NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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|
10557 |
1pxq   |
5860 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 3H ASN 1 HT3 ASN 1 4.229 2.303 12.749
2 HA ASN 1 HA ASN 1 5.691 3.821 14.022
3 1HB ASN 1 HB2 ASN 1 7.233 3.431 11.631
4 2HB ASN 1 HB1 ASN 1 6.977 5.155 11.878
5 1HD2 ASN 1 1HD2 ASN 1 9.363 3.377 12.141
6 2HD2 ASN 1 2HD2 ASN 1 9.981 3.703 13.721
7 H LYS 2 HN LYS 2 5.271 6.073 14.196
8 HA LYS 2 HA LYS 2 2.799 6.858 13.007
9 1HB LYS 2 HB2 LYS 2 4.569 7.820 15.121
10 2HB LYS 2 HB1 LYS 2 3.835 9.128 14.204
11 1HG LYS 2 HG2 LYS 2 1.629 7.816 14.592
12 2HG LYS 2 HG1 LYS 2 2.534 7.040 15.893
13 1HD LYS 2 HD2 LYS 2 1.295 8.952 16.742
14 2HD LYS 2 HD1 LYS 2 3.032 9.247 16.848
15 1HE LYS 2 HE2 LYS 2 2.935 10.982 15.434
16 2HE LYS 2 HE1 LYS 2 1.851 10.136 14.329
17 1HZ LYS 2 HZ1 LYS 2 0.499 11.796 15.074
18 2HZ LYS 2 HZ2 LYS 2 1.205 11.861 16.609
19 3HZ LYS 2 HZ3 LYS 2 0.136 10.609 16.224
20 H GLY 3 HN GLY 3 5.963 7.012 11.895
21 1HA GLY 3 HA2 GLY 3 5.941 9.546 10.607
22 2HA GLY 3 HA1 GLY 3 7.017 8.206 10.240
23 H CYS 4 HN CYS 4 5.295 6.256 9.406
24 HA CYS 4 HA CYS 4 4.627 7.190 6.780
25 1HB CYS 4 HB2 CYS 4 4.260 4.496 8.101
26 2HB CYS 4 HB1 CYS 4 3.929 4.821 6.403
27 H ALA 5 HN ALA 5 3.061 8.680 8.382
28 HA ALA 5 HA ALA 5 0.440 7.471 8.639
29 1HB ALA 5 HB1 ALA 5 0.632 8.888 10.390
30 2HB ALA 5 HB2 ALA 5 -0.011 10.047 9.227
31 3HB ALA 5 HB3 ALA 5 1.725 9.975 9.534
32 H THR 6 HN THR 6 2.186 9.388 6.367
33 HA THR 6 HA THR 6 0.030 10.669 5.072
34 HB THR 6 HB THR 6 2.374 11.356 4.795
35 HG1 THR 6 HG1 THR 6 1.756 12.142 2.969
36 1HG2 THR 6 1HG2 THR 6 2.984 8.742 4.404
37 2HG2 THR 6 2HG2 THR 6 4.024 10.100 3.976
38 3HG2 THR 6 3HG2 THR 6 2.991 9.360 2.753
39 H CYS 7 HN CYS 7 0.797 7.396 5.221
40 HA CYS 7 HA CYS 7 -1.145 6.783 3.171
41 1HB CYS 7 HB2 CYS 7 0.640 5.027 2.274
42 2HB CYS 7 HB1 CYS 7 0.518 6.650 1.607
43 H SER 8 HN SER 8 -1.380 6.450 5.850
44 HA SER 8 HA SER 8 -0.547 4.018 6.942
45 1HB SER 8 HB2 SER 8 -3.101 5.562 7.445
46 2HB SER 8 HB1 SER 8 -2.478 4.274 8.477
47 HG SER 8 HG SER 8 -0.618 5.570 8.823
48 H ILE 9 HN ILE 9 -2.865 4.698 4.511
49 HA ILE 9 HA ILE 9 -4.761 2.763 4.648
50 HB ILE 9 HB ILE 9 -3.320 4.005 2.346
