NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
5601 |
1hp8   |
cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
1 1H MET 1 2H MET 1 6.591 14.598 -6.507
2 2H MET 1 3H MET 1 7.111 14.857 -8.057
3 3H MET 1 1H MET 1 7.418 13.411 -7.311
4 HA MET 1 HA MET 1 9.341 14.684 -7.401
5 1HB MET 1 1HB MET 1 9.503 16.814 -6.153
6 2HB MET 1 2HB MET 1 8.672 16.752 -7.697
7 1HG MET 1 1HG MET 1 6.461 16.740 -6.415
8 2HG MET 1 2HG MET 1 7.391 16.916 -4.930
9 1HE MET 1 2HE MET 1 5.893 18.553 -8.075
10 2HE MET 1 3HE MET 1 6.696 20.135 -8.174
11 3HE MET 1 1HE MET 1 7.604 18.657 -8.557
12 HA PRO 2 HA PRO 2 9.066 12.214 -3.574
13 1HB PRO 2 1HB PRO 2 10.937 10.330 -4.163
14 2HB PRO 2 2HB PRO 2 9.361 10.391 -4.993
15 1HG PRO 2 1HG PRO 2 11.994 11.558 -5.965
16 2HG PRO 2 2HG PRO 2 10.871 10.475 -6.853
17 1HD PRO 2 1HD PRO 2 10.794 13.222 -7.122
18 2HD PRO 2 2HD PRO 2 9.315 12.231 -7.201
19 H GLN 3 H GLN 3 9.986 14.559 -3.020
20 HA GLN 3 HA GLN 3 12.687 14.979 -2.311
21 1HB GLN 3 1HB GLN 3 10.111 15.811 -0.893
22 2HB GLN 3 2HB GLN 3 11.703 16.446 -0.480
23 1HG GLN 3 1HG GLN 3 10.471 16.721 -3.262
24 2HG GLN 3 2HG GLN 3 10.262 17.904 -1.979
25 1HE2 GLN 3 1HE2 GLN 3 13.464 19.349 -2.435
26 2HE2 GLN 3 2HE2 GLN 3 11.963 19.392 -1.521
27 H LYS 4 H LYS 4 10.050 13.503 -0.386
28 HA LYS 4 HA LYS 4 11.748 11.451 0.634
29 1HB LYS 4 1HB LYS 4 10.266 13.408 2.460
30 2HB LYS 4 2HB LYS 4 10.646 11.752 2.952
31 1HG LYS 4 1HG LYS 4 13.064 12.191 2.617
32 2HG LYS 4 2HG LYS 4 12.693 13.873 2.171
33 1HD LYS 4 1HD LYS 4 11.704 14.294 4.351
34 2HD LYS 4 2HD LYS 4 11.956 12.598 4.832
35 1HE LYS 4 1HE LYS 4 14.406 12.884 4.547
36 2HE LYS 4 2HE LYS 4 14.155 14.582 4.103
37 1HZ LYS 4 2HZ LYS 4 13.447 13.365 6.686
38 2HZ LYS 4 3HZ LYS 4 14.750 14.331 6.403
39 3HZ LYS 4 1HZ LYS 4 13.227 14.948 6.278
40 H ASP 5 H ASP 5 10.302 9.593 1.090
41 HA ASP 5 HA ASP 5 7.485 9.963 0.447
42 1HB ASP 5 1HB ASP 5 8.661 9.568 -1.673
43 2HB ASP 5 2HB ASP 5 9.214 8.012 -1.077
44 HA PRO 6 HA PRO 6 8.149 7.587 4.357
45 1HB PRO 6 1HB PRO 6 5.184 7.900 4.373
46 2HB PRO 6 2HB PRO 6 6.359 8.152 5.706
47 1HG PRO 6 1HG PRO 6 5.319 10.290 4.462
48 2HG PRO 6 2HG PRO 6 7.090 10.239 4.720
49 1HD PRO 6 1HD PRO 6 5.561 9.365 2.215
50 2HD PRO 6 2HD PRO 6 6.921 10.551 2.359
51 H CYS 7 HN CYX 7 5.952 6.985 1.699
52 H GLN 8 H GLN 8 7.398 5.708 0.447
53 HA GLN 8 HA GLN 8 7.375 3.839 -1.634
54 1HB GLN 8 1HB GLN 8 8.558 5.871 -1.761
55 2HB GLN 8 2HB GLN 8 9.491 5.587 -0.287
56 1HG GLN 8 1HG GLN 8 9.640 3.657 -2.536
57 2HG GLN 8 2HG GLN 8 10.466 5.224 -2.706
58 1HE2 GLN 8 1HE2 GLN 8 12.210 2.254 -0.588
59 2HE2 GLN 8 2HE2 GLN 8 10.617 2.043 -1.349
60 H LYS 9 H LYS 9 8.736 3.730 1.546
61 HA LYS 9 HA LYS 9 10.246 1.323 1.370
62 1HB LYS 9 1HB LYS 9 10.253 3.047 3.256
63 2HB LYS 9 2HB LYS 9 8.757 2.331 3.815
64 1HG LYS 9 1HG LYS 9 10.059 0.056 3.794
65 2HG LYS 9 2HG LYS 9 11.515 1.048 3.689
66 1HD LYS 9 1HD LYS 9 9.361 1.292 5.832
67 2HD LYS 9 2HD LYS 9 10.843 0.333 6.007
68 1HE LYS 9 1HE LYS 9 12.195 2.406 5.645
69 2HE LYS 9 2HE LYS 9 10.692 3.349 5.589
70 1HZ LYS 9 1HZ LYS 9 10.231 2.599 7.824
71 2HZ LYS 9 2HZ LYS 9 11.636 1.741 7.864
72 3HZ LYS 9 3HZ LYS 9 11.678 3.386 7.762
73 H GLN 10 H GLN 10 6.861 1.922 2.373
74 HA GLN 10 HA GLN 10 6.351 -0.813 2.930
75 1HB GLN 10 1HB GLN 10 4.037 0.912 2.267
76 2HB GLN 10 2HB GLN 10 4.237 -0.276 3.520
77 1HG GLN 10 1HG GLN 10 4.997 2.600 3.470
78 2HG GLN 10 2HG GLN 10 4.011 1.761 4.638
79 1HE2 GLN 10 1HE2 GLN 10 7.457 2.642 6.004
80 2HE2 GLN 10 2HE2 GLN 10 6.452 3.662 4.993
81 H ALA 11 H ALA 11 5.547 1.254 0.081
82 HA ALA 11 HA ALA 11 4.574 -0.666 -1.707
83 1HB ALA 11 1HB ALA 11 4.745 1.740 -2.201
84 2HB ALA 11 2HB ALA 11 6.510 1.595 -2.303
85 3HB ALA 11 3HB ALA 11 5.476 0.764 -3.482
86 H CYS 12 H CYS 12 7.952 -0.134 -0.752
87 HA CYS 12 HA CYS 12 9.058 -2.065 -2.555
88 1HB CYS 12 1HB CYS 12 10.260 -0.275 -1.090
89 2HB CYS 12 2HB CYS 12 10.251 -1.588 0.103
90 H GLU 13 H GLU 13 7.857 -2.226 0.799
91 HA GLU 13 HA GLU 13 8.432 -4.964 1.254
92 1HB GLU 13 1HB GLU 13 6.552 -2.975 2.613
93 2HB GLU 13 2HB GLU 13 6.561 -4.671 3.070
94 1HG GLU 13 1HG GLU 13 8.756 -4.674 3.702
95 2HG GLU 13 2HG GLU 13 9.102 -3.080 2.953
96 H ILE 14 H ILE 14 5.519 -3.462 -0.353
97 HA ILE 14 HA ILE 14 4.052 -5.855 -0.467
98 HB ILE 14 HB ILE 14 4.385 -3.468 -2.291
99 1HG1 ILE 14 1HG1 ILE 14 2.054 -3.100 -1.812
100 2HG1 ILE 14 2HG1 ILE 14 2.017 -4.488 -0.717
101 1HG2 ILE 14 2HG2 ILE 14 2.619 -5.886 -2.844
102 2HG2 ILE 14 3HG2 ILE 14 2.461 -4.317 -3.667
103 3HG2 ILE 14 1HG2 ILE 14 3.927 -5.260 -3.874
104 1HD1 ILE 14 2HD1 ILE 14 3.503 -1.904 -0.432
105 2HD1 ILE 14 3HD1 ILE 14 2.016 -2.320 0.387
106 3HD1 ILE 14 1HD1 ILE 14 3.493 -3.213 0.781
107 H GLN 15 H GLN 15 6.669 -4.679 -2.622
108 HA GLN 15 HA GLN 15 6.657 -7.024 -4.223
109 1HB GLN 15 1HB GLN 15 8.949 -5.058 -3.825
110 2HB GLN 15 2HB GLN 15 8.777 -6.263 -5.100
111 1HG GLN 15 1HG GLN 15 6.576 -5.106 -5.743
112 2HG GLN 15 2HG GLN 15 7.047 -3.799 -4.651
113 1HE2 GLN 15 1HE2 GLN 15 8.846 -4.150 -8.292
114 2HE2 GLN 15 2HE2 GLN 15 7.687 -5.365 -7.760
115 H LYS 16 H LYS 16 8.658 -6.080 -1.365
116 HA LYS 16 HA LYS 16 10.210 -8.463 -1.428
117 1HB LYS 16 1HB LYS 16 9.440 -6.995 1.170
118 2HB LYS 16 2HB LYS 16 10.873 -7.949 0.884
119 1HG LYS 16 1HG LYS 16 10.276 -5.129 -0.010
120 2HG LYS 16 2HG LYS 16 11.571 -5.701 0.995
121 1HD LYS 16 1HD LYS 16 11.289 -6.311 -1.983
122 2HD LYS 16 2HD LYS 16 12.337 -5.058 -1.273
123 1HE LYS 16 1HE LYS 16 13.424 -6.777 0.129
124 2HE LYS 16 2HE LYS 16 12.433 -8.023 -0.639
125 1HZ LYS 16 2HZ LYS 16 14.380 -6.297 -2.027
126 2HZ LYS 16 3HZ LYS 16 14.621 -7.879 -1.637
127 3HZ LYS 16 1HZ LYS 16 13.466 -7.469 -2.739
128 H CYS 17 HN CYX 17 7.158 -7.759 0.321
129 H LEU 18 H LEU 18 6.128 -9.193 -1.642
130 HA LEU 18 HA LEU 18 4.912 -11.589 -2.390
131 1HB LEU 18 1HB LEU 18 5.816 -9.146 -3.704
132 2HB LEU 18 2HB LEU 18 6.353 -10.496 -4.651
133 HG LEU 18 HG LEU 18 3.863 -11.350 -4.133
134 1HD1 LEU 18 1HD1 LEU 18 3.366 -9.336 -2.720
135 2HD1 LEU 18 2HD1 LEU 18 3.634 -8.283 -4.105
136 3HD1 LEU 18 3HD1 LEU 18 2.284 -9.422 -4.126
137 1HD2 LEU 18 2HD2 LEU 18 4.862 -10.844 -6.439
138 2HD2 LEU 18 3HD2 LEU 18 3.151 -10.413 -6.312
139 3HD2 LEU 18 1HD2 LEU 18 4.402 -9.153 -6.226
140 H GLN 19 H GLN 19 8.382 -10.727 -2.462
141 HA GLN 19 HA GLN 19 9.165 -13.252 -3.609
142 1HB GLN 19 1HB GLN 19 11.147 -11.888 -1.885
143 2HB GLN 19 2HB GLN 19 11.363 -12.582 -3.482
144 1HG GLN 19 1HG GLN 19 9.923 -10.016 -2.945
145 2HG GLN 19 2HG GLN 19 11.664 -10.041 -3.187
146 1HE2 GLN 19 1HE2 GLN 19 9.094 -9.637 -6.261
147 2HE2 GLN 19 2HE2 GLN 19 8.669 -9.403 -4.566
148 H ALA 20 H ALA 20 8.854 -12.162 -0.250
149 HA ALA 20 HA ALA 20 9.618 -14.629 0.932
150 1HB ALA 20 1HB ALA 20 9.474 -12.485 2.148
151 2HB ALA 20 2HB ALA 20 7.711 -12.482 1.955
152 3HB ALA 20 3HB ALA 20 8.492 -13.743 2.927
153 H ASN 21 H ASN 21 6.815 -13.957 -1.008
154 HA ASN 21 HA ASN 21 5.357 -16.351 0.022
155 1HB ASN 21 1HB ASN 21 4.349 -13.631 -0.825
156 2HB ASN 21 2HB ASN 21 3.348 -15.066 -0.681
157 1HD2 ASN 21 1HD2 ASN 21 4.612 -13.236 2.746
158 2HD2 ASN 21 2HD2 ASN 21 5.218 -12.711 1.159
159 H SER 22 H SER 22 7.349 -15.502 -2.484
160 HA SER 22 HA SER 22 7.648 -16.175 -4.568
161 1HB SER 22 1HB SER 22 5.699 -18.403 -4.049
162 2HB SER 22 2HB SER 22 6.980 -18.302 -5.298
163 HG SER 22 HG SER 22 7.617 -19.557 -3.449
164 H TYR 23 H TYR 23 5.981 -14.198 -4.225
165 HA TYR 23 HA TYR 23 4.840 -12.762 -5.276
166 1HB TYR 23 1HB TYR 23 4.985 -14.641 -7.602
167 2HB TYR 23 2HB TYR 23 4.769 -12.887 -7.687
168 HD1 TYR 23 HD2 TYR 23 6.918 -12.400 -5.223
169 HD2 TYR 23 HD1 TYR 23 7.079 -14.747 -8.879
170 HE1 TYR 23 HE2 TYR 23 9.084 -12.108 -5.212
171 HE2 TYR 23 HE1 TYR 23 9.544 -14.545 -8.792
172 HH TYR 23 HH TYR 23 11.131 -12.174 -6.580
173 H MET 24 H MET 24 3.446 -15.126 -4.042
174 HA MET 24 HA MET 24 0.754 -14.951 -5.006
175 1HB MET 24 1HB MET 24 1.827 -16.007 -2.353
176 2HB MET 24 2HB MET 24 0.191 -16.234 -2.994
177 1HG MET 24 1HG MET 24 1.264 -17.268 -5.046
178 2HG MET 24 2HG MET 24 2.788 -17.280 -4.213
179 1HE MET 24 2HE MET 24 2.656 -18.218 -1.438
180 2HE MET 24 3HE MET 24 2.569 -19.992 -1.554
181 3HE MET 24 1HE MET 24 3.623 -19.077 -2.654
182 H GLU 25 H GLU 25 0.787 -12.602 -5.184
183 HA GLU 25 HA GLU 25 0.794 -10.767 -3.151
184 1HB GLU 25 1HB GLU 25 0.708 -10.427 -5.628
185 2HB GLU 25 2HB GLU 25 -1.008 -10.868 -5.619
186 1HG GLU 25 1HG GLU 25 -1.576 -8.958 -4.314
187 2HG GLU 25 2HG GLU 25 0.116 -8.646 -3.901
188 H SER 26 H SER 26 -1.613 -13.257 -3.671
189 HA SER 26 HA SER 26 -3.821 -12.442 -2.243
190 1HB SER 26 1HB SER 26 -2.488 -15.155 -1.977
191 2HB SER 26 2HB SER 26 -4.221 -14.779 -2.047
192 HG SER 26 HG SER 26 -3.513 -15.605 -4.033
193 H LYS 27 H LYS 27 -0.613 -13.572 -1.023
194 HA LYS 27 HA LYS 27 -1.491 -13.552 1.734
195 1HB LYS 27 1HB LYS 27 1.358 -13.770 0.677
196 2HB LYS 27 2HB LYS 27 0.743 -14.242 2.265
197 1HG LYS 27 1HG LYS 27 -0.864 -15.792 0.763
198 2HG LYS 27 2HG LYS 27 0.471 -15.611 -0.401
199 1HD LYS 27 1HD LYS 27 1.944 -16.849 0.868
200 2HD LYS 27 2HD LYS 27 1.080 -16.550 2.388
201 1HE LYS 27 1HE LYS 27 0.821 -18.877 1.621
202 2HE LYS 27 2HE LYS 27 -0.727 -18.025 1.721
203 1HZ LYS 27 2HZ LYS 27 0.795 -18.497 -0.753
204 2HZ LYS 27 3HZ LYS 27 -0.552 -19.313 -0.277
205 3HZ LYS 27 1HZ LYS 27 -0.644 -17.711 -0.645
206 H CYS 28 HN CYX 28 0.466 -11.503 -0.466
207 H GLN 29 H GLN 29 -1.895 -10.028 0.243
208 HA GLN 29 HA GLN 29 -2.887 -7.397 -0.018
209 1HB GLN 29 1HB GLN 29 -4.173 -9.703 1.520
210 2HB GLN 29 2HB GLN 29 -4.997 -8.226 1.016
211 1HG GLN 29 1HG GLN 29 -3.848 -10.365 -0.809
212 2HG GLN 29 2HG GLN 29 -5.546 -10.020 -0.513
213 1HE2 GLN 29 1HE2 GLN 29 -3.513 -7.921 -3.319
214 2HE2 GLN 29 2HE2 GLN 29 -2.761 -9.256 -2.415
215 H ALA 30 H ALA 30 -1.847 -9.051 2.978
216 HA ALA 30 HA ALA 30 -2.724 -7.156 4.873
217 1HB ALA 30 1HB ALA 30 -1.676 -9.389 5.417
218 2HB ALA 30 2HB ALA 30 -0.104 -8.752 4.835
219 3HB ALA 30 3HB ALA 30 -0.866 -8.039 6.258
220 H VAL 31 H VAL 31 0.284 -7.222 2.869
221 HA VAL 31 HA VAL 31 1.301 -4.927 4.253
222 HB VAL 31 HB VAL 31 2.630 -6.921 3.684
223 1HG1 VAL 31 2HG1 VAL 31 2.153 -5.992 0.871
224 2HG1 VAL 31 3HG1 VAL 31 3.646 -6.840 1.325
225 3HG1 VAL 31 1HG1 VAL 31 2.101 -7.617 1.588
226 1HG2 VAL 31 2HG2 VAL 31 3.691 -4.853 4.255
227 2HG2 VAL 31 3HG2 VAL 31 4.630 -5.805 3.090
228 3HG2 VAL 31 1HG2 VAL 31 3.730 -4.367 2.532
229 H ILE 32 H ILE 32 -0.435 -5.578 1.152
230 HA ILE 32 HA ILE 32 -0.174 -2.917 0.159
231 HB ILE 32 HB ILE 32 -2.297 -5.071 -0.141
232 1HG1 ILE 32 1HG1 ILE 32 -1.682 -4.603 -2.661
233 2HG1 ILE 32 2HG1 ILE 32 -0.247 -3.821 -2.026
234 1HG2 ILE 32 1HG2 ILE 32 -3.386 -2.758 -0.191
235 2HG2 ILE 32 2HG2 ILE 32 -2.419 -2.437 -1.669
236 3HG2 ILE 32 3HG2 ILE 32 -3.590 -3.778 -1.600
237 1HD1 ILE 32 2HD1 ILE 32 -1.071 -6.729 -1.609
238 2HD1 ILE 32 3HD1 ILE 32 0.117 -6.144 -2.783
239 3HD1 ILE 32 1HD1 ILE 32 0.459 -5.991 -1.059
240 H GLN 33 H GLN 33 -2.476 -4.484 2.529
241 HA GLN 33 HA GLN 33 -3.795 -2.107 3.108
242 1HB GLN 33 1HB GLN 33 -4.474 -4.487 3.534
243 2HB GLN 33 2HB GLN 33 -3.447 -4.492 4.974
244 1HG GLN 33 1HG GLN 33 -4.735 -2.839 6.047
245 2HG GLN 33 2HG GLN 33 -5.462 -2.293 4.525
246 1HE2 GLN 33 1HE2 GLN 33 -7.742 -5.099 4.310
247 2HE2 GLN 33 2HE2 GLN 33 -6.644 -4.139 3.302
248 H GLU 34 H GLU 34 -0.540 -3.116 4.111
249 HA GLU 34 HA GLU 34 -0.407 -1.297 6.308
250 1HB GLU 34 1HB GLU 34 1.062 -3.336 5.916
251 2HB GLU 34 2HB GLU 34 1.874 -2.419 4.627
252 1HG GLU 34 1HG GLU 34 1.665 -0.679 6.786
253 2HG GLU 34 2HG GLU 34 2.139 -2.225 7.504
254 H LEU 35 H LEU 35 0.372 -1.153 2.875
255 HA LEU 35 HA LEU 35 1.592 1.437 2.712
256 1HB LEU 35 1HB LEU 35 0.514 -0.510 0.789
257 2HB LEU 35 2HB LEU 35 0.084 1.160 0.395
258 HG LEU 35 HG LEU 35 2.785 0.021 0.555
259 1HD1 LEU 35 1HD1 LEU 35 1.449 -0.526 -1.457
260 2HD1 LEU 35 2HD1 LEU 35 1.226 1.217 -1.748
261 3HD1 LEU 35 3HD1 LEU 35 2.821 0.514 -1.851
262 1HD2 LEU 35 1HD2 LEU 35 1.819 2.883 -0.072
263 2HD2 LEU 35 2HD2 LEU 35 2.815 2.457 1.323
264 3HD2 LEU 35 3HD2 LEU 35 3.482 2.314 -0.301
265 H ARG 36 H ARG 36 -1.666 0.284 2.966
266 HA ARG 36 HA ARG 36 -3.135 2.568 2.265
267 1HB ARG 36 1HB ARG 36 -3.534 -0.067 3.185
268 2HB ARG 36 2HB ARG 36 -4.232 0.906 4.463
269 1HG ARG 36 1HG ARG 36 -6.040 0.770 3.236
270 2HG ARG 36 2HG ARG 36 -5.278 2.115 2.340
271 1HD ARG 36 1HD ARG 36 -4.340 -0.304 1.178
272 2HD ARG 36 2HD ARG 36 -6.059 -0.576 1.463
273 HE ARG 36 HE ARG 36 -5.048 0.625 -0.705
274 1HH1 ARG 36 1HH2 ARG 36 -7.502 1.582 1.609
275 2HH1 ARG 36 2HH2 ARG 36 -8.052 2.989 0.722
276 1HH2 ARG 36 1HH1 ARG 36 -5.609 2.736 -1.823
277 2HH2 ARG 36 2HH1 ARG 36 -6.951 3.594 -1.152
278 H LYS 37 H LYS 37 -2.362 1.386 5.456
279 HA LYS 37 HA LYS 37 -3.213 3.667 6.921
280 1HB LYS 37 1HB LYS 37 -0.986 1.729 7.703
281 2HB LYS 37 2HB LYS 37 -1.911 2.747 8.811
282 1HG LYS 37 1HG LYS 37 -3.959 1.452 8.346
283 2HG LYS 37 2HG LYS 37 -3.097 0.490 7.138
284 1HD LYS 37 1HD LYS 37 -1.446 -0.145 9.004
285 2HD LYS 37 2HD LYS 37 -2.620 0.562 10.129
286 1HE LYS 37 1HE LYS 37 -3.125 -1.745 10.113
287 2HE LYS 37 2HE LYS 37 -4.352 -1.023 9.056
288 1HZ LYS 37 1HZ LYS 37 -2.953 -1.664 7.176
289 2HZ LYS 37 2HZ LYS 37 -1.882 -2.382 8.203
290 3HZ LYS 37 3HZ LYS 37 -3.414 -2.973 8.073
291 H CYS 38 HN CYX 38 -0.053 2.880 5.460
292 H CYS 39 HN CYX 39 -0.560 4.539 3.426
293 H ALA 40 H ALA 40 -2.712 5.922 4.085
294 HA ALA 40 HA ALA 40 -4.214 8.325 3.781
295 1HB ALA 40 1HB ALA 40 -5.261 6.101 4.132
296 2HB ALA 40 2HB ALA 40 -4.546 6.017 5.761
297 3HB ALA 40 3HB ALA 40 -5.775 7.246 5.386
298 H GLN 41 H GLN 41 -1.315 8.055 5.485
299 HA GLN 41 HA GLN 41 -2.085 9.474 7.877
300 1HB GLN 41 1HB GLN 41 0.126 7.996 6.997
301 2HB GLN 41 2HB GLN 41 0.639 9.629 6.787
302 1HG GLN 41 1HG GLN 41 0.534 10.223 8.956
303 2HG GLN 41 2HG GLN 41 -0.509 8.836 9.407
304 1HE2 GLN 41 1HE2 GLN 41 2.187 6.515 9.712
305 2HE2 GLN 41 2HE2 GLN 41 0.447 6.671 9.505
306 H TYR 42 H TYR 42 -1.767 10.134 4.470
307 HA TYR 42 HA TYR 42 -1.090 12.921 4.944
308 1HB TYR 42 1HB TYR 42 0.060 11.052 2.858
309 2HB TYR 42 2HB TYR 42 0.610 12.671 3.246
310 HD1 TYR 42 HD2 TYR 42 1.513 13.044 5.691
311 HD2 TYR 42 HD1 TYR 42 1.024 9.168 3.943
312 HE1 TYR 42 HE2 TYR 42 3.266 12.203 7.123
313 HE2 TYR 42 HE1 TYR 42 2.851 8.274 5.289
314 HH TYR 42 HH TYR 42 3.675 9.312 7.947
315 HA PRO 43 HA PRO 43 -3.531 13.565 1.126
316 1HB PRO 43 1HB PRO 43 -2.195 15.656 -0.050
317 2HB PRO 43 2HB PRO 43 -3.228 15.868 1.396
318 1HG PRO 43 1HG PRO 43 -0.209 15.567 1.292
319 2HG PRO 43 2HG PRO 43 -1.170 16.772 2.203
320 1HD PRO 43 1HD PRO 43 -0.211 14.512 3.401
321 2HD PRO 43 2HD PRO 43 -1.797 15.175 3.829
322 H LYS 44 H LYS 44 -3.309 12.439 -0.859
323 HA LYS 44 HA LYS 44 -1.180 10.791 -1.341
324 1HB LYS 44 1HB LYS 44 -2.024 10.534 -3.680
325 2HB LYS 44 2HB LYS 44 -3.200 10.321 -2.417
326 1HG LYS 44 1HG LYS 44 -4.445 11.528 -3.917
327 2HG LYS 44 2HG LYS 44 -3.879 12.812 -2.882
328 1HD LYS 44 1HD LYS 44 -3.377 13.820 -4.838
329 2HD LYS 44 2HD LYS 44 -1.896 12.867 -4.787
330 1HE LYS 44 1HE LYS 44 -4.459 12.079 -6.228
331 2HE LYS 44 2HE LYS 44 -3.029 12.805 -6.982
332 1HZ LYS 44 1HZ LYS 44 -1.764 10.897 -6.235
333 2HZ LYS 44 2HZ LYS 44 -3.136 10.200 -5.640
334 3HZ LYS 44 3HZ LYS 44 -2.990 10.464 -7.258
335 H GLY 45 H GLY 45 -1.318 14.134 -2.409
336 1HA GLY 45 1HA GLY 45 0.706 14.047 -4.389
337 2HA GLY 45 2HA GLY 45 0.242 15.472 -3.447
338 H ARG 46 H ARG 46 1.049 13.623 -0.929
339 HA ARG 46 HA ARG 46 3.724 14.644 -0.770
340 1HB ARG 46 1HB ARG 46 3.477 14.309 1.403
341 2HB ARG 46 2HB ARG 46 1.811 13.997 1.084
342 1HG ARG 46 1HG ARG 46 1.974 11.892 1.888
343 2HG ARG 46 2HG ARG 46 3.218 11.425 0.836
344 1HD ARG 46 1HD ARG 46 3.618 12.957 3.407
345 2HD ARG 46 2HD ARG 46 3.959 11.240 3.118
346 HE ARG 46 HE ARG 46 5.407 12.492 1.156
347 1HH1 ARG 46 1HH2 ARG 46 5.199 13.078 4.599
348 2HH1 ARG 46 2HH2 ARG 46 6.815 13.685 4.812
349 1HH2 ARG 46 1HH1 ARG 46 7.653 13.052 1.373
350 2HH2 ARG 46 2HH1 ARG 46 8.207 13.776 2.852
351 H SER 47 H SER 47 2.466 11.726 -2.234
352 HA SER 47 HA SER 47 5.113 10.551 -2.262
353 1HB SER 47 1HB SER 47 4.533 9.596 -0.282
354 2HB SER 47 2HB SER 47 2.801 9.557 -0.629
355 HG SER 47 HG SER 47 4.808 7.739 -1.125
356 H VAL 48 H VAL 48 5.481 9.179 -3.818
357 HA VAL 48 HA VAL 48 3.791 9.381 -6.135
358 HB VAL 48 HB VAL 48 6.206 7.551 -5.879
359 1HG1 VAL 48 1HG1 VAL 48 4.736 7.363 -7.880
360 2HG1 VAL 48 2HG1 VAL 48 4.957 9.089 -8.202
361 3HG1 VAL 48 3HG1 VAL 48 6.346 7.979 -8.309
362 1HG2 VAL 48 1HG2 VAL 48 6.230 10.550 -6.428
363 2HG2 VAL 48 2HG2 VAL 48 7.050 9.688 -5.101
364 3HG2 VAL 48 3HG2 VAL 48 7.583 9.447 -6.764
365 H VAL 49 H VAL 49 4.880 6.670 -3.990
366 HA VAL 49 HA VAL 49 3.334 4.755 -5.351
367 HB VAL 49 HB VAL 49 3.939 3.244 -3.692
368 1HG1 VAL 49 1HG1 VAL 49 5.887 4.293 -4.981
369 2HG1 VAL 49 2HG1 VAL 49 6.224 5.254 -3.511
370 3HG1 VAL 49 3HG1 VAL 49 6.312 3.498 -3.465
371 1HG2 VAL 49 1HG2 VAL 49 4.467 5.575 -1.800
372 2HG2 VAL 49 2HG2 VAL 49 3.159 4.368 -1.681
373 3HG2 VAL 49 3HG2 VAL 49 4.839 3.877 -1.490
374 H CYS 50 HN CYX 50 2.562 6.772 -2.469
375 H SER 51 H SER 51 1.129 8.029 -4.320
376 HA SER 51 HA SER 51 -1.506 8.836 -5.080
377 1HB SER 51 1HB SER 51 1.143 8.963 -6.574
378 2HB SER 51 2HB SER 51 -0.374 9.660 -7.142
379 HG SER 51 HG SER 51 1.112 10.337 -4.796
380 H GLY 52 H GLY 52 0.540 6.020 -5.825
381 1HA GLY 52 1HA GLY 52 -1.150 4.953 -7.984
382 2HA GLY 52 2HA GLY 52 -0.011 4.060 -6.891
383 H PHE 53 H PHE 53 -0.968 4.978 -4.520
384 HA PHE 53 HA PHE 53 -2.555 2.722 -4.161
385 1HB PHE 53 1HB PHE 53 -0.584 3.936 -2.845
386 2HB PHE 53 2HB PHE 53 -1.947 4.605 -1.916
387 HD1 PHE 53 HD2 PHE 53 -0.686 1.490 -3.599
388 HD2 PHE 53 HD1 PHE 53 -2.704 3.264 -0.210
389 HE1 PHE 53 HE2 PHE 53 -0.845 -0.708 -2.577
390 HE2 PHE 53 HE1 PHE 53 -2.721 1.013 0.837
391 HZ PHE 53 HZ PHE 53 -1.980 -0.909 -0.344
392 H GLU 54 H GLU 54 -3.294 6.097 -3.405
393 HA GLU 54 HA GLU 54 -6.004 5.474 -2.718
394 1HB GLU 54 1HB GLU 54 -4.956 8.109 -3.780
395 2HB GLU 54 2HB GLU 54 -6.551 7.817 -3.067
396 1HG GLU 54 1HG GLU 54 -4.989 6.745 -1.069
397 2HG GLU 54 2HG GLU 54 -3.861 7.912 -1.731
398 H LYS 55 H LYS 55 -4.447 5.494 -5.891
399 HA LYS 55 HA LYS 55 -6.997 5.302 -7.233
400 1HB LYS 55 1HB LYS 55 -5.940 5.847 -9.060
401 2HB LYS 55 2HB LYS 55 -4.550 6.151 -8.063
402 1HG LYS 55 1HG LYS 55 -3.492 4.858 -9.530
403 2HG LYS 55 2HG LYS 55 -4.121 3.498 -8.609
404 1HD LYS 55 1HD LYS 55 -6.075 3.369 -10.158
405 2HD LYS 55 2HD LYS 55 -5.372 4.681 -11.120
406 1HE LYS 55 1HE LYS 55 -4.046 1.995 -10.542
407 2HE LYS 55 2HE LYS 55 -4.880 2.417 -12.047
408 1HZ LYS 55 2HZ LYS 55 -2.497 3.768 -10.987
409 2HZ LYS 55 3HZ LYS 55 -2.515 2.688 -12.231
410 3HZ LYS 55 1HZ LYS 55 -3.268 4.146 -12.393
411 H GLU 56 H GLU 56 -4.701 3.039 -5.830
412 HA GLU 56 HA GLU 56 -5.737 0.587 -6.738
413 1HB GLU 56 1HB GLU 56 -4.180 -0.097 -5.216
414 2HB GLU 56 2HB GLU 56 -4.122 1.523 -4.636
415 1HG GLU 56 1HG GLU 56 -4.377 0.562 -2.703
416 2HG GLU 56 2HG GLU 56 -6.061 0.865 -3.022
417 H GLU 57 H GLU 57 -6.871 2.771 -4.299
418 HA GLU 57 HA GLU 57 -9.183 1.391 -3.434
419 1HB GLU 57 1HB GLU 57 -8.114 3.715 -2.636
420 2HB GLU 57 2HB GLU 57 -9.389 4.394 -3.634
421 1HG GLU 57 1HG GLU 57 -11.108 3.217 -2.362
422 2HG GLU 57 2HG GLU 57 -9.884 2.303 -1.470
423 H GLU 58 H GLU 58 -8.796 3.440 -6.285
424 HA GLU 58 HA GLU 58 -11.572 3.290 -7.081
425 1HB GLU 58 1HB GLU 58 -10.568 5.107 -8.079
426 2HB GLU 58 2HB GLU 58 -9.039 4.304 -8.332
427 1HG GLU 58 1HG GLU 58 -10.146 4.802 -10.446
428 2HG GLU 58 2HG GLU 58 -9.862 3.082 -10.241
429 H GLU 59 H GLU 59 -8.567 1.537 -7.995
430 HA GLU 59 HA GLU 59 -9.732 -0.289 -9.785
431 1HB GLU 59 1HB GLU 59 -7.332 0.049 -9.524
432 2HB GLU 59 2HB GLU 59 -7.382 -0.671 -7.910
433 1HG GLU 59 1HG GLU 59 -7.944 -2.838 -8.787
434 2HG GLU 59 2HG GLU 59 -8.171 -2.181 -10.422
435 H ASN 60 H ASN 60 -9.745 -0.378 -6.326
436 HA ASN 60 HA ASN 60 -10.634 -3.039 -5.912
437 1HB ASN 60 1HB ASN 60 -10.945 -0.469 -4.369
438 2HB ASN 60 2HB ASN 60 -11.753 -1.920 -3.808
439 1HD2 ASN 60 1HD2 ASN 60 -7.617 -2.266 -3.901
440 2HD2 ASN 60 2HD2 ASN 60 -8.413 -1.354 -5.164
441 H LEU 61 H LEU 61 -12.447 -0.237 -7.013
442 HA LEU 61 HA LEU 61 -15.041 -1.128 -6.425
443 1HB LEU 61 1HB LEU 61 -15.838 0.502 -7.701
444 2HB LEU 61 2HB LEU 61 -14.238 1.087 -7.420
445 HG LEU 61 HG LEU 61 -14.283 1.624 -9.542
446 1HD1 LEU 61 1HD1 LEU 61 -12.747 -0.470 -9.714
447 2HD1 LEU 61 2HD1 LEU 61 -14.102 -1.175 -10.630
448 3HD1 LEU 61 3HD1 LEU 61 -13.340 0.315 -11.176
449 1HD2 LEU 61 2HD2 LEU 61 -16.679 1.252 -9.737
450 2HD2 LEU 61 3HD2 LEU 61 -15.872 0.783 -11.240
451 3HD2 LEU 61 1HD2 LEU 61 -16.416 -0.470 -10.099
452 H THR 62 H THR 62 -12.847 -2.606 -8.619
453 HA THR 62 HA THR 62 -14.649 -4.117 -10.224
454 HB THR 62 HB THR 62 -12.654 -5.662 -10.417
455 HG1 THR 62 HG1 THR 62 -11.171 -3.689 -8.973
456 1HG2 THR 62 1HG2 THR 62 -12.947 -3.779 -11.974
457 2HG2 THR 62 2HG2 THR 62 -12.044 -2.718 -10.871
458 3HG2 THR 62 3HG2 THR 62 -11.232 -4.097 -11.637
459 H ARG 63 H ARG 63 -12.738 -5.068 -7.436
460 HA ARG 63 HA ARG 63 -14.098 -7.463 -6.824
461 1HB ARG 63 1HB ARG 63 -11.805 -6.568 -5.998
462 2HB ARG 63 2HB ARG 63 -12.693 -5.780 -4.695
463 1HG ARG 63 1HG ARG 63 -12.949 -8.750 -5.330
464 2HG ARG 63 2HG ARG 63 -11.655 -8.137 -4.312
465 1HD ARG 63 1HD ARG 63 -13.049 -7.572 -2.551
466 2HD ARG 63 2HD ARG 63 -14.494 -7.447 -3.536
467 HE ARG 63 HE ARG 63 -13.305 -9.843 -2.398
468 1HH1 ARG 63 1HH2 ARG 63 -15.741 -8.568 -4.684
469 2HH1 ARG 63 2HH2 ARG 63 -16.536 -10.085 -4.898
470 1HH2 ARG 63 1HH1 ARG 63 -14.385 -11.866 -2.686
471 2HH2 ARG 63 2HH1 ARG 63 -15.768 -11.985 -3.715
472 H LYS 64 H LYS 64 -14.521 -4.237 -5.504
473 HA LYS 64 HA LYS 64 -17.090 -3.668 -5.254
474 1HB LYS 64 1HB LYS 64 -16.418 -5.712 -3.165
475 2HB LYS 64 2HB LYS 64 -17.362 -4.323 -2.648
476 1HG LYS 64 1HG LYS 64 -19.213 -4.839 -4.001
477 2HG LYS 64 2HG LYS 64 -18.293 -5.932 -5.034
478 1HD LYS 64 1HD LYS 64 -19.661 -7.285 -3.563
479 2HD LYS 64 2HD LYS 64 -17.965 -7.479 -3.106
480 1HE LYS 64 1HE LYS 64 -18.484 -5.546 -1.379
481 2HE LYS 64 2HE LYS 64 -20.175 -5.968 -1.676
482 1HZ LYS 64 1HZ LYS 64 -19.601 -8.234 -1.030
483 2HZ LYS 64 2HZ LYS 64 -18.047 -7.765 -0.717
484 3HZ LYS 64 3HZ LYS 64 -19.285 -7.155 0.179
485 H SER 65 H SER 65 -16.941 -1.540 -4.595
486 HA SER 65 HA SER 65 -14.639 -0.433 -3.648
487 1HB SER 65 1HB SER 65 -17.431 0.645 -3.215
488 2HB SER 65 2HB SER 65 -15.974 1.613 -3.567
489 HG SER 65 HG SER 65 -17.229 1.399 -5.439
490 H ALA 66 H ALA 66 -16.766 -1.924 -1.972
491 HA ALA 66 HA ALA 66 -15.656 -1.338 0.669
492 1HB ALA 66 1HB ALA 66 -17.607 0.144 0.621
493 2HB ALA 66 2HB ALA 66 -18.667 -1.225 0.214
494 3HB ALA 66 3HB ALA 66 -17.867 -1.160 1.797
495 H SER 67 H SER 67 -14.634 -3.403 0.271
496 HA SER 67 HA SER 67 -16.246 -5.505 1.435
497 1HB SER 67 1HB SER 67 -16.468 -5.874 -0.986
498 2HB SER 67 2HB SER 67 -14.699 -5.960 -1.149
499 HG SER 67 HG SER 67 -14.825 -7.683 0.410
500 H LYS 68 H LYS 68 -14.206 -3.799 2.429
501 HA LYS 68 HA LYS 68 -12.434 -5.806 3.553
502 1HB LYS 68 1HB LYS 68 -11.424 -3.258 2.229
503 2HB LYS 68 2HB LYS 68 -10.527 -4.064 3.522
504 1HG LYS 68 1HG LYS 68 -10.536 -6.178 2.201
505 2HG LYS 68 2HG LYS 68 -11.249 -5.316 0.834
506 1HD LYS 68 1HD LYS 68 -8.644 -4.364 2.098
507 2HD LYS 68 2HD LYS 68 -8.668 -5.715 0.968
508 1HE LYS 68 1HE LYS 68 -8.134 -3.804 -0.312
509 2HE LYS 68 2HE LYS 68 -9.787 -4.264 -0.726
510 1HZ LYS 68 1HZ LYS 68 -10.542 -2.514 0.755
511 2HZ LYS 68 2HZ LYS 68 -8.973 -2.055 1.037
512 3HZ LYS 68 3HZ LYS 68 -9.612 -1.965 -0.487
No H/Q in entry = 512
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