NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | in_recoord | stage | position | program | type |
|
|
13058 |
1u2f   |
cing | recoord | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
1 1H ALA 1 1H ALA 1 -5.434 10.285 5.042
2 2H ALA 1 2H ALA 1 -6.977 10.074 5.723
3 3H ALA 1 3H ALA 1 -5.730 10.778 6.638
4 HA ALA 1 HA ALA 1 -5.431 8.746 7.478
5 1HB ALA 1 1HB ALA 1 -7.201 8.058 5.196
6 2HB ALA 1 2HB ALA 1 -6.181 6.753 5.803
7 3HB ALA 1 3HB ALA 1 -7.305 7.572 6.888
8 H ARG 2 H ARG 2 -4.885 8.804 3.945
9 HA ARG 2 HA ARG 2 -2.941 8.339 2.719
10 1HB ARG 2 1HB ARG 2 -1.569 8.477 5.421
11 2HB ARG 2 2HB ARG 2 -0.790 8.598 3.842
12 1HG ARG 2 1HG ARG 2 -1.077 10.833 4.044
13 2HG ARG 2 2HG ARG 2 -2.780 10.521 3.703
14 1HD ARG 2 1HD ARG 2 -2.610 9.932 6.388
15 2HD ARG 2 2HD ARG 2 -1.487 11.282 6.232
16 HE ARG 2 HE ARG 2 -4.128 11.655 4.972
17 1HH1 ARG 2 1HH2 ARG 2 -4.275 11.388 8.020
18 2HH1 ARG 2 2HH2 ARG 2 -4.169 13.049 8.499
19 1HH2 ARG 2 1HH1 ARG 2 -3.011 14.138 5.418
20 2HH2 ARG 2 2HH1 ARG 2 -3.453 14.606 7.026
21 H ARG 3 H ARG 3 -4.467 6.266 4.625
22 HA ARG 3 HA ARG 3 -2.423 4.104 4.439
23 1HB ARG 3 1HB ARG 3 -3.449 4.305 6.635
24 2HB ARG 3 2HB ARG 3 -5.063 4.253 5.924
25 1HG ARG 3 1HG ARG 3 -5.032 2.009 6.073
26 2HG ARG 3 2HG ARG 3 -3.662 1.976 4.962
27 1HD ARG 3 1HD ARG 3 -3.109 0.844 7.087
28 2HD ARG 3 2HD ARG 3 -2.111 2.278 6.852
29 HE ARG 3 HE ARG 3 -3.098 3.172 8.789
30 1HH1 ARG 3 1HH2 ARG 3 -3.874 0.562 9.859
31 2HH1 ARG 3 2HH2 ARG 3 -5.594 0.688 10.022
32 1HH2 ARG 3 1HH1 ARG 3 -5.857 3.434 7.920
33 2HH2 ARG 3 2HH1 ARG 3 -6.717 2.315 8.924
34 H LEU 4 H LEU 4 -2.664 2.511 2.913
35 HA LEU 4 HA LEU 4 -5.248 2.459 1.418
36 1HB LEU 4 1HB LEU 4 -2.388 2.177 0.536
37 2HB LEU 4 2HB LEU 4 -3.687 1.465 -0.412
38 HG LEU 4 HG LEU 4 -3.654 4.365 0.448
39 1HD1 LEU 4 1HD1 LEU 4 -1.945 3.187 -1.397
40 2HD1 LEU 4 2HD1 LEU 4 -3.265 3.796 -2.394
41 3HD1 LEU 4 3HD1 LEU 4 -2.377 4.896 -1.340
42 1HD2 LEU 4 1HD2 LEU 4 -5.481 2.592 -1.076
43 2HD2 LEU 4 2HD2 LEU 4 -5.843 4.044 -0.143
44 3HD2 LEU 4 3HD2 LEU 4 -5.204 4.184 -1.781
45 H TYR 5 H TYR 5 -5.896 0.336 0.618
46 HA TYR 5 HA TYR 5 -4.885 -1.864 2.368
47 1HB TYR 5 1HB TYR 5 -7.206 -1.586 2.771
48 2HB TYR 5 2HB TYR 5 -7.557 -1.344 1.060
49 HD1 TYR 5 HD1 TYR 5 -7.250 -3.292 -0.548
50 HD2 TYR 5 HD2 TYR 5 -7.181 -3.763 3.721
51 HE1 TYR 5 HE1 TYR 5 -7.653 -5.724 -0.809
52 HE2 TYR 5 HE2 TYR 5 -7.583 -6.195 3.460
53 HH TYR 5 HH TYR 5 -8.735 -7.586 0.764
54 H VAL 6 H VAL 6 -4.368 -3.873 1.403
55 HA VAL 6 HA VAL 6 -4.281 -3.866 -1.586
56 HB VAL 6 HB VAL 6 -2.215 -5.279 0.084
57 1HG1 VAL 6 1HG1 VAL 6 -2.666 -5.509 -2.497
58 2HG1 VAL 6 2HG1 VAL 6 -1.811 -3.969 -2.586
59 3HG1 VAL 6 3HG1 VAL 6 -1.008 -5.385 -1.907
60 1HG2 VAL 6 1HG2 VAL 6 -2.569 -2.382 -0.254
61 2HG2 VAL 6 2HG2 VAL 6 -1.526 -3.260 0.866
62 3HG2 VAL 6 3HG2 VAL 6 -0.988 -2.955 -0.786
63 H GLY 7 H GLY 7 -4.520 -5.979 -2.540
64 1HA GLY 7 1HA GLY 7 -5.440 -8.118 -0.676
65 2HA GLY 7 2HA GLY 7 -6.449 -7.658 -2.048
66 H ASN 8 H ASN 8 -5.640 -10.257 -1.945
67 HA ASN 8 HA ASN 8 -4.594 -11.903 -3.251
68 1HB ASN 8 1HB ASN 8 -4.106 -9.464 -4.978
69 2HB ASN 8 2HB ASN 8 -3.608 -11.089 -5.449
70 1HD2 ASN 8 2HD2 ASN 8 -6.539 -9.290 -4.376
71 2HD2 ASN 8 1HD2 ASN 8 -7.627 -10.226 -5.283
72 H ILE 9 H ILE 9 -3.222 -10.275 -1.154
73 HA ILE 9 HA ILE 9 -0.403 -10.378 -2.077
74 HB ILE 9 HB ILE 9 0.112 -8.963 -0.277
75 1HG1 ILE 9 1HG1 ILE 9 -1.762 -8.649 1.545
76 2HG1 ILE 9 2HG1 ILE 9 -2.317 -10.222 0.967
77 1HG2 ILE 9 1HG2 ILE 9 -1.414 -7.898 -1.949
78 2HG2 ILE 9 2HG2 ILE 9 -2.784 -8.325 -0.923
79 3HG2 ILE 9 3HG2 ILE 9 -1.568 -7.189 -0.341
80 1HD1 ILE 9 1HD1 ILE 9 0.565 -10.186 1.319
81 2HD1 ILE 9 2HD1 ILE 9 -0.269 -9.767 2.815
82 3HD1 ILE 9 3HD1 ILE 9 -0.629 -11.289 2.001
83 HA PRO 10 HA PRO 10 0.138 -14.220 0.015
84 1HB PRO 10 1HB PRO 10 2.885 -14.252 -0.068
85 2HB PRO 10 2HB PRO 10 1.860 -14.608 -1.470
86 1HG PRO 10 1HG PRO 10 3.458 -12.159 -0.889
87 2HG PRO 10 2HG PRO 10 2.946 -12.821 -2.451
88 1HD PRO 10 1HD PRO 10 1.748 -10.639 -1.090
89 2HD PRO 10 2HD PRO 10 1.072 -11.503 -2.488
90 H PHE 11 H PHE 11 -0.596 -13.468 2.149
91 HA PHE 11 HA PHE 11 0.797 -11.878 3.968
92 1HB PHE 11 1HB PHE 11 -1.318 -12.584 4.686
93 2HB PHE 11 2HB PHE 11 -0.981 -14.279 4.342
94 HD1 PHE 11 HD1 PHE 11 -0.472 -11.508 6.711
95 HD2 PHE 11 HD2 PHE 11 0.356 -15.640 5.877
96 HE1 PHE 11 HE1 PHE 11 0.283 -11.829 9.051
97 HE2 PHE 11 HE2 PHE 11 1.110 -15.960 8.218
98 HZ PHE 11 HZ PHE 11 1.074 -14.055 9.805
99 H GLY 12 H GLY 12 2.053 -12.680 5.944
100 1HA GLY 12 1HA GLY 12 3.614 -14.306 6.889
101 2HA GLY 12 2HA GLY 12 3.794 -15.008 5.278
102 H ILE 13 H ILE 13 4.241 -12.821 3.711
103 HA ILE 13 HA ILE 13 6.964 -12.281 3.917
104 HB ILE 13 HB ILE 13 5.728 -11.775 1.915
105 1HG1 ILE 13 1HG1 ILE 13 7.606 -10.080 2.976
106 2HG1 ILE 13 2HG1 ILE 13 6.960 -9.952 1.342
107 1HG2 ILE 13 1HG2 ILE 13 4.202 -9.837 3.668
108 2HG2 ILE 13 2HG2 ILE 13 4.095 -9.850 1.908
109 3HG2 ILE 13 3HG2 ILE 13 3.570 -11.256 2.834
110 1HD1 ILE 13 1HD1 ILE 13 5.469 -8.663 3.598
111 2HD1 ILE 13 2HD1 ILE 13 6.897 -7.864 2.946
112 3HD1 ILE 13 3HD1 ILE 13 5.525 -8.213 1.896
113 H THR 14 H THR 14 8.123 -10.349 4.709
114 HA THR 14 HA THR 14 7.081 -9.475 7.300
115 HB THR 14 HB THR 14 9.261 -8.429 7.594
116 HG1 THR 14 HG1 THR 14 9.704 -9.141 4.886
117 1HG2 THR 14 1HG2 THR 14 8.841 -11.070 7.447
118 2HG2 THR 14 2HG2 THR 14 10.005 -10.916 6.131
119 3HG2 THR 14 3HG2 THR 14 10.441 -10.396 7.759
120 H GLU 15 H GLU 15 7.973 -6.910 7.607
121 HA GLU 15 HA GLU 15 6.017 -5.428 5.961
122 1HB GLU 15 1HB GLU 15 5.987 -5.032 8.370
123 2HB GLU 15 2HB GLU 15 7.696 -4.592 8.345
124 1HG GLU 15 1HG GLU 15 7.288 -2.591 7.165
125 2HG GLU 15 2HG GLU 15 5.694 -3.127 6.632
126 H GLU 16 H GLU 16 9.107 -6.313 5.465
127 HA GLU 16 HA GLU 16 10.124 -3.689 4.570
128 1HB GLU 16 1HB GLU 16 11.297 -6.479 4.596
129 2HB GLU 16 2HB GLU 16 12.118 -5.107 3.850
130 1HG GLU 16 1HG GLU 16 12.310 -3.955 5.916
131 2HG GLU 16 2HG GLU 16 11.124 -5.001 6.699
132 H ALA 17 H ALA 17 9.644 -6.897 3.037
133 HA ALA 17 HA ALA 17 10.043 -6.218 0.383
134 1HB ALA 17 1HB ALA 17 8.310 -8.184 1.775
135 2HB ALA 17 2HB ALA 17 7.896 -7.846 0.095
136 3HB ALA 17 3HB ALA 17 9.505 -8.438 0.504
137 H MET 18 H MET 18 6.674 -6.436 1.554
138 HA MET 18 HA MET 18 5.448 -4.937 -0.418
139 1HB MET 18 1HB MET 18 4.876 -5.145 2.535
140 2HB MET 18 2HB MET 18 3.875 -4.132 1.494
141 1HG MET 18 1HG MET 18 4.456 -7.045 0.913
142 2HG MET 18 2HG MET 18 3.027 -6.497 1.789
143 1HE MET 18 1HE MET 18 1.252 -6.134 1.157
144 2HE MET 18 2HE MET 18 0.754 -4.987 -0.094
145 3HE MET 18 3HE MET 18 0.705 -6.719 -0.412
146 H MET 19 H MET 19 6.655 -3.540 2.657
147 HA MET 19 HA MET 19 6.210 -0.854 2.194
148 1HB MET 19 1HB MET 19 7.315 -1.766 4.229
149 2HB MET 19 2HB MET 19 8.791 -2.003 3.294
150 1HG MET 19 1HG MET 19 8.960 0.385 2.860
151 2HG MET 19 2HG MET 19 7.407 0.671 3.645
152 1HE MET 19 1HE MET 19 7.097 -0.770 6.078
153 2HE MET 19 2HE MET 19 7.929 0.164 7.318
154 3HE MET 19 3HE MET 19 7.016 0.989 6.048
155 H ASP 20 H ASP 20 9.389 -2.280 1.448
156 HA ASP 20 HA ASP 20 10.172 -0.167 -0.292
157 1HB ASP 20 1HB ASP 20 11.766 -1.724 0.761
158 2HB ASP 20 2HB ASP 20 11.127 -3.040 -0.222
159 H PHE 21 H PHE 21 7.901 -2.635 -0.785
160 HA PHE 21 HA PHE 21 8.345 -2.909 -3.668
161 1HB PHE 21 1HB PHE 21 7.423 -4.804 -2.472
162 2HB PHE 21 2HB PHE 21 6.105 -3.819 -1.842
163 HD1 PHE 21 HD1 PHE 21 7.624 -4.245 -5.259
164 HD2 PHE 21 HD2 PHE 21 4.086 -4.399 -2.829
165 HE1 PHE 21 HE1 PHE 21 6.265 -4.777 -7.263
166 HE2 PHE 21 HE2 PHE 21 2.730 -4.931 -4.831
167 HZ PHE 21 HZ PHE 21 3.822 -5.121 -7.049
168 H PHE 22 H PHE 22 6.335 -0.958 -1.531
169 HA PHE 22 HA PHE 22 4.769 0.050 -3.819
170 1HB PHE 22 1HB PHE 22 4.624 0.442 -0.842
171 2HB PHE 22 2HB PHE 22 3.774 1.538 -1.932
172 HD1 PHE 22 HD1 PHE 22 4.368 -2.167 -1.648
173 HD2 PHE 22 HD2 PHE 22 1.565 1.004 -2.387
174 HE1 PHE 22 HE1 PHE 22 2.554 -3.835 -1.945
175 HE2 PHE 22 HE2 PHE 22 -0.245 -0.664 -2.683
176 HZ PHE 22 HZ PHE 22 0.250 -3.084 -2.463
177 H ASN 23 H ASN 23 7.177 1.293 -1.500
178 HA ASN 23 HA ASN 23 7.099 3.947 -2.699
179 1HB ASN 23 1HB ASN 23 9.244 4.259 -1.332
180 2HB ASN 23 2HB ASN 23 7.778 3.902 -0.420
181 1HD2 ASN 23 2HD2 ASN 23 8.033 2.286 1.097
182 2HD2 ASN 23 1HD2 ASN 23 9.169 1.030 1.009
183 H ALA 24 H ALA 24 9.228 1.127 -2.941
184 HA ALA 24 HA ALA 24 11.293 2.162 -4.507
185 1HB ALA 24 1HB ALA 24 9.844 -0.489 -4.791
186 2HB ALA 24 2HB ALA 24 11.353 -0.104 -5.619
187 3HB ALA 24 3HB ALA 24 11.308 -0.177 -3.857
188 H GLN 25 H GLN 25 7.945 1.689 -5.318
189 HA GLN 25 HA GLN 25 8.402 2.134 -8.198
190 1HB GLN 25 1HB GLN 25 5.845 1.910 -6.572
191 2HB GLN 25 2HB GLN 25 5.914 2.041 -8.333
192 1HG GLN 25 1HG GLN 25 7.102 -0.185 -6.648
193 2HG GLN 25 2HG GLN 25 5.697 -0.310 -7.707
194 1HE2 GLN 25 2HE2 GLN 25 9.067 -0.750 -7.604
195 2HE2 GLN 25 1HE2 GLN 25 9.358 -0.795 -9.276
196 H MET 26 H MET 26 7.359 3.876 -5.334
197 HA MET 26 HA MET 26 6.458 6.245 -6.736
198 1HB MET 26 1HB MET 26 7.422 5.958 -3.874
199 2HB MET 26 2HB MET 26 6.441 7.275 -4.519
200 1HG MET 26 1HG MET 26 5.005 5.016 -5.240
201 2HG MET 26 2HG MET 26 5.629 4.596 -3.645
202 1HE MET 26 1HE MET 26 3.120 4.374 -4.027
203 2HE MET 26 2HE MET 26 2.434 5.121 -2.578
204 3HE MET 26 3HE MET 26 1.976 5.706 -4.175
205 H ARG 27 H ARG 27 9.538 4.999 -5.679
206 HA ARG 27 HA ARG 27 10.912 7.578 -5.823
207 1HB ARG 27 1HB ARG 27 11.730 4.721 -5.400
208 2HB ARG 27 2HB ARG 27 12.957 5.908 -5.844
209 1HG ARG 27 1HG ARG 27 11.017 6.364 -3.569
210 2HG ARG 27 2HG ARG 27 12.579 5.578 -3.336
211 1HD ARG 27 1HD ARG 27 12.116 8.361 -4.446
212 2HD ARG 27 2HD ARG 27 12.809 7.962 -2.875
213 HE ARG 27 HE ARG 27 14.219 7.917 -5.415
214 1HH1 ARG 27 1HH1 ARG 27 14.421 5.104 -4.333
215 2HH1 ARG 27 2HH1 ARG 27 15.853 5.204 -3.364
216 1HH2 ARG 27 1HH2 ARG 27 15.873 8.670 -3.276
217 2HH2 ARG 27 2HH2 ARG 27 16.675 7.222 -2.766
218 H LEU 28 H LEU 28 9.849 5.267 -8.096
219 HA LEU 28 HA LEU 28 11.785 5.143 -10.072
220 1HB LEU 28 1HB LEU 28 8.814 5.274 -10.100
221 2HB LEU 28 2HB LEU 28 9.625 5.588 -11.634
222 HG LEU 28 HG LEU 28 10.656 3.277 -10.090
223 1HD1 LEU 28 1HD1 LEU 28 8.146 3.175 -9.800
224 2HD1 LEU 28 2HD1 LEU 28 8.010 3.096 -11.557
225 3HD1 LEU 28 3HD1 LEU 28 8.833 1.808 -10.677
226 1HD2 LEU 28 1HD2 LEU 28 11.441 3.972 -12.367
227 2HD2 LEU 28 2HD2 LEU 28 10.816 2.323 -12.329
228 3HD2 LEU 28 3HD2 LEU 28 9.827 3.626 -12.989
229 H GLY 29 H GLY 29 9.211 7.465 -10.750
230 1HA GLY 29 1HA GLY 29 10.880 9.215 -12.230
231 2HA GLY 29 2HA GLY 29 9.316 9.668 -11.550
232 H GLY 30 H GLY 30 10.438 8.882 -8.806
233 1HA GLY 30 1HA GLY 30 12.044 9.830 -7.249
234 2HA GLY 30 2HA GLY 30 12.341 11.133 -8.400
235 H LEU 31 H LEU 31 9.486 9.782 -6.704
236 HA LEU 31 HA LEU 31 8.291 12.451 -6.529
237 1HB LEU 31 1HB LEU 31 7.393 9.893 -5.173
238 2HB LEU 31 2HB LEU 31 6.421 11.333 -5.480
239 HG LEU 31 HG LEU 31 7.697 9.667 -7.665
240 1HD1 LEU 31 1HD1 LEU 31 5.264 9.260 -6.097
241 2HD1 LEU 31 2HD1 LEU 31 4.931 9.397 -7.823
242 3HD1 LEU 31 3HD1 LEU 31 6.056 8.172 -7.236
243 1HD2 LEU 31 1HD2 LEU 31 5.919 12.081 -7.542
244 2HD2 LEU 31 2HD2 LEU 31 7.282 11.753 -8.612
245 3HD2 LEU 31 3HD2 LEU 31 5.732 10.958 -8.889
246 H THR 32 H THR 32 10.572 10.726 -4.725
247 HA THR 32 HA THR 32 10.206 12.621 -2.459
248 HB THR 32 HB THR 32 10.751 10.736 -0.878
249 HG1 THR 32 HG1 THR 32 9.848 8.757 -2.382
250 1HG2 THR 32 1HG2 THR 32 8.257 11.188 -2.349
251 2HG2 THR 32 2HG2 THR 32 8.350 9.585 -1.619
252 3HG2 THR 32 3HG2 THR 32 8.524 11.024 -0.613
253 H GLN 33 H GLN 33 12.128 13.523 -1.865
254 HA GLN 33 HA GLN 33 14.637 12.091 -2.608
255 1HB GLN 33 1HB GLN 33 13.699 14.760 -3.488
256 2HB GLN 33 2HB GLN 33 15.370 14.696 -2.927
257 1HG GLN 33 1HG GLN 33 15.438 12.518 -4.446
258 2HG GLN 33 2HG GLN 33 14.103 13.327 -5.267
259 1HE2 GLN 33 1HE2 GLN 33 14.906 16.034 -5.030
260 2HE2 GLN 33 2HE2 GLN 33 16.350 16.261 -5.893
261 H ALA 34 H ALA 34 14.064 11.680 -0.168
262 HA ALA 34 HA ALA 34 15.546 13.741 1.409
263 1HB ALA 34 1HB ALA 34 12.802 13.023 1.691
264 2HB ALA 34 2HB ALA 34 13.663 12.374 3.087
265 3HB ALA 34 3HB ALA 34 13.750 14.097 2.719
266 HA PRO 35 HA PRO 35 17.741 10.380 3.187
267 1HB PRO 35 1HB PRO 35 17.745 10.961 5.876
268 2HB PRO 35 2HB PRO 35 18.706 11.848 4.680
269 1HG PRO 35 1HG PRO 35 16.213 12.690 6.083
270 2HG PRO 35 2HG PRO 35 17.513 13.687 5.408
271 1HD PRO 35 1HD PRO 35 14.992 13.218 4.213
272 2HD PRO 35 2HD PRO 35 16.410 13.928 3.412
273 H GLY 36 H GLY 36 15.294 9.374 2.629
274 1HA GLY 36 1HA GLY 36 14.939 7.181 4.339
275 2HA GLY 36 2HA GLY 36 13.804 8.410 4.900
276 H ASN 37 H ASN 37 12.120 6.841 4.198
277 HA ASN 37 HA ASN 37 11.662 7.013 1.244
278 1HB ASN 37 1HB ASN 37 10.171 4.866 2.451
279 2HB ASN 37 2HB ASN 37 11.395 4.778 1.184
280 1HD2 ASN 37 2HD2 ASN 37 13.664 4.473 1.866
281 2HD2 ASN 37 1HD2 ASN 37 14.025 3.869 3.410
282 HA PRO 38 HA PRO 38 7.715 8.708 2.101
283 1HB PRO 38 1HB PRO 38 6.108 7.393 0.300
284 2HB PRO 38 2HB PRO 38 7.270 8.650 -0.157
285 1HG PRO 38 1HG PRO 38 7.450 5.703 -0.537
286 2HG PRO 38 2HG PRO 38 8.221 7.000 -1.461
287 1HD PRO 38 1HD PRO 38 9.475 5.390 0.508
288 2HD PRO 38 2HD PRO 38 10.129 6.886 -0.195
289 H VAL 39 H VAL 39 6.681 5.378 1.272
290 HA VAL 39 HA VAL 39 4.649 5.193 3.195
291 HB VAL 39 HB VAL 39 6.451 3.022 2.078
292 1HG1 VAL 39 1HG1 VAL 39 4.587 2.917 4.272
293 2HG1 VAL 39 2HG1 VAL 39 3.947 1.996 2.918
294 3HG1 VAL 39 3HG1 VAL 39 5.537 1.609 3.576
295 1HG2 VAL 39 1HG2 VAL 39 4.061 4.464 1.178
296 2HG2 VAL 39 2HG2 VAL 39 5.172 3.455 0.254
297 3HG2 VAL 39 3HG2 VAL 39 3.849 2.714 1.153
298 H LEU 40 H LEU 40 4.604 4.396 5.367
299 HA LEU 40 HA LEU 40 7.295 4.261 6.662
300 1HB LEU 40 1HB LEU 40 6.087 6.419 7.090
301 2HB LEU 40 2HB LEU 40 4.812 5.491 7.880
302 HG LEU 40 HG LEU 40 6.682 4.496 9.344
303 1HD1 LEU 40 1HD1 LEU 40 8.323 5.804 7.592
304 2HD1 LEU 40 2HD1 LEU 40 8.237 6.972 8.911
305 3HD1 LEU 40 3HD1 LEU 40 8.799 5.330 9.223
306 1HD2 LEU 40 1HD2 LEU 40 5.071 6.758 9.599
307 2HD2 LEU 40 2HD2 LEU 40 5.957 5.968 10.903
308 3HD2 LEU 40 3HD2 LEU 40 6.676 7.333 10.050
309 H ALA 41 H ALA 41 3.887 3.200 6.864
310 HA ALA 41 HA ALA 41 4.883 0.853 8.418
311 1HB ALA 41 1HB ALA 41 3.176 2.951 9.372
312 2HB ALA 41 2HB ALA 41 2.251 1.452 9.303
313 3HB ALA 41 3HB ALA 41 3.747 1.523 10.235
314 H VAL 42 H VAL 42 4.556 -0.745 6.895
315 HA VAL 42 HA VAL 42 1.811 -0.919 5.715
316 HB VAL 42 HB VAL 42 4.390 -1.979 4.521
317 1HG1 VAL 42 1HG1 VAL 42 2.045 -3.056 4.052
318 2HG1 VAL 42 2HG1 VAL 42 1.769 -1.602 3.094
319 3HG1 VAL 42 3HG1 VAL 42 3.105 -2.681 2.693
320 1HG2 VAL 42 1HG2 VAL 42 3.568 0.659 4.644
321 2HG2 VAL 42 2HG2 VAL 42 4.645 -0.016 3.421
322 3HG2 VAL 42 3HG2 VAL 42 2.918 0.121 3.095
323 H GLN 43 H GLN 43 1.466 -2.087 7.864
324 HA GLN 43 HA GLN 43 2.743 -4.649 8.288
325 1HB GLN 43 1HB GLN 43 0.445 -3.155 9.472
326 2HB GLN 43 2HB GLN 43 0.503 -4.899 9.731
327 1HG GLN 43 1HG GLN 43 2.583 -4.786 10.845
328 2HG GLN 43 2HG GLN 43 2.927 -3.173 10.220
329 1HE2 GLN 43 2HE2 GLN 43 1.038 -4.959 12.636
330 2HE2 GLN 43 1HE2 GLN 43 0.589 -3.597 13.545
331 H ILE 44 H ILE 44 1.663 -6.748 8.086
332 HA ILE 44 HA ILE 44 -0.216 -6.788 5.768
333 HB ILE 44 HB ILE 44 1.503 -9.026 6.883
334 1HG1 ILE 44 1HG1 ILE 44 2.596 -8.529 4.502
335 2HG1 ILE 44 2HG1 ILE 44 1.959 -6.913 4.812
336 1HG2 ILE 44 1HG2 ILE 44 -0.234 -8.752 4.416
337 2HG2 ILE 44 2HG2 ILE 44 0.965 -10.031 4.616
338 3HG2 ILE 44 3HG2 ILE 44 -0.403 -9.925 5.723
339 1HD1 ILE 44 1HD1 ILE 44 3.718 -8.465 6.733
340 2HD1 ILE 44 2HD1 ILE 44 4.292 -7.196 5.651
341 3HD1 ILE 44 3HD1 ILE 44 3.151 -6.808 6.939
342 H ASN 45 H ASN 45 -1.816 -8.700 5.881
343 HA ASN 45 HA ASN 45 -2.714 -9.116 8.702
344 1HB ASN 45 1HB ASN 45 -4.044 -7.647 6.657
345 2HB ASN 45 2HB ASN 45 -4.955 -9.134 6.916
346 1HD2 ASN 45 2HD2 ASN 45 -5.243 -9.659 9.413
347 2HD2 ASN 45 1HD2 ASN 45 -5.636 -8.334 10.397
348 H GLN 46 H GLN 46 -3.570 -11.168 9.143
349 HA GLN 46 HA GLN 46 -2.940 -13.240 7.138
350 1HB GLN 46 1HB GLN 46 -4.153 -13.772 9.844
351 2HB GLN 46 2HB GLN 46 -3.060 -14.788 8.904
352 1HG GLN 46 1HG GLN 46 -1.293 -13.886 9.960
353 2HG GLN 46 2HG GLN 46 -1.760 -12.282 9.396
354 1HE2 GLN 46 2HE2 GLN 46 -3.468 -14.484 11.676
355 2HE2 GLN 46 1HE2 GLN 46 -3.478 -13.382 12.967
356 H ASP 47 H ASP 47 -5.018 -15.058 8.248
357 HA ASP 47 HA ASP 47 -7.209 -15.702 7.725
358 1HB ASP 47 1HB ASP 47 -7.628 -12.697 7.786
359 2HB ASP 47 2HB ASP 47 -8.922 -13.895 7.753
360 H LYS 48 H LYS 48 -8.615 -13.333 5.951
361 HA LYS 48 HA LYS 48 -8.537 -14.685 3.494
362 1HB LYS 48 1HB LYS 48 -9.401 -12.068 4.445
363 2HB LYS 48 2HB LYS 48 -8.774 -11.990 2.798
364 1HG LYS 48 1HG LYS 48 -10.704 -14.159 3.600
365 2HG LYS 48 2HG LYS 48 -11.290 -12.563 3.128
366 1HD LYS 48 1HD LYS 48 -11.247 -13.509 1.038
367 2HD LYS 48 2HD LYS 48 -9.560 -12.999 1.108
368 1HE LYS 48 1HE LYS 48 -8.786 -15.136 1.317
369 2HE LYS 48 2HE LYS 48 -10.136 -15.629 2.339
370 1HZ LYS 48 1HZ LYS 48 -11.492 -15.376 0.181
371 2HZ LYS 48 2HZ LYS 48 -9.990 -15.492 -0.599
372 3HZ LYS 48 3HZ LYS 48 -10.533 -16.763 0.390
373 H ASN 49 H ASN 49 -6.111 -12.724 4.972
374 HA ASN 49 HA ASN 49 -3.866 -12.458 4.292
375 1HB ASN 49 1HB ASN 49 -4.597 -13.454 1.541
376 2HB ASN 49 2HB ASN 49 -3.038 -13.530 2.363
377 1HD2 ASN 49 2HD2 ASN 49 -5.364 -15.571 1.373
378 2HD2 ASN 49 1HD2 ASN 49 -5.337 -16.718 2.624
379 H PHE 50 H PHE 50 -3.969 -10.226 4.365
380 HA PHE 50 HA PHE 50 -4.088 -8.859 1.763
381 1HB PHE 50 1HB PHE 50 -5.656 -7.089 2.852
382 2HB PHE 50 2HB PHE 50 -6.379 -8.570 2.227
383 HD1 PHE 50 HD1 PHE 50 -6.603 -10.556 3.914
384 HD2 PHE 50 HD2 PHE 50 -6.037 -6.460 5.075
385 HE1 PHE 50 HE1 PHE 50 -7.506 -11.070 6.166
386 HE2 PHE 50 HE2 PHE 50 -6.940 -6.973 7.327
387 HZ PHE 50 HZ PHE 50 -7.675 -9.278 7.873
388 H ALA 51 H ALA 51 -3.455 -6.456 2.119
389 HA ALA 51 HA ALA 51 -1.819 -6.161 4.594
390 1HB ALA 51 1HB ALA 51 -0.878 -5.985 1.736
391 2HB ALA 51 2HB ALA 51 -0.014 -5.176 3.043
392 3HB ALA 51 3HB ALA 51 -0.195 -6.930 3.059
393 H PHE 52 H PHE 52 -0.978 -3.882 4.800
394 HA PHE 52 HA PHE 52 -2.738 -1.868 3.472
395 1HB PHE 52 1HB PHE 52 -2.417 -2.447 6.381
396 2HB PHE 52 2HB PHE 52 -2.460 -0.749 5.909
397 HD1 PHE 52 HD1 PHE 52 -4.420 0.135 4.610
398 HD2 PHE 52 HD2 PHE 52 -4.382 -3.805 6.320
399 HE1 PHE 52 HE1 PHE 52 -6.887 0.015 4.387
400 HE2 PHE 52 HE2 PHE 52 -6.849 -3.926 6.097
401 HZ PHE 52 HZ PHE 52 -8.101 -2.015 5.131
402 H LEU 53 H LEU 53 -1.669 0.209 3.226
403 HA LEU 53 HA LEU 53 1.247 0.139 3.921
404 1HB LEU 53 1HB LEU 53 0.227 1.658 1.529
405 2HB LEU 53 2HB LEU 53 1.839 1.025 1.849
406 HG LEU 53 HG LEU 53 -0.101 -1.130 1.809
407 1HD1 LEU 53 1HD1 LEU 53 -1.302 0.383 0.259
408 2HD1 LEU 53 2HD1 LEU 53 0.165 0.542 -0.706
409 3HD1 LEU 53 3HD1 LEU 53 -0.645 -1.019 -0.584
410 1HD2 LEU 53 1HD2 LEU 53 2.581 -0.467 0.917
411 2HD2 LEU 53 2HD2 LEU 53 1.883 -2.050 1.263
412 3HD2 LEU 53 3HD2 LEU 53 1.692 -1.333 -0.334
413 H GLU 54 H GLU 54 1.630 1.643 5.431
414 HA GLU 54 HA GLU 54 -0.168 3.978 5.666
415 1HB GLU 54 1HB GLU 54 0.541 2.457 7.605
416 2HB GLU 54 2HB GLU 54 2.106 3.261 7.508
417 1HG GLU 54 1HG GLU 54 1.102 5.418 7.924
418 2HG GLU 54 2HG GLU 54 -0.522 4.738 7.806
419 H PHE 55 H PHE 55 0.438 5.882 4.779
420 HA PHE 55 HA PHE 55 3.342 6.321 4.242
421 1HB PHE 55 1HB PHE 55 1.128 7.972 3.047
422 2HB PHE 55 2HB PHE 55 2.755 7.685 2.433
423 HD1 PHE 55 HD1 PHE 55 2.871 4.713 2.928
424 HD2 PHE 55 HD2 PHE 55 -0.164 7.179 1.158
425 HE1 PHE 55 HE1 PHE 55 2.061 2.778 1.626
426 HE2 PHE 55 HE2 PHE 55 -0.978 5.231 -0.149
427 HZ PHE 55 HZ PHE 55 0.139 3.023 0.091
428 H ARG 56 H ARG 56 4.320 7.715 5.592
429 HA ARG 56 HA ARG 56 2.671 9.489 7.282
430 1HB ARG 56 1HB ARG 56 5.071 8.084 7.667
431 2HB ARG 56 2HB ARG 56 5.543 9.783 7.607
432 1HG ARG 56 1HG ARG 56 3.318 9.948 9.163
433 2HG ARG 56 2HG ARG 56 3.908 8.348 9.616
434 1HD ARG 56 1HD ARG 56 5.814 9.174 10.588
435 2HD ARG 56 2HD ARG 56 5.944 10.508 9.441
436 HE ARG 56 HE ARG 56 3.721 10.678 11.375
437 1HH1 ARG 56 1HH1 ARG 56 5.747 12.568 9.668
438 2HH1 ARG 56 2HH1 ARG 56 6.330 13.526 10.988
439 1HH2 ARG 56 1HH2 ARG 56 4.972 11.468 13.426
440 2HH2 ARG 56 2HH2 ARG 56 5.891 12.903 13.116
441 H SER 57 H SER 57 3.993 9.697 4.246
442 HA SER 57 HA SER 57 3.814 12.616 4.284
443 1HB SER 57 1HB SER 57 6.236 11.771 5.021
444 2HB SER 57 2HB SER 57 6.446 11.631 3.278
445 HG SER 57 HG SER 57 6.154 13.866 4.879
446 H VAL 58 H VAL 58 4.621 9.662 2.484
447 HA VAL 58 HA VAL 58 4.800 10.568 -0.113
448 HB VAL 58 HB VAL 58 4.465 8.096 0.970
449 1HG1 VAL 58 1HG1 VAL 58 1.946 8.579 1.028
450 2HG1 VAL 58 2HG1 VAL 58 1.999 8.492 -0.730
451 3HG1 VAL 58 3HG1 VAL 58 2.439 7.086 0.234
452 1HG2 VAL 58 1HG2 VAL 58 5.422 8.977 -1.302
453 2HG2 VAL 58 2HG2 VAL 58 4.873 7.305 -1.199
454 3HG2 VAL 58 3HG2 VAL 58 3.842 8.527 -1.944
455 H ASP 59 H ASP 59 3.565 11.842 -1.372
456 HA ASP 59 HA ASP 59 0.759 12.365 -0.548
457 1HB ASP 59 1HB ASP 59 2.874 13.908 -1.822
458 2HB ASP 59 2HB ASP 59 1.384 13.970 -2.764
459 H GLU 60 H GLU 60 1.219 9.845 -1.658
460 HA GLU 60 HA GLU 60 -0.062 10.112 -4.347
461 1HB GLU 60 1HB GLU 60 2.362 9.144 -4.154
462 2HB GLU 60 2HB GLU 60 1.555 7.711 -3.520
463 1HG GLU 60 1HG GLU 60 0.586 7.192 -5.530
464 2HG GLU 60 2HG GLU 60 0.402 8.884 -5.990
465 H THR 61 H THR 61 -0.632 9.301 -1.207
466 HA THR 61 HA THR 61 -1.823 6.820 -1.050
467 HB THR 61 HB THR 61 -1.851 8.287 0.865
468 HG1 THR 61 HG1 THR 61 -3.677 6.791 0.441
469 1HG2 THR 61 1HG2 THR 61 -2.086 10.396 -0.453
470 2HG2 THR 61 2HG2 THR 61 -3.793 10.020 -0.687
471 3HG2 THR 61 3HG2 THR 61 -3.173 10.330 0.935
472 H THR 62 H THR 62 -2.923 9.540 -2.956
473 HA THR 62 HA THR 62 -5.549 8.319 -3.460
474 HB THR 62 HB THR 62 -5.021 10.852 -3.349
475 HG1 THR 62 HG1 THR 62 -6.421 9.734 -5.547
476 1HG2 THR 62 1HG2 THR 62 -3.088 10.770 -4.881
477 2HG2 THR 62 2HG2 THR 62 -4.145 10.221 -6.181
478 3HG2 THR 62 3HG2 THR 62 -4.347 11.836 -5.503
479 H GLN 63 H GLN 63 -2.554 8.931 -5.283
480 HA GLN 63 HA GLN 63 -3.623 7.482 -7.613
481 1HB GLN 63 1HB GLN 63 -0.751 8.321 -7.293
482 2HB GLN 63 2HB GLN 63 -1.704 8.186 -8.768
483 1HG GLN 63 1HG GLN 63 -3.038 10.122 -8.145
484 2HG GLN 63 2HG GLN 63 -2.224 10.221 -6.583
485 1HE2 GLN 63 2HE2 GLN 63 -2.134 11.406 -9.767
486 2HE2 GLN 63 1HE2 GLN 63 -0.550 12.016 -9.755
487 H ALA 64 H ALA 64 -1.880 6.724 -4.749
488 HA ALA 64 HA ALA 64 -0.197 4.625 -5.525
489 1HB ALA 64 1HB ALA 64 -1.753 5.279 -3.092
490 2HB ALA 64 2HB ALA 64 -1.319 3.579 -3.264
491 3HB ALA 64 3HB ALA 64 -0.060 4.814 -3.252
492 H MET 65 H MET 65 -3.707 4.730 -5.422
493 HA MET 65 HA MET 65 -4.250 1.948 -5.634
494 1HB MET 65 1HB MET 65 -5.709 4.287 -6.911
495 2HB MET 65 2HB MET 65 -6.356 2.653 -6.758
496 1HG MET 65 1HG MET 65 -6.433 2.789 -4.389
497 2HG MET 65 2HG MET 65 -5.390 4.210 -4.357
498 1HE MET 65 1HE MET 65 -8.153 2.737 -6.126
499 2HE MET 65 2HE MET 65 -9.546 3.357 -5.244
500 3HE MET 65 3HE MET 65 -9.065 4.097 -6.778
501 H ALA 66 H ALA 66 -2.770 4.164 -7.797
502 HA ALA 66 HA ALA 66 -3.343 3.020 -10.320
503 1HB ALA 66 1HB ALA 66 -0.897 4.431 -9.238
504 2HB ALA 66 2HB ALA 66 -1.012 3.908 -10.918
505 3HB ALA 66 3HB ALA 66 -2.157 5.089 -10.282
506 H PHE 67 H PHE 67 -1.130 1.988 -7.759
507 HA PHE 67 HA PHE 67 0.093 -0.062 -9.469
508 1HB PHE 67 1HB PHE 67 0.215 0.075 -6.447
509 2HB PHE 67 2HB PHE 67 1.344 -0.720 -7.538
510 HD1 PHE 67 HD1 PHE 67 2.322 0.923 -9.441
511 HD2 PHE 67 HD2 PHE 67 0.856 2.147 -5.594
512 HE1 PHE 67 HE1 PHE 67 3.670 2.999 -9.588
513 HE2 PHE 67 HE2 PHE 67 2.202 4.224 -5.741
514 HZ PHE 67 HZ PHE 67 3.612 4.649 -7.737
515 H ASP 68 H ASP 68 -2.921 0.233 -8.274
516 HA ASP 68 HA ASP 68 -3.696 -1.954 -6.822
517 1HB ASP 68 1HB ASP 68 -5.333 -0.415 -7.684
518 2HB ASP 68 2HB ASP 68 -4.955 -0.862 -9.346
519 H GLY 69 H GLY 69 -2.608 -3.880 -7.010
520 1HA GLY 69 1HA GLY 69 -2.674 -6.090 -8.043
521 2HA GLY 69 2HA GLY 69 -2.881 -5.311 -9.609
522 H ILE 70 H ILE 70 -1.012 -3.901 -10.302
523 HA ILE 70 HA ILE 70 1.224 -4.029 -11.051
524 HB ILE 70 HB ILE 70 1.091 -2.515 -9.038
525 1HG1 ILE 70 1HG1 ILE 70 3.716 -3.926 -9.609
526 2HG1 ILE 70 2HG1 ILE 70 3.077 -2.500 -10.415
527 1HG2 ILE 70 1HG2 ILE 70 1.642 -5.067 -7.677
528 2HG2 ILE 70 2HG2 ILE 70 2.614 -3.707 -7.126
529 3HG2 ILE 70 3HG2 ILE 70 0.856 -3.611 -7.080
530 1HD1 ILE 70 1HD1 ILE 70 2.984 -1.746 -7.772
531 2HD1 ILE 70 2HD1 ILE 70 4.453 -2.720 -7.829
532 3HD1 ILE 70 3HD1 ILE 70 4.277 -1.327 -8.896
533 H ILE 71 H ILE 71 3.174 -5.298 -8.774
534 HA ILE 71 HA ILE 71 2.492 -8.126 -9.192
535 HB ILE 71 HB ILE 71 4.889 -6.789 -10.453
536 1HG1 ILE 71 1HG1 ILE 71 2.841 -7.023 -11.810
537 2HG1 ILE 71 2HG1 ILE 71 4.112 -8.083 -12.419
538 1HG2 ILE 71 1HG2 ILE 71 4.551 -9.580 -9.423
539 2HG2 ILE 71 2HG2 ILE 71 5.398 -9.354 -10.953
540 3HG2 ILE 71 3HG2 ILE 71 6.001 -8.578 -9.488
541 1HD1 ILE 71 1HD1 ILE 71 2.957 -9.760 -10.650
542 2HD1 ILE 71 2HD1 ILE 71 1.555 -8.775 -11.067
543 3HD1 ILE 71 3HD1 ILE 71 2.431 -9.642 -12.329
544 H PHE 72 H PHE 72 2.767 -8.931 -7.179
545 HA PHE 72 HA PHE 72 5.163 -8.025 -5.635
546 1HB PHE 72 1HB PHE 72 2.953 -7.222 -4.725
547 2HB PHE 72 2HB PHE 72 2.514 -8.911 -4.465
548 HD1 PHE 72 HD1 PHE 72 5.466 -6.668 -3.853
549 HD2 PHE 72 HD2 PHE 72 2.895 -9.756 -2.334
550 HE1 PHE 72 HE1 PHE 72 6.725 -6.665 -1.716
551 HE2 PHE 72 HE2 PHE 72 4.154 -9.753 -0.197
552 HZ PHE 72 HZ PHE 72 6.068 -8.207 0.111
553 H GLN 73 H GLN 73 6.519 -9.661 -5.042
554 HA GLN 73 HA GLN 73 7.372 -11.860 -4.994
555 1HB GLN 73 1HB GLN 73 5.811 -11.586 -2.929
556 2HB GLN 73 2HB GLN 73 4.701 -12.621 -3.826
557 1HG GLN 73 1HG GLN 73 6.367 -14.380 -3.972
558 2HG GLN 73 2HG GLN 73 7.588 -13.335 -3.243
559 1HE2 GLN 73 2HE2 GLN 73 6.005 -12.172 -1.156
560 2HE2 GLN 73 1HE2 GLN 73 5.588 -13.395 -0.055
561 H GLY 74 H GLY 74 6.120 -11.191 -7.482
562 1HA GLY 74 1HA GLY 74 5.326 -12.250 -9.420
563 2HA GLY 74 2HA GLY 74 5.849 -13.757 -8.666
564 H GLN 75 H GLN 75 3.237 -11.353 -8.152
565 HA GLN 75 HA GLN 75 1.165 -13.320 -8.608
566 1HB GLN 75 1HB GLN 75 1.926 -14.101 -6.397
567 2HB GLN 75 2HB GLN 75 1.693 -12.480 -5.740
568 1HG GLN 75 1HG GLN 75 -0.307 -13.554 -5.150
569 2HG GLN 75 2HG GLN 75 -0.744 -12.730 -6.648
570 1HE2 GLN 75 1HE2 GLN 75 -0.747 -15.767 -5.112
571 2HE2 GLN 75 2HE2 GLN 75 -0.996 -16.733 -6.486
572 H SER 76 H SER 76 -0.579 -12.166 -9.280
573 HA SER 76 HA SER 76 -0.678 -9.383 -9.454
574 1HB SER 76 1HB SER 76 -2.201 -11.173 -10.525
575 2HB SER 76 2HB SER 76 -3.153 -10.944 -9.076
576 HG SER 76 HG SER 76 -3.859 -9.524 -10.671
577 H LEU 77 H LEU 77 -2.077 -7.830 -8.290
578 HA LEU 77 HA LEU 77 -2.513 -8.602 -5.436
579 1HB LEU 77 1HB LEU 77 -1.577 -5.861 -6.286
580 2HB LEU 77 2HB LEU 77 -1.558 -6.572 -4.671
581 HG LEU 77 HG LEU 77 0.050 -7.668 -6.988
582 1HD1 LEU 77 1HD1 LEU 77 0.552 -5.246 -6.018
583 2HD1 LEU 77 2HD1 LEU 77 1.278 -6.173 -4.704
584 3HD1 LEU 77 3HD1 LEU 77 1.865 -6.375 -6.355
585 1HD2 LEU 77 1HD2 LEU 77 -0.682 -8.849 -4.627
586 2HD2 LEU 77 2HD2 LEU 77 0.787 -9.245 -5.519
587 3HD2 LEU 77 3HD2 LEU 77 0.850 -8.100 -4.179
588 H LYS 78 H LYS 78 -3.736 -6.375 -4.488
589 HA LYS 78 HA LYS 78 -5.727 -5.359 -6.374
590 1HB LYS 78 1HB LYS 78 -6.842 -7.423 -6.005
591 2HB LYS 78 2HB LYS 78 -6.436 -7.426 -4.288
592 1HG LYS 78 1HG LYS 78 -8.202 -6.110 -3.752
593 2HG LYS 78 2HG LYS 78 -7.937 -5.045 -5.132
594 1HD LYS 78 1HD LYS 78 -8.816 -7.658 -6.022
595 2HD LYS 78 2HD LYS 78 -9.961 -6.980 -4.864
596 1HE LYS 78 1HE LYS 78 -10.105 -4.914 -6.170
597 2HE LYS 78 2HE LYS 78 -8.900 -5.524 -7.303
598 1HZ LYS 78 1HZ LYS 78 -11.069 -7.349 -6.910
599 2HZ LYS 78 2HZ LYS 78 -11.594 -5.851 -7.508
600 3HZ LYS 78 3HZ LYS 78 -10.417 -6.736 -8.355
601 H ILE 79 H ILE 79 -5.140 -3.281 -5.653
602 HA ILE 79 HA ILE 79 -5.054 -2.665 -2.797
603 HB ILE 79 HB ILE 79 -4.928 -0.931 -5.273
604 1HG1 ILE 79 1HG1 ILE 79 -2.988 -2.285 -3.461
605 2HG1 ILE 79 2HG1 ILE 79 -2.854 -1.930 -5.183
606 1HG2 ILE 79 1HG2 ILE 79 -5.933 0.223 -3.262
607 2HG2 ILE 79 2HG2 ILE 79 -4.440 -0.127 -2.391
608 3HG2 ILE 79 3HG2 ILE 79 -4.409 0.923 -3.808
609 1HD1 ILE 79 1HD1 ILE 79 -2.753 0.559 -4.410
610 2HD1 ILE 79 2HD1 ILE 79 -2.328 -0.124 -2.841
611 3HD1 ILE 79 3HD1 ILE 79 -1.310 -0.443 -4.246
612 H ARG 80 H ARG 80 -6.594 -1.348 -1.675
613 HA ARG 80 HA ARG 80 -9.201 -0.973 -3.089
614 1HB ARG 80 1HB ARG 80 -8.695 -2.136 -0.340
615 2HB ARG 80 2HB ARG 80 -10.273 -1.525 -0.838
616 1HG ARG 80 1HG ARG 80 -9.361 -3.187 -2.943
617 2HG ARG 80 2HG ARG 80 -9.059 -4.066 -1.444
618 1HD ARG 80 1HD ARG 80 -11.264 -4.406 -1.081
619 2HD ARG 80 2HD ARG 80 -11.659 -2.726 -1.447
620 HE ARG 80 HE ARG 80 -11.039 -4.069 -3.888
621 1HH1 ARG 80 1HH1 ARG 80 -13.476 -3.371 -1.587
622 2HH1 ARG 80 2HH1 ARG 80 -14.747 -4.123 -2.491
623 1HH2 ARG 80 1HH2 ARG 80 -12.641 -5.304 -4.979
624 2HH2 ARG 80 2HH2 ARG 80 -14.275 -5.218 -4.411
625 H ARG 81 H ARG 81 -10.649 0.417 -1.386
626 HA ARG 81 HA ARG 81 -8.922 2.724 -0.580
627 1HB ARG 81 1HB ARG 81 -11.707 2.639 -1.756
628 2HB ARG 81 2HB ARG 81 -11.062 4.076 -0.961
629 1HG ARG 81 1HG ARG 81 -8.995 3.540 -2.599
630 2HG ARG 81 2HG ARG 81 -10.301 2.850 -3.564
631 1HD ARG 81 1HD ARG 81 -10.992 5.454 -2.412
632 2HD ARG 81 2HD ARG 81 -9.604 5.530 -3.497
633 HE ARG 81 HE ARG 81 -11.293 4.122 -5.035
634 1HH1 ARG 81 1HH2 ARG 81 -11.044 7.292 -4.671
635 2HH1 ARG 81 2HH2 ARG 81 -12.718 7.700 -4.846
636 1HH2 ARG 81 1HH1 ARG 81 -13.823 4.429 -4.526
637 2HH2 ARG 81 2HH1 ARG 81 -14.291 6.080 -4.764
638 HA PRO 82 HA PRO 82 -10.821 1.294 3.291
639 1HB PRO 82 1HB PRO 82 -8.681 2.071 4.834
640 2HB PRO 82 2HB PRO 82 -8.775 0.509 4.003
641 1HG PRO 82 1HG PRO 82 -7.164 2.918 3.294
642 2HG PRO 82 2HG PRO 82 -6.843 1.212 2.944
643 1HD PRO 82 1HD PRO 82 -7.875 3.104 1.115
644 2HD PRO 82 2HD PRO 82 -7.885 1.340 0.904
645 H HIS 83 H HIS 83 -11.721 3.668 2.143
646 HA HIS 83 HA HIS 83 -11.533 5.562 4.448
647 1HB HIS 83 1HB HIS 83 -10.286 6.278 2.304
648 2HB HIS 83 2HB HIS 83 -11.888 6.484 1.595
649 HD1 HIS 83 HD1 HIS 83 -9.437 8.162 3.734
650 HD2 HIS 83 HD2 HIS 83 -13.555 8.401 3.135
651 HE1 HIS 83 HE1 HIS 83 -10.183 10.356 4.757
652 H ASP 84 H ASP 84 -13.468 4.201 1.831
653 HA ASP 84 HA ASP 84 -15.783 4.374 1.392
654 1HB ASP 84 1HB ASP 84 -17.123 3.891 3.523
655 2HB ASP 84 2HB ASP 84 -15.890 2.707 3.091
656 H TYR 85 H TYR 85 -14.937 6.877 1.183
657 HA TYR 85 HA TYR 85 -16.158 8.667 3.141
658 1HB TYR 85 1HB TYR 85 -15.152 10.383 1.957
659 2HB TYR 85 2HB TYR 85 -14.119 9.040 1.468
660 HD1 TYR 85 HD1 TYR 85 -15.608 7.556 -0.473
661 HD2 TYR 85 HD2 TYR 85 -15.513 11.806 0.144
662 HE1 TYR 85 HE1 TYR 85 -16.261 7.915 -2.838
663 HE2 TYR 85 HE2 TYR 85 -16.166 12.165 -2.221
664 HH TYR 85 HH TYR 85 -17.308 10.931 -4.018
665 H GLN 86 H GLN 86 -17.895 10.201 2.553
666 HA GLN 86 HA GLN 86 -20.142 10.472 1.898
667 1HB GLN 86 1HB GLN 86 -18.674 9.845 -0.668
668 2HB GLN 86 2HB GLN 86 -20.387 10.267 -0.654
669 1HG GLN 86 1HG GLN 86 -19.867 12.384 0.493
670 2HG GLN 86 2HG GLN 86 -18.154 11.966 0.496
671 1HE2 GLN 86 2HE2 GLN 86 -19.422 14.282 -0.884
672 2HE2 GLN 86 1HE2 GLN 86 -19.070 14.092 -2.534
673 HA PRO 87 HA PRO 87 -21.207 6.050 2.047
674 1HB PRO 87 1HB PRO 87 -23.123 6.403 3.988
675 2HB PRO 87 2HB PRO 87 -21.404 6.159 4.342
676 1HG PRO 87 1HG PRO 87 -23.011 8.667 4.485
677 2HG PRO 87 2HG PRO 87 -21.552 8.217 5.382
678 1HD PRO 87 1HD PRO 87 -21.652 9.956 3.152
679 2HD PRO 87 2HD PRO 87 -20.185 9.230 3.844
680 H LEU 88 H LEU 88 -22.221 6.124 -0.041
681 HA LEU 88 HA LEU 88 -24.381 7.568 -0.949
682 1HB LEU 88 1HB LEU 88 -23.143 5.746 -2.194
683 2HB LEU 88 2HB LEU 88 -24.156 4.576 -1.349
684 HG LEU 88 HG LEU 88 -25.906 6.556 -2.361
685 1HD1 LEU 88 1HD1 LEU 88 -23.724 5.739 -4.279
686 2HD1 LEU 88 2HD1 LEU 88 -25.334 6.172 -4.854
687 3HD1 LEU 88 3HD1 LEU 88 -24.366 7.353 -3.972
688 1HD2 LEU 88 1HD2 LEU 88 -25.249 3.695 -3.079
689 2HD2 LEU 88 2HD2 LEU 88 -26.619 4.299 -2.147
690 3HD2 LEU 88 3HD2 LEU 88 -26.546 4.576 -3.887
691 HA PRO 89 HA PRO 89 -27.314 6.262 2.241
692 1HB PRO 89 1HB PRO 89 -28.850 8.531 2.023
693 2HB PRO 89 2HB PRO 89 -27.386 8.432 3.017
694 1HG PRO 89 1HG PRO 89 -27.783 9.788 0.391
695 2HG PRO 89 2HG PRO 89 -26.621 10.152 1.677
696 1HD PRO 89 1HD PRO 89 -26.059 8.765 -0.728
697 2HD PRO 89 2HD PRO 89 -25.002 8.860 0.696
698 H GLY 90 H GLY 90 -29.809 6.120 2.098
699 1HA GLY 90 1HA GLY 90 -31.620 6.425 0.219
700 2HA GLY 90 2HA GLY 90 -30.538 5.368 -0.690
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