51 1HG1 ILE 9 2HG1 ILE 9 -6.093 4.223 2.068
52 2HG1 ILE 9 1HG1 ILE 9 -5.806 4.349 3.800
53 1HG2 ILE 9 1HG2 ILE 9 -3.595 2.042 1.226
54 2HG2 ILE 9 2HG2 ILE 9 -5.173 2.775 0.936
55 3HG2 ILE 9 3HG2 ILE 9 -4.986 1.551 2.193
56 1HD1 ILE 9 1HD1 ILE 9 -5.460 6.315 1.792
57 2HD1 ILE 9 2HD1 ILE 9 -3.883 5.959 2.496
58 3HD1 ILE 9 3HD1 ILE 9 -5.220 6.459 3.533
59 H GLY 10 HN GLY 10 -1.868 2.217 2.611
60 1HA GLY 10 HA2 GLY 10 -0.525 0.184 3.343
61 2HA GLY 10 HA1 GLY 10 -2.074 -0.641 3.327
62 H ALA 11 HN ALA 11 0.297 -1.300 1.826
63 HA ALA 11 HA ALA 11 -0.175 -0.512 -0.907
64 1HB ALA 11 HB1 ALA 11 1.889 -1.282 -1.299
65 2HB ALA 11 HB2 ALA 11 1.574 -2.814 -0.484
66 3HB ALA 11 HB3 ALA 11 2.029 -1.392 0.456
67 H ALA 12 HN ALA 12 -1.747 -1.365 -2.091
68 HA ALA 12 HA ALA 12 -2.072 -4.197 -2.333
69 1HB ALA 12 HB1 ALA 12 -3.471 -4.356 -0.562
70 2HB ALA 12 HB2 ALA 12 -4.655 -3.800 -1.744
71 3HB ALA 12 HB3 ALA 12 -3.921 -2.652 -0.625
72 H CYS 13 HN CYS 13 -1.692 -3.752 -4.515
73 HA CYS 13 HA CYS 13 -3.139 -1.846 -6.020
74 1HB CYS 13 HB2 CYS 13 -1.352 -4.143 -6.658
75 2HB CYS 13 HB1 CYS 13 -2.410 -3.555 -7.937
76 H LEU 14 HN LEU 14 -3.644 -5.258 -5.343
77 HA LEU 14 HA LEU 14 -5.528 -6.544 -5.499
78 1HB LEU 14 HB2 LEU 14 -6.947 -4.221 -6.791
79 2HB LEU 14 HB1 LEU 14 -7.664 -5.610 -6.001
80 HG LEU 14 HG LEU 14 -6.025 -3.537 -4.548
81 1HD1 LEU 14 1HD1 LEU 14 -9.023 -3.753 -4.789
82 2HD1 LEU 14 2HD1 LEU 14 -8.013 -2.494 -5.501
83 3HD1 LEU 14 3HD1 LEU 14 -8.144 -2.633 -3.748
84 1HD2 LEU 14 1HD2 LEU 14 -6.208 -5.807 -3.541
85 2HD2 LEU 14 2HD2 LEU 14 -7.959 -5.595 -3.498
86 3HD2 LEU 14 3HD2 LEU 14 -6.918 -4.525 -2.559
87 H VAL 15 HN VAL 15 -3.676 -5.320 -7.860
88 HA VAL 15 HA VAL 15 -4.976 -6.066 -10.255
89 HB VAL 15 HB VAL 15 -3.059 -4.540 -10.221
90 1HG1 VAL 15 1HG1 VAL 15 -1.019 -5.029 -9.400
91 2HG1 VAL 15 2HG1 VAL 15 -1.072 -6.698 -9.970
92 3HG1 VAL 15 3HG1 VAL 15 -1.904 -6.247 -8.481
93 1HG2 VAL 15 1HG2 VAL 15 -3.670 -5.978 -12.226
94 2HG2 VAL 15 2HG2 VAL 15 -2.286 -6.982 -11.793
95 3HG2 VAL 15 3HG2 VAL 15 -2.047 -5.287 -12.212
96 H ASP 16 HN ASP 16 -4.047 -7.990 -7.745
97 HA ASP 16 HA ASP 16 -3.180 -10.223 -9.406
98 1HB ASP 16 HB2 ASP 16 -2.227 -11.122 -7.511
99 2HB ASP 16 HB1 ASP 16 -2.167 -9.408 -7.098
100 H GLY 17 HN GLY 17 -5.958 -9.056 -9.226
101 1HA GLY 17 HA2 GLY 17 -7.358 -11.583 -9.156
102 2HA GLY 17 HA1 GLY 17 -7.857 -10.441 -7.914
103 HA PRO 18 HA PRO 18 -10.786 -8.654 -10.698
104 1HB PRO 18 HB2 PRO 18 -10.405 -5.970 -10.008
105 2HB PRO 18 HB1 PRO 18 -11.526 -7.090 -9.234
106 1HG PRO 18 HG2 PRO 18 -8.822 -6.212 -8.361
107 2HG PRO 18 HG1 PRO 18 -10.239 -6.637 -7.388
108 1HD PRO 18 HD2 PRO 18 -8.123 -8.288 -7.656
109 2HD PRO 18 HD1 PRO 18 -9.783 -8.895 -7.483
110 H ILE 19 HN ILE 19 -7.526 -7.401 -10.517
111 HA ILE 19 HA ILE 19 -6.044 -6.988 -12.203
112 HB ILE 19 HB ILE 19 -8.355 -6.964 -14.097
113 1HG1 ILE 19 2HG1 ILE 19 -8.200 -9.145 -13.044
114 2HG1 ILE 19 1HG1 ILE 19 -7.622 -9.252 -14.702
115 1HG2 ILE 19 1HG2 ILE 19 -6.233 -7.671 -15.583
116 2HG2 ILE 19 2HG2 ILE 19 -5.448 -6.623 -14.401
117 3HG2 ILE 19 3HG2 ILE 19 -6.771 -6.003 -15.388
118 1HD1 ILE 19 1HD1 ILE 19 -5.713 -10.098 -13.993
119 2HD1 ILE 19 2HD1 ILE 19 -6.306 -10.020 -12.333
120 3HD1 ILE 19 3HD1 ILE 19 -5.414 -8.661 -13.016
121 HA PRO 20 HA PRO 20 -8.063 -2.617 -12.159
122 1HB PRO 20 HB2 PRO 20 -7.310 -1.710 -9.715
123 2HB PRO 20 HB1 PRO 20 -8.866 -2.485 -10.016
124 1HG PRO 20 HG2 PRO 20 -6.362 -3.645 -8.862
125 2HG PRO 20 HG1 PRO 20 -8.044 -3.871 -8.347
126 1HD PRO 20 HD2 PRO 20 -6.724 -5.703 -9.834
127 2HD PRO 20 HD1 PRO 20 -8.469 -5.433 -9.984
128 H ASP 21 HN ASP 21 -5.054 -4.037 -11.232
129 HA ASP 21 HA ASP 21 -2.919 -3.538 -11.872
130 1HB ASP 21 HB2 ASP 21 -4.390 -2.146 -13.729
131 2HB ASP 21 HB1 ASP 21 -3.390 -0.885 -13.014
132 H PHE 22 HN PHE 22 -1.543 -3.046 -10.359
133 1HB PHE 22 HB2 PHE 22 0.456 -0.139 -8.823
134 2HB PHE 22 HB1 PHE 22 0.808 -1.691 -9.577
135 HD1 PHE 22 HD1 PHE 22 0.038 1.753 -10.110
136 HD2 PHE 22 HD2 PHE 22 -0.045 -2.091 -11.933
137 HE1 PHE 22 HE1 PHE 22 -0.108 2.812 -12.326
138 HE2 PHE 22 HE2 PHE 22 -0.190 -1.040 -14.153
139 HZ PHE 22 HZ PHE 22 -0.221 1.415 -14.351
140 H GLU 23 HN GLU 23 -3.566 -1.569 -7.959
141 HA GLU 23 HA GLU 23 -3.943 1.305 -7.841
142 1HB GLU 23 HB2 GLU 23 -5.763 -1.034 -7.336
143 2HB GLU 23 HB1 GLU 23 -6.231 0.605 -6.911
144 1HG GLU 23 HG2 GLU 23 -5.616 -0.482 -9.641
145 2HG GLU 23 HG1 GLU 23 -7.161 0.113 -9.035
146 H ILE 24 HN ILE 24 -2.094 1.358 -6.257
147 HA ILE 24 HA ILE 24 -2.758 0.527 -3.553
148 HB ILE 24 HB ILE 24 -0.345 2.068 -4.517
149 1HG1 ILE 24 2HG1 ILE 24 0.060 -0.727 -3.777
150 2HG1 ILE 24 1HG1 ILE 24 -1.024 -0.550 -5.153
151 1HG2 ILE 24 1HG2 ILE 24 -0.163 2.383 -2.293
152 2HG2 ILE 24 2HG2 ILE 24 0.461 0.734 -2.319
153 3HG2 ILE 24 3HG2 ILE 24 -1.228 1.032 -1.905
154 1HD1 ILE 24 1HD1 ILE 24 0.689 0.811 -6.283
155 2HD1 ILE 24 2HD1 ILE 24 1.235 -0.826 -5.920
156 3HD1 ILE 24 3HD1 ILE 24 1.776 0.525 -4.924
157 H ALA 25 HN ALA 25 -1.993 3.571 -5.238
158 HA ALA 25 HA ALA 25 -2.567 5.732 -4.819
159 1HB ALA 25 HB1 ALA 25 -4.843 4.222 -3.628
160 2HB ALA 25 HB2 ALA 25 -4.818 5.323 -5.006
161 3HB ALA 25 HB3 ALA 25 -4.733 5.962 -3.364
162 H GLY 26 HN GLY 26 -0.744 4.288 -2.994
163 1HA GLY 26 HA2 GLY 26 0.140 6.103 -1.290
164 2HA GLY 26 HA1 GLY 26 -1.275 5.546 -0.411
165 H ALA 27 HN ALA 27 1.785 4.486 -1.831
166 HA ALA 27 HA ALA 27 1.765 1.932 -0.561
167 1HB ALA 27 HB1 ALA 27 3.345 3.253 -2.487
168 2HB ALA 27 HB2 ALA 27 3.362 1.555 -2.017
169 3HB ALA 27 HB3 ALA 27 4.416 2.705 -1.197
170 H THR 28 HN THR 28 2.194 4.993 0.689
171 HB THR 28 HB THR 28 4.830 6.000 1.693
172 HG1 THR 28 HG1 THR 28 5.330 3.984 0.964
173 1HG2 THR 28 1HG2 THR 28 6.072 4.872 4.032
174 2HG2 THR 28 2HG2 THR 28 4.595 5.741 4.450
175 3HG2 THR 28 3HG2 THR 28 5.878 6.561 3.560
176 H GLY 29 HN GLY 29 1.424 3.043 2.644
177 1HA GLY 29 HA2 GLY 29 1.229 2.308 5.243
178 2HA GLY 29 HA1 GLY 29 1.020 1.168 3.926
179 H LEU 30 HN LEU 30 3.845 1.411 3.091
180 HA LEU 30 HA LEU 30 4.899 -0.721 4.570
181 1HB LEU 30 HB2 LEU 30 6.478 1.277 2.952
182 2HB LEU 30 HB1 LEU 30 6.958 -0.357 3.366
183 HG LEU 30 HG LEU 30 4.830 0.501 1.417
184 1HD1 LEU 30 1HD1 LEU 30 7.515 -0.748 1.262
185 2HD1 LEU 30 2HD1 LEU 30 6.756 0.445 0.209
186 3HD1 LEU 30 3HD1 LEU 30 6.295 -1.253 0.093
187 1HD2 LEU 30 1HD2 LEU 30 4.076 -1.403 2.892
188 2HD2 LEU 30 2HD2 LEU 30 5.410 -2.340 2.220
189 3HD2 LEU 30 3HD2 LEU 30 4.129 -1.746 1.163
190 H PHE 31 HN PHE 31 5.216 2.751 4.961
191 1HB PHE 31 HB2 PHE 31 8.300 3.344 7.544
192 2HB PHE 31 HB1 PHE 31 8.065 1.724 6.900
193 HD1 PHE 31 HD1 PHE 31 9.154 5.083 6.201
194 HD2 PHE 31 HD2 PHE 31 8.045 1.376 4.430
195 HE1 PHE 31 HE1 PHE 31 10.244 5.764 4.103
196 HE2 PHE 31 HE2 PHE 31 9.134 2.049 2.329
197 HZ PHE 31 HZ PHE 31 10.236 4.246 2.164
198 H GLY 32 HN GLY 32 4.078 1.898 7.180
199 1HA GLY 32 HA2 GLY 32 4.283 2.058 10.090
200 2HA GLY 32 HA1 GLY 32 2.841 1.653 9.171
201 H LEU 33 HN LEU 33 4.411 -0.297 7.534
202 HA LEU 33 HA LEU 33 3.855 -2.605 9.055
203 1HB LEU 33 HB2 LEU 33 5.248 -2.074 6.465
204 2HB LEU 33 HB1 LEU 33 5.351 -3.671 7.182
205 HG LEU 33 HG LEU 33 2.809 -2.249 6.387
206 1HD1 LEU 33 1HD1 LEU 33 3.583 -4.829 5.194
207 2HD1 LEU 33 2HD1 LEU 33 4.553 -3.435 4.719
208 3HD1 LEU 33 3HD1 LEU 33 2.808 -3.423 4.464
209 1HD2 LEU 33 1HD2 LEU 33 2.064 -4.784 6.798
210 2HD2 LEU 33 2HD2 LEU 33 1.988 -3.546 8.051
211 3HD2 LEU 33 3HD2 LEU 33 3.348 -4.667 8.000
212 H TRP 34 HN TRP 34 6.574 -0.534 9.005
213 HA TRP 34 HA TRP 34 8.254 -2.584 10.278
214 1HB TRP 34 HB2 TRP 34 9.259 -1.519 8.311
215 2HB TRP 34 HB1 TRP 34 9.036 0.066 9.043
216 HD1 TRP 34 HD1 TRP 34 10.974 0.949 10.496
217 HE1 TRP 34 HE1 TRP 34 13.169 -0.042 11.402
218 HE3 TRP 34 HE3 TRP 34 10.259 -3.942 9.188
219 HZ2 TRP 34 HZ2 TRP 34 14.431 -2.563 11.545
220 HZ3 TRP 34 HZ3 TRP 34 12.009 -5.579 9.745
221 HH2 TRP 34 HH2 TRP 34 14.051 -4.902 10.899
222 H GLY 35 HN GLY 35 6.703 0.501 10.733
223 1HA GLY 35 HA2 GLY 35 7.353 0.355 13.582
224 2HA GLY 35 HA1 GLY 35 7.812 1.818 12.724
Start of MODEL 2
1 3H ASN 1 HT3 ASN 1 7.949 3.601 14.186
2 HA ASN 1 HA ASN 1 8.326 3.718 11.332
3 1HB ASN 1 HB2 ASN 1 5.996 4.190 10.768
4 2HB ASN 1 HB1 ASN 1 6.141 2.588 11.484
5 1HD2 ASN 1 1HD2 ASN 1 3.823 4.325 11.296
6 2HD2 ASN 1 2HD2 ASN 1 3.284 4.589 12.915
7 H LYS 2 HN LYS 2 8.843 5.733 10.756
8 HA LYS 2 HA LYS 2 8.745 7.816 12.756
9 1HB LYS 2 HB2 LYS 2 9.742 9.087 10.581
10 2HB LYS 2 HB1 LYS 2 10.717 8.174 11.721
11 1HG LYS 2 HG2 LYS 2 10.725 6.262 10.275
12 2HG LYS 2 HG1 LYS 2 9.579 7.032 9.177
13 1HD LYS 2 HD2 LYS 2 12.375 7.999 9.778
14 2HD LYS 2 HD1 LYS 2 11.869 7.151 8.315
15 1HE LYS 2 HE2 LYS 2 10.101 9.127 8.238
16 2HE LYS 2 HE1 LYS 2 11.349 9.947 9.174
17 1HZ LYS 2 HZ1 LYS 2 11.659 10.362 6.838
18 2HZ LYS 2 HZ2 LYS 2 11.693 8.706 6.499
19 3HZ LYS 2 HZ3 LYS 2 12.937 9.409 7.404
20 H GLY 3 HN GLY 3 8.097 8.259 9.296
21 1HA GLY 3 HA2 GLY 3 5.602 9.646 10.064
22 2HA GLY 3 HA1 GLY 3 6.653 10.200 8.770
23 H CYS 4 HN CYS 4 5.816 6.839 9.365
24 HA CYS 4 HA CYS 4 4.951 6.503 6.662
25 1HB CYS 4 HB2 CYS 4 5.125 4.704 9.058
26 2HB CYS 4 HB1 CYS 4 4.292 4.169 7.603
27 H ALA 5 HN ALA 5 3.381 7.743 9.325
28 HA ALA 5 HA ALA 5 0.799 6.562 8.931
29 1HB ALA 5 HB1 ALA 5 0.973 9.140 10.343
30 2HB ALA 5 HB2 ALA 5 1.936 7.824 11.014
31 3HB ALA 5 HB3 ALA 5 0.194 7.631 10.817
32 H THR 6 HN THR 6 2.481 8.722 7.070
33 HA THR 6 HA THR 6 0.363 10.562 6.464
34 HB THR 6 HB THR 6 1.937 11.072 4.462
35 HG1 THR 6 HG1 THR 6 3.653 9.900 4.322
36 1HG2 THR 6 1HG2 THR 6 2.739 12.725 5.694
37 2HG2 THR 6 2HG2 THR 6 3.613 11.611 6.746
38 3HG2 THR 6 3HG2 THR 6 1.922 11.989 7.072
39 H CYS 7 HN CYS 7 0.761 7.368 5.742
40 HA CYS 7 HA CYS 7 -1.235 7.479 3.659
41 1HB CYS 7 HB2 CYS 7 0.383 5.750 2.375
42 2HB CYS 7 HB1 CYS 7 0.342 7.471 2.018
43 H SER 8 HN SER 8 -2.053 6.553 5.803
44 HA SER 8 HA SER 8 -1.349 4.095 6.829
45 1HB SER 8 HB2 SER 8 -3.937 5.584 6.660
46 2HB SER 8 HB1 SER 8 -3.960 3.917 7.234
47 HG SER 8 HG SER 8 -2.234 5.896 8.297
48 H ILE 9 HN ILE 9 -2.951 4.822 3.841
49 HA ILE 9 HA ILE 9 -4.137 2.345 3.290
50 HB ILE 9 HB ILE 9 -3.332 4.720 1.728
51 1HG1 ILE 9 2HG1 ILE 9 -5.593 4.432 2.597
52 2HG1 ILE 9 1HG1 ILE 9 -5.611 4.458 0.836
53 1HG2 ILE 9 1HG2 ILE 9 -3.947 3.426 -0.423
54 2HG2 ILE 9 2HG2 ILE 9 -3.430 2.004 0.482
55 3HG2 ILE 9 3HG2 ILE 9 -2.300 3.328 0.200
56 1HD1 ILE 9 1HD1 ILE 9 -5.508 1.865 1.087
57 2HD1 ILE 9 2HD1 ILE 9 -7.035 2.725 1.289
58 3HD1 ILE 9 3HD1 ILE 9 -6.124 2.200 2.705
59 H GLY 10 HN GLY 10 -2.977 0.526 3.613
60 1HA GLY 10 HA2 GLY 10 -0.199 0.282 3.084
61 2HA GLY 10 HA1 GLY 10 -1.305 -1.040 3.422
62 H ALA 11 HN ALA 11 0.769 -1.307 1.615
63 HA ALA 11 HA ALA 11 0.078 -0.792 -1.063
64 1HB ALA 11 HB1 ALA 11 2.298 -1.707 0.146
65 2HB ALA 11 HB2 ALA 11 2.004 -1.850 -1.587
66 3HB ALA 11 HB3 ALA 11 1.671 -3.214 -0.520
67 H ALA 12 HN ALA 12 -1.702 -1.503 -2.033
68 HA ALA 12 HA ALA 12 -2.255 -4.324 -2.163
69 1HB ALA 12 HB1 ALA 12 -3.466 -2.997 -0.099
70 2HB ALA 12 HB2 ALA 12 -4.051 -4.488 -0.838
71 3HB ALA 12 HB3 ALA 12 -4.694 -2.931 -1.363
72 H CYS 13 HN CYS 13 -1.892 -3.981 -4.377
73 HA CYS 13 HA CYS 13 -3.242 -2.036 -5.920
74 1HB CYS 13 HB2 CYS 13 -1.570 -4.406 -6.464
75 2HB CYS 13 HB1 CYS 13 -2.721 -3.993 -7.729
76 H LEU 14 HN LEