG2 VAL 17 2HG2 VAL 17 -1.349 -0.838 -10.260
121 3HG2 VAL 17 3HG2 VAL 17 -0.562 0.227 -11.430
122 H GLU 18 H GLU 18 -5.027 0.533 -11.820
123 HA GLU 18 HA GLU 18 -6.693 2.828 -11.446
124 1HB GLU 18 1HB GLU 18 -7.698 2.165 -13.513
125 2HB GLU 18 2HB GLU 18 -5.937 2.084 -13.617
126 1HG GLU 18 1HG GLU 18 -7.387 -0.441 -12.870
127 2HG GLU 18 2HG GLU 18 -7.576 0.146 -14.525
128 H VAL 19 H VAL 19 -6.993 1.049 -9.239
129 HA VAL 19 HA VAL 19 -9.884 0.309 -9.411
130 HB VAL 19 HB VAL 19 -8.372 -1.626 -9.261
131 1HG1 VAL 19 1HG1 VAL 19 -6.604 -0.417 -7.773
132 2HG1 VAL 19 2HG1 VAL 19 -7.667 -0.849 -6.418
133 3HG1 VAL 19 3HG1 VAL 19 -6.975 -2.112 -7.451
134 1HG2 VAL 19 1HG2 VAL 19 -10.150 -1.114 -6.838
135 2HG2 VAL 19 2HG2 VAL 19 -10.631 -1.809 -8.399
136 3HG2 VAL 19 3HG2 VAL 19 -9.542 -2.693 -7.316
137 H CYS 20 H CYS 20 -7.330 2.027 -7.542
138 HA CYS 20 HA CYS 20 -8.800 2.030 -5.181
139 1HB CYS 20 1HB CYS 20 -6.418 2.457 -5.229
140 2HB CYS 20 2HB CYS 20 -6.794 3.968 -6.070
141 HA PRO 21 HA PRO 21 -12.168 4.864 -6.181
142 1HB PRO 21 1HB PRO 21 -11.889 5.307 -3.195
143 2HB PRO 21 2HB PRO 21 -13.387 5.131 -4.151
144 1HG PRO 21 1HG PRO 21 -12.394 3.025 -2.750
145 2HG PRO 21 2HG PRO 21 -12.976 2.778 -4.425
146 1HD PRO 21 1HD PRO 21 -10.092 3.099 -3.508
147 2HD PRO 21 2HD PRO 21 -10.826 1.964 -4.686
148 H VAL 22 H VAL 22 -9.352 5.908 -4.217
149 HA VAL 22 HA VAL 22 -9.814 8.720 -5.104
150 HB VAL 22 HB VAL 22 -8.512 8.573 -2.490
151 1HG1 VAL 22 1HG1 VAL 22 -9.547 10.580 -3.529
152 2HG1 VAL 22 2HG1 VAL 22 -11.144 9.805 -3.404
153 3HG1 VAL 22 3HG1 VAL 22 -10.233 10.216 -1.935
154 1HG2 VAL 22 1HG2 VAL 22 -11.307 7.412 -2.539
155 2HG2 VAL 22 2HG2 VAL 22 -9.805 6.560 -2.058
156 3HG2 VAL 22 3HG2 VAL 22 -10.385 7.947 -1.132
157 H ASP 23 H ASP 23 -8.089 6.601 -6.238
158 HA ASP 23 HA ASP 23 -5.913 6.296 -6.897
159 1HB ASP 23 1HB ASP 23 -7.006 7.947 -8.395
160 2HB ASP 23 2HB ASP 23 -6.324 9.266 -7.421
161 H CYS 24 H CYS 24 -5.315 6.030 -4.456
162 HA CYS 24 HA CYS 24 -3.164 8.014 -3.774
163 1HB CYS 24 1HB CYS 24 -3.560 7.702 -1.508
164 2HB CYS 24 2HB CYS 24 -5.130 8.057 -2.270
165 HG CYS 24 HG CYS 24 -3.809 5.343 -1.031
166 H ILE 25 H ILE 25 -2.907 5.805 -5.541
167 HA ILE 25 HA ILE 25 -1.009 4.026 -4.108
168 HB ILE 25 HB ILE 25 -1.445 2.617 -6.323
169 1HG1 ILE 25 1HG1 ILE 25 -3.820 2.425 -6.827
170 2HG1 ILE 25 2HG1 ILE 25 -4.203 3.855 -5.877
171 1HG2 ILE 25 1HG2 ILE 25 -3.238 2.632 -3.879
172 2HG2 ILE 25 2HG2 ILE 25 -3.061 1.255 -4.977
173 3HG2 ILE 25 3HG2 ILE 25 -1.664 1.805 -4.051
174 1HD1 ILE 25 1HD1 ILE 25 -2.388 3.871 -8.335
175 2HD1 ILE 25 2HD1 ILE 25 -4.124 4.237 -8.361
176 3HD1 ILE 25 3HD1 ILE 25 -3.030 5.292 -7.480
177 H HIS 26 H HIS 26 1.029 4.642 -4.444
178 HA HIS 26 HA HIS 26 1.769 6.197 -6.882
179 1HB HIS 26 1HB HIS 26 2.641 6.304 -3.958
180 2HB HIS 26 2HB HIS 26 3.211 7.356 -5.264
181 HD1 HIS 26 HD1 HIS 26 0.956 8.752 -6.505
182 HD2 HIS 26 HD2 HIS 26 0.509 7.124 -2.654
183 HE1 HIS 26 HE1 HIS 26 -1.125 9.822 -5.496
184 H GLU 27 H GLU 27 3.904 5.713 -7.710
185 HA GLU 27 HA GLU 27 4.990 3.115 -6.861
186 1HB GLU 27 1HB GLU 27 5.700 5.009 -9.109
187 2HB GLU 27 2HB GLU 27 6.687 3.601 -8.694
188 1HG GLU 27 1HG GLU 27 4.862 2.068 -9.007
189 2HG GLU 27 2HG GLU 27 3.754 3.408 -9.304
190 H GLY 28 H GLY 28 6.780 2.712 -5.816
191 1HA GLY 28 1HA GLY 28 8.693 4.887 -5.009
192 2HA GLY 28 2HA GLY 28 8.467 3.339 -4.165
193 H GLU 29 H GLU 29 8.489 4.073 -7.583
194 HA GLU 29 HA GLU 29 9.369 3.423 -9.363
195 1HB GLU 29 1HB GLU 29 11.572 3.964 -7.864
196 2HB GLU 29 2HB GLU 29 11.904 2.284 -8.195
197 1HG GLU 29 1HG GLU 29 12.278 4.694 -9.824
198 2HG GLU 29 2HG GLU 29 13.096 3.142 -9.861
199 H ASP 30 H ASP 30 10.345 1.054 -6.938
200 HA ASP 30 HA ASP 30 10.187 -1.212 -8.768
201 1HB ASP 30 1HB ASP 30 11.862 -1.181 -6.983
202 2HB ASP 30 2HB ASP 30 10.593 -1.098 -5.750
203 H GLN 31 H GLN 31 7.991 0.213 -6.339
204 HA GLN 31 HA GLN 31 5.987 -1.900 -6.791
205 1HB GLN 31 1HB GLN 31 5.900 -2.224 -4.274
206 2HB GLN 31 2HB GLN 31 7.337 -2.858 -5.050
207 1HG GLN 31 1HG GLN 31 8.758 -1.463 -4.008
208 2HG GLN 31 2HG GLN 31 7.742 -0.042 -4.185
209 1HE2 GLN 31 2HE2 GLN 31 5.446 -0.771 -2.829
210 2HE2 GLN 31 1HE2 GLN 31 5.853 -0.952 -1.136
211 H TYR 32 H TYR 32 3.930 -1.246 -5.893
212 HA TYR 32 HA TYR 32 3.596 1.646 -5.831
213 1HB TYR 32 1HB TYR 32 1.709 -0.679 -5.750
214 2HB TYR 32 2HB TYR 32 1.165 0.923 -5.295
215 HD1 TYR 32 HD1 TYR 32 2.817 -0.928 -8.136
216 HD2 TYR 32 HD2 TYR 32 0.771 2.636 -6.857
217 HE1 TYR 32 HE1 TYR 32 2.895 -0.024 -10.448
218 HE2 TYR 32 HE2 TYR 32 0.677 3.433 -9.199
219 HH TYR 32 HH TYR 32 2.691 2.243 -11.575
220 H TYR 33 H TYR 33 2.651 2.752 -4.157
221 HA TYR 33 HA TYR 33 3.037 1.885 -1.336
222 1HB TYR 33 1HB TYR 33 4.212 4.169 -2.947
223 2HB TYR 33 2HB TYR 33 3.649 4.537 -1.352
224 HD1 TYR 33 HD1 TYR 33 4.736 3.548 0.625
225 HD2 TYR 33 HD2 TYR 33 6.160 2.715 -3.335
226 HE1 TYR 33 HE1 TYR 33 6.574 2.165 1.587
227 HE2 TYR 33 HE2 TYR 33 8.161 1.599 -2.371
228 HH TYR 33 HH TYR 33 8.665 0.219 -0.419
229 H ILE 34 H ILE 34 1.119 2.216 -0.280
230 HA ILE 34 HA ILE 34 -0.983 3.737 -1.616
231 HB ILE 34 HB ILE 34 -0.929 1.726 0.637
232 1HG1 ILE 34 1HG1 ILE 34 -2.640 1.763 -1.888
233 2HG1 ILE 34 2HG1 ILE 34 -1.034 1.029 -1.863
234 1HG2 ILE 34 1HG2 ILE 34 -3.154 3.640 -0.140
235 2HG2 ILE 34 2HG2 ILE 34 -3.456 2.148 0.756
236 3HG2 ILE 34 3HG2 ILE 34 -2.445 3.387 1.469
237 1HD1 ILE 34 1HD1 ILE 34 -1.769 -0.465 -0.021
238 2HD1 ILE 34 2HD1 ILE 34 -3.418 0.173 -0.175
239 3HD1 ILE 34 3HD1 ILE 34 -2.677 -0.671 -1.535
240 H ASP 35 H ASP 35 -1.479 5.879 -0.764
241 HA ASP 35 HA ASP 35 0.005 6.714 1.635
242 1HB ASP 35 1HB ASP 35 -0.759 8.417 -0.145
243 2HB ASP 35 2HB ASP 35 -2.363 8.231 0.567
244 HA PRO 36 HA PRO 36 -3.341 4.607 3.923
245 1HB PRO 36 1HB PRO 36 -2.505 5.131 6.493
246 2HB PRO 36 2HB PRO 36 -1.855 3.821 5.498
247 1HG PRO 36 1HG PRO 36 -0.677 6.579 5.921
248 2HG PRO 36 2HG PRO 36 0.174 5.002 5.966
249 1HD PRO 36 1HD PRO 36 0.226 6.584 3.781
250 2HD PRO 36 2HD PRO 36 0.065 4.804 3.635
251 H ASP 37 H ASP 37 -2.132 7.944 4.257
252 HA ASP 37 HA ASP 37 -4.323 8.724 6.034
253 1HB ASP 37 1HB ASP 37 -2.183 10.404 4.729
254 2HB ASP 37 2HB ASP 37 -3.215 10.844 6.098
255 H VAL 38 H VAL 38 -3.769 8.513 2.578
256 HA VAL 38 HA VAL 38 -6.185 10.189 2.091
257 HB VAL 38 HB VAL 38 -4.260 9.010 0.078
258 1HG1 VAL 38 1HG1 VAL 38 -6.538 11.019 -0.205
259 2HG1 VAL 38 2HG1 VAL 38 -5.382 10.582 -1.479
260 3HG1 VAL 38 3HG1 VAL 38 -6.518 9.374 -0.869
261 1HG2 VAL 38 1HG2 VAL 38 -4.545 11.852 1.146
262 2HG2 VAL 38 2HG2 VAL 38 -3.175 10.771 1.456
263 3HG2 VAL 38 3HG2 VAL 38 -3.486 11.340 -0.185
264 H CYS 39 H CYS 39 -5.059 6.771 1.977
265 HA CYS 39 HA CYS 39 -7.239 5.669 0.603
266 1HB CYS 39 1HB CYS 39 -5.315 4.330 1.171
267 2HB CYS 39 2HB CYS 39 -5.584 4.649 2.880
268 H ILE 40 H ILE 40 -9.349 5.395 1.049
269 HA ILE 40 HA ILE 40 -10.420 6.402 3.612
270 HB ILE 40 HB ILE 40 -12.585 6.319 2.405
271 1HG1 ILE 40 1HG1 ILE 40 -11.011 5.711 -0.131
272 2HG1 ILE 40 2HG1 ILE 40 -11.773 4.424 0.803
273 1HG2 ILE 40 1HG2 ILE 40 -10.321 7.845 1.067
274 2HG2 ILE 40 2HG2 ILE 40 -12.049 8.224 0.909
275 3HG2 ILE 40 3HG2 ILE 40 -11.250 8.347 2.481
276 1HD1 ILE 40 1HD1 ILE 40 -13.972 5.535 0.582
277 2HD1 ILE 40 2HD1 ILE 40 -13.229 6.783 -0.447
278 3HD1 ILE 40 3HD1 ILE 40 -13.255 5.091 -0.977
279 H ASP 41 H ASP 41 -9.065 3.927 3.853
280 HA ASP 41 HA ASP 41 -9.302 1.746 4.526
281 1HB ASP 41 1HB ASP 41 -11.197 3.419 6.152
282 2HB ASP 41 2HB ASP 41 -11.289 1.673 6.372
283 H CYS 42 H CYS 42 -10.045 1.494 2.171
284 HA CYS 42 HA CYS 42 -12.609 -0.037 2.169
285 1HB CYS 42 1HB CYS 42 -13.015 0.429 0.105
286 2HB CYS 42 2HB CYS 42 -12.098 1.878 0.449
287 H GLY 43 H GLY 43 -11.982 -1.850 0.108
288 1HA GLY 43 1HA GLY 43 -9.595 -3.353 1.114
289 2HA GLY 43 2HA GLY 43 -11.190 -4.107 1.244
290 H ALA 44 H ALA 44 -10.512 -2.023 -1.489
291 HA ALA 44 HA ALA 44 -11.020 -4.219 -3.323
292 1HB ALA 44 1HB ALA 44 -11.910 -1.959 -3.703
293 2HB ALA 44 2HB ALA 44 -10.262 -1.318 -3.877
294 3HB ALA 44 3HB ALA 44 -10.889 -2.500 -5.047
295 H CYS 45 H CYS 45 -8.243 -2.002 -2.840
296 HA CYS 45 HA CYS 45 -6.545 -3.059 -4.751
297 1HB CYS 45 1HB CYS 45 -4.754 -1.948 -3.524
298 2HB CYS 45 2HB CYS 45 -6.159 -0.961 -3.819
299 H GLU 46 H GLU 46 -6.734 -4.097 -1.290
300 HA GLU 46 HA GLU 46 -4.801 -6.140 -1.461
301 1HB GLU 46 1HB GLU 46 -5.775 -5.547 0.713
302 2HB GLU 46 2HB GLU 46 -7.375 -6.003 0.155
303 1HG GLU 46 1HG GLU 46 -6.478 -7.625 1.711
304 2HG GLU 46 2HG GLU 46 -6.802 -8.364 0.149
305 H ALA 47 H ALA 47 -8.337 -6.386 -2.130
306 HA ALA 47 HA ALA 47 -8.314 -9.143 -2.819
307 1HB ALA 47 1HB ALA 47 -10.372 -7.870 -2.336
308 2HB ALA 47 2HB ALA 47 -10.164 -6.944 -3.839
309 3HB ALA 47 3HB ALA 47 -10.461 -8.691 -3.908
310 H VAL 48 H VAL 48 -7.513 -6.239 -4.685
311 HA VAL 48 HA VAL 48 -7.285 -7.683 -7.211
312 HB VAL 48 HB VAL 48 -6.859 -4.866 -6.257
313 1HG1 VAL 48 1HG1 VAL 48 -5.904 -5.931 -8.940
314 2HG1 VAL 48 2HG1 VAL 48 -6.196 -4.224 -8.552
315 3HG1 VAL 48 3HG1 VAL 48 -4.935 -5.109 -7.683
316 1HG2 VAL 48 1HG2 VAL 48 -9.108 -5.717 -6.937
317 2HG2 VAL 48 2HG2 VAL 48 -8.511 -4.454 -8.035
318 3HG2 VAL 48 3HG2 VAL 48 -8.447 -6.145 -8.532
319 H CYS 49 H CYS 49 -4.950 -6.761 -4.627
320 HA CYS 49 HA CYS 49 -2.635 -7.266 -6.165
321 1HB CYS 49 1HB CYS 49 -2.673 -6.163 -3.929
322 2HB CYS 49 2HB CYS 49 -2.950 -7.758 -3.204
323 HA PRO 50 HA PRO 50 -3.793 -11.589 -6.638
324 1HB PRO 50 1HB PRO 50 -2.003 -12.416 -8.517
325 2HB PRO 50 2HB PRO 50 -3.241 -11.181 -8.865
326 1HG PRO 50 1HG PRO 50 -0.360 -10.693 -8.036
327 2HG PRO 50 2HG PRO 50 -1.203 -10.035 -9.472
328 1HD PRO 50 1HD PRO 50 -1.015 -8.627 -7.148
329 2HD PRO 50 2HD PRO 50 -2.493 -8.565 -8.152
330 H VAL 51 H VAL 51 -1.922 -10.764 -4.423
331 HA VAL 51 HA VAL 51 -0.493 -13.321 -3.972
332 HB VAL 51 HB VAL 51 1.455 -12.295 -3.460
333 1HG1 VAL 51 1HG1 VAL 51 0.975 -11.506 -5.784
334 2HG1 VAL 51 2HG1 VAL 51 0.336 -9.984 -5.102
335 3HG1 VAL 51 3HG1 VAL 51 2.038 -10.416 -4.880
336 1HG2 VAL 51 1HG2 VAL 51 -0.079 -9.852 -2.499
337 2HG2 VAL 51 2HG2 VAL 51 0.802 -11.072 -1.542
338 3HG2 VAL 51 3HG2 VAL 51 1.688 -9.951 -2.576
339 H SER 52 H SER 52 -2.551 -10.690 -2.805
340 HA SER 52 HA SER 52 -3.507 -10.148 -0.938
341 1HB SER 52 1HB SER 52 -3.082 -13.016 -0.080
342 2HB SER 52 2HB SER 52 -4.219 -11.845 0.621
343 HG SER 52 HG SER 52 -4.942 -11.676 -1.722
344 H ALA 53 H ALA 53 -2.301 -8.653 0.054
345 HA ALA 53 HA ALA 53 -0.251 -9.383 2.029
346 1HB ALA 53 1HB ALA 53 0.615 -8.058 -0.564
347 2HB ALA 53 2HB ALA 53 1.596 -8.137 0.915
348 3HB ALA 53 3HB ALA 53 1.148 -9.629 0.093
349 H ILE 54 H ILE 54 -2.364 -7.010 0.539
350 HA ILE 54 HA ILE 54 -1.180 -4.761 2.007
351 HB ILE 54 HB ILE 54 -3.763 -4.922 0.436
352 1HG1 ILE 54 1HG1 ILE 54 -0.980 -4.258 -0.558
353 2HG1 ILE 54 2HG1 ILE 54 -2.003 -5.599 -1.072
354 1HG2 ILE 54 1HG2 ILE 54 -3.273 -3.008 2.116
355 2HG2 ILE 54 2HG2 ILE 54 -2.025 -2.505 0.969
356 3HG2 ILE 54 3HG2 ILE 54 -3.733 -2.541 0.477
357 1HD1 ILE 54 1HD1 ILE 54 -3.674 -3.468 -1.587
358 2HD1 ILE 54 2HD1 ILE 54 -2.064 -2.808 -1.968
359 3HD1 ILE 54 3HD1 ILE 54 -2.638 -4.275 -2.760
360 H TYR 55 H TYR 55 -1.687 -4.548 4.206
361 HA TYR 55 HA TYR 55 -4.328 -5.575 5.146
362 1HB TYR 55 1HB TYR 55 -1.559 -5.909 6.348
363 2HB TYR 55 2HB TYR 55 -3.007 -6.076 7.298
364 HD1 TYR 55 HD1 TYR 55 -4.891 -7.655 5.989
365 HD2 TYR 55 HD2 TYR 55 -0.611 -7.927 5.515
366 HE1 TYR 55 HE1 TYR 55 -5.177 -9.511 4.389
367 HE2 TYR 55 HE2 TYR 55 -0.910 -9.962 4.135
368 HH TYR 55 HH TYR 55 -3.831 -10.309 2.442
369 H HIS 56 H HIS 56 -4.859 -4.677 7.280
370 HA HIS 56 HA HIS 56 -4.863 -1.848 7.029
371 1HB HIS 56 1HB HIS 56 -6.486 -3.441 8.403
372 2HB HIS 56 2HB HIS 56 -5.271 -3.285 9.666
373 HD1 HIS 56 HD1 HIS 56 -5.884 -1.401 11.333
374 HD2 HIS 56 HD2 HIS 56 -7.132 -0.708 7.384
375 HE1 HIS 56 HE1 HIS 56 -6.887 0.937 11.295
376 H GLU 57 H GLU 57 -3.638 -0.230 8.060
377 HA GLU 57 HA GLU 57 -1.036 -0.817 8.584
378 1HB GLU 57 1HB GLU 57 -0.950 1.486 9.501
379 2HB GLU 57 2HB GLU 57 -1.965 1.426 8.046
380 1HG GLU 57 1HG GLU 57 -3.871 1.086 9.730
381 2HG GLU 57 2HG GLU 57 -2.689 1.660 10.928
382 H ASP 58 H ASP 58 -3.588 -0.706 10.885
383 HA ASP 58 HA ASP 58 -2.052 -1.227 13.214
384 1HB ASP 58 1HB ASP 58 -4.465 -0.592 13.273
385 2HB ASP 58 2HB ASP 58 -4.847 -2.216 12.628
386 H PHE 59 H PHE 59 -3.094 -3.387 10.636
387 HA PHE 59 HA PHE 59 -2.899 -5.809 12.310
388 1HB PHE 59 1HB PHE 59 -3.574 -5.282 9.392
389 2HB PHE 59 2HB PHE 59 -3.482 -6.858 10.129
390 HD1 PHE 59 HD1 PHE 59 -4.967 -4.831 12.652
391 HD2 PHE 59 HD2 PHE 59 -5.810 -6.701 8.836
392 HE1 PHE 59 HE1 PHE 59 -7.361 -4.579 13.054
393 HE2 PHE 59 HE2 PHE 59 -8.234 -6.438 9.264
394 HZ PHE 59 HZ PHE 59 -9.020 -5.362 11.364
395 H VAL 60 H VAL 60 -1.129 -4.097 9.740
396 HA VAL 60 HA VAL 60 0.670 -6.104 9.038
397 HB VAL 60 HB VAL 60 0.946 -3.093 9.160
398 1HG1 VAL 60 1HG1 VAL 60 2.969 -5.171 8.259
399 2HG1 VAL 60 2HG1 VAL 60 3.017 -3.477 7.736
400 3HG1 VAL 60 3HG1 VAL 60 3.205 -3.865 9.443
401 1HG2 VAL 60 1HG2 VAL 60 0.601 -5.195 6.961
402 2HG2 VAL 60 2HG2 VAL 60 -0.595 -3.990 7.480
403 3HG2 VAL 60 3HG2 VAL 60 0.868 -3.486 6.637
404 HA PRO 61 HA PRO 61 2.604 -6.948 13.007
405 1HB PRO 61 1HB PRO 61 4.860 -7.914 11.235
406 2HB PRO 61 2HB PRO 61 4.159 -8.710 12.669
407 1HG PRO 61 1HG PRO 61 3.467 -9.530 10.173
408 2HG PRO 61 2HG PRO 61 2.208 -9.352 11.434
409 1HD PRO 61 1HD PRO 61 2.884 -7.444 9.189
410 2HD PRO 61 2HD PRO 61 1.293 -7.983 9.821
411 H GLU 62 H GLU 62 4.149 -5.923 14.382
412 HA GLU 62 HA GLU 62 5.228 -3.510 14.118
413 1HB GLU 62 1HB GLU 62 5.676 -6.029 15.650
414 2HB GLU 62 2HB GLU 62 6.766 -4.700 15.868
415 1HG GLU 62 1HG GLU 62 4.840 -4.702 17.499
416 2HG GLU 62 2HG GLU 62 4.951 -3.211 16.552
417 H GLU 63 H GLU 63 7.008 -6.521 13.237
418 HA GLU 63 HA GLU 63 9.462 -5.398 12.520
419 1HB GLU 63 1HB GLU 63 7.961 -7.533 10.963
420 2HB GLU 63 2HB GLU 63 9.701 -7.245 10.997
421 1HG GLU 63 1HG GLU 63 9.632 -8.956 12.493
422 2HG GLU 63 2HG GLU 63 9.338 -7.655 13.649
423 H TRP 64 H TRP 64 6.417 -5.458 10.728
424 HA TRP 64 HA TRP 64 7.547 -3.946 8.439
425 1HB TRP 64 1HB TRP 64 5.136 -5.724 8.804
426 2HB TRP 64 2HB TRP 64 5.406 -4.764 7.354
427 HD1 TRP 64 HD1 TRP 64 8.755 -5.749 7.817
428 HE1 TRP 64 HE1 TRP 64 9.339 -7.859 6.454
429 HE3 TRP 64 HE3 TRP 64 4.026 -7.581 6.945
430 HZ2 TRP 64 HZ2 TRP 64 8.026 -10.057 5.316
431 HZ3 TRP 64 HZ3 TRP 64 3.749 -9.625 5.574
432 HH2 TRP 64 HH2 TRP 64 5.781 -10.783 4.643
433 H LYS 65 H LYS 65 5.787 -3.211 11.335
434 HA LYS 65 HA LYS 65 4.042 -1.212 10.420
435 1HB LYS 65 1HB LYS 65 5.769 -1.658 12.876
436 2HB LYS 65 2HB LYS 65 4.824 -0.251 12.706
437 1HG LYS 65 1HG LYS 65 3.630 -3.036 12.683
438 2HG LYS 65 2HG LYS 65 3.723 -1.943 14.086
439 1HD LYS 65 1HD LYS 65 2.423 -0.289 12.535
440 2HD LYS 65 2HD LYS 65 1.998 -1.768 11.646
441 1HE LYS 65 1HE LYS 65 1.451 -1.177 14.609
442 2HE LYS 65 2HE LYS 65 0.272 -1.183 13.299
443 1HZ LYS 65 1HZ LYS 65 1.197 -3.620 13.065
444 2HZ LYS 65 2HZ LYS 65 1.519 -3.402 14.668
445 3HZ LYS 65 3HZ LYS 65 -0.032 -3.265 14.077
446 H SER 66 H SER 66 7.607 -1.379 10.658
447 HA SER 66 HA SER 66 8.472 1.140 10.169
448 1HB SER 66 1HB SER 66 9.416 -1.162 8.511
449 2HB SER 66 2HB SER 66 10.366 0.110 9.292
450 HG SER 66 HG SER 66 9.655 -2.321 10.287
451 H TYR 67 H TYR 67 6.886 -1.049 7.762
452 HA TYR 67 HA TYR 67 7.247 0.802 5.564
453 1HB TYR 67 1HB TYR 67 5.373 -1.554 5.902
454 2HB TYR 67 2HB TYR 67 5.456 -0.524 4.482
455 HD1 TYR 67 HD1 TYR 67 7.636 -0.377 3.157
456 HD2 TYR 67 HD2 TYR 67 6.966 -3.358 6.196
457 HE1 TYR 67 HE1 TYR 67 9.499 -1.736 2.245
458 HE2 TYR 67 HE2 TYR 67 8.867 -4.684 5.312
459 HH TYR 67 HH TYR 67 10.445 -4.908 3.609
460 H ILE 68 H ILE 68 4.720 0.442 8.150
461 HA ILE 68 HA ILE 68 2.743 1.995 6.719
462 HB ILE 68 HB ILE 68 3.205 1.048 9.568
463 1HG1 ILE 68 1HG1 ILE 68 1.234 -0.155 9.294
464 2HG1 ILE 68 2HG1 ILE 68 0.790 0.695 7.803
465 1HG2 ILE 68 1HG2 ILE 68 1.095 3.021 8.717
466 2HG2 ILE 68 2HG2 ILE 68 1.141 2.116 10.257
467 3HG2 ILE 68 3HG2 ILE 68 2.416 3.276 9.893
468 1HD1 ILE 68 1HD1 ILE 68 3.135 -1.208 8.097
469 2HD1 ILE 68 2HD1 ILE 68 1.541 -1.585 7.409
470 3HD1 ILE 68 3HD1 ILE 68 2.584 -0.445 6.578
471 H GLN 69 H GLN 69 5.298 2.618 9.134
472 HA GLN 69 HA GLN 69 4.950 5.410 9.231
473 1HB GLN 69 1HB GLN 69 6.417 3.979 10.734
474 2HB GLN 69 2HB GLN 69 7.611 3.937 9.431
475 1HG GLN 69 1HG GLN 69 8.249 5.633 10.997
476 2HG GLN 69 2HG GLN 69 7.722 6.460 9.526
477 1HE2 GLN 69 2HE2 GLN 69 5.746 7.711 9.596
478 2HE2 GLN 69 1HE2 GLN 69 4.991 8.088 11.141
479 H LYS 70 H LYS 70 6.963 3.431 6.981
480 HA LYS 70 HA LYS 70 8.006 5.662 5.609
481 1HB LYS 70 1HB LYS 70 8.866 3.246 5.486
482 2HB LYS 70 2HB LYS 70 7.479 2.894 4.468
483 1HG LYS 70 1HG LYS 70 9.379 3.226 3.020
484 2HG LYS 70 2HG LYS 70 8.233 4.515 2.803
485 1HD LYS 70 1HD LYS 70 10.005 5.547 4.789
486 2HD LYS 70 2HD LYS 70 11.028 4.566 3.761
487 1HE LYS 70 1HE LYS 70 11.039 6.800 2.866
488 2HE LYS 70 2HE LYS 70 10.131 5.783 1.744
489 1HZ LYS 70 1HZ LYS 70 8.084 6.709 3.022
490 2HZ LYS 70 2HZ LYS 70 9.139 7.803 3.638
491 3HZ LYS 70 3HZ LYS 70 8.905 7.734 2.030
492 H ASN 71 H ASN 71 5.210 3.677 4.886
493 HA ASN 71 HA ASN 71 4.314 4.957 2.511
494 1HB ASN 71 1HB ASN 71 2.966 3.323 4.608
495 2HB ASN 71 2HB ASN 71 2.017 4.125 3.378
496 1HD2 ASN 71 2HD2 ASN 71 4.622 1.728 3.773
497 2HD2 ASN 71 1HD2 ASN 71 4.306 0.924 2.240
498 H ARG 72 H ARG 72 3.638 5.778 5.969
499 HA ARG 72 HA ARG 72 1.801 7.881 5.612
500 1HB ARG 72 1HB ARG 72 2.563 6.604 7.638
501 2HB ARG 72 2HB ARG 72 3.994 7.593 7.692
502 1HG ARG 72 1HG ARG 72 2.971 9.255 8.730
503 2HG ARG 72 2HG ARG 72 1.663 9.318 7.538
504 1HD ARG 72 1HD ARG 72 1.854 7.200 9.705
505 2HD ARG 72 2HD ARG 72 0.934 8.709 9.870
506 HE ARG 72 HE ARG 72 -0.136 7.952 7.615
507 1HH1 ARG 72 1HH1 ARG 72 0.700 5.413 9.999
508 2HH1 ARG 72 2HH1 ARG 72 -0.940 4.740 9.892
509 1HH2 ARG 72 1HH2 ARG 72 -2.357 7.278 8.099
510 2HH2 ARG 72 2HH2 ARG 72 -2.539 5.631 8.832
511 H ASP 73 H ASP 73 5.288 7.772 6.090
512 HA ASP 73 HA ASP 73 5.947 10.451 6.041
513 1HB ASP 73 1HB ASP 73 7.267 8.692 7.038
514 2HB ASP 73 2HB ASP 73 7.374 7.823 5.519
515 H PHE 74 H PHE 74 6.013 8.080 3.389
516 HA PHE 74 HA PHE 74 7.391 9.260 1.344
517 1HB PHE 74 1HB PHE 74 5.096 7.479 1.470
518 2HB PHE 74 2HB PHE 74 5.109 8.516 0.058
519 HD1 PHE 74 HD1 PHE 74 6.924 8.556 -1.583
520 HD2 PHE 74 HD2 PHE 74 6.553 5.517 1.433
521 HE1 PHE 74 HE1 PHE 74 8.490 7.099 -2.834
522 HE2 PHE 74 HE2 PHE 74 8.388 4.224 0.352
523 HZ PHE 74 HZ PHE 74 9.291 4.963 -1.809
524 H PHE 75 H PHE 75 4.023 10.051 2.116
525 HA PHE 75 HA PHE 75 4.099 12.307 0.193
526 1HB PHE 75 1HB PHE 75 1.714 11.194 1.556
527 2HB PHE 75 2HB PHE 75 1.783 12.070 0.042
528 HD1 PHE 75 HD1 PHE 75 3.149 10.925 -1.908
529 HD2 PHE 75 HD2 PHE 75 1.779 8.789 1.583
530 HE1 PHE 75 HE1 PHE 75 3.637 8.764 -3.022
531 HE2 PHE 75 HE2 PHE 75 2.185 6.644 0.436
532 HZ PHE 75 HZ PHE 75 3.166 6.627 -1.845
533 H LYS 76 H LYS 76 4.058 11.718 3.645
534 HA LYS 76 HA LYS 76 3.220 14.507 4.278
535 1HB LYS 76 1HB LYS 76 4.008 12.064 5.907
536 2HB LYS 76 2HB LYS 76 4.197 13.682 6.547
537 1HG LYS 76 1HG LYS 76 2.220 13.216 7.398
538 2HG LYS 76 2HG LYS 76 1.673 14.071 5.955
539 1HD LYS 76 1HD LYS 76 1.937 11.053 6.206
540 2HD LYS 76 2HD LYS 76 0.475 11.880 6.705
541 1HE LYS 76 1HE LYS 76 -0.250 12.316 4.574
542 2HE LYS 76 2HE LYS 76 1.363 12.382 3.882
543 1HZ LYS 76 1HZ LYS 76 0.037 9.907 4.797
544 2HZ LYS 76 2HZ LYS 76 0.151 10.377 3.239
545 3HZ LYS 76 3HZ LYS 76 1.530 10.010 4.103
546 H LYS 77 H LYS 77 4.896 15.404 2.732
547 HA LYS 77 HA LYS 77 7.509 15.668 3.962
548 1HB LYS 77 1HB LYS 77 7.321 13.407 2.581
549 2HB LYS 77 2HB LYS 77 7.196 14.455 1.188
550 1HG LYS 77 1HG LYS 77 9.478 13.743 1.379
551 2HG LYS 77 2HG LYS 77 9.384 15.470 1.718
552 1HD LYS 77 1HD LYS 77 10.954 14.392 3.191
553 2HD LYS 77 2HD LYS 77 9.644 15.059 4.141
554 1HE LYS 77 1HE LYS 77 9.810 12.084 3.331
555 2HE LYS 77 2HE LYS 77 10.532 12.742 4.799
556 1HZ LYS 77 1HZ LYS 77 8.099 13.537 5.255
557 2HZ LYS 77 2HZ LYS 77 7.721 12.369 4.202
558 3HZ LYS 77 3HZ LYS 77 8.596 11.982 5.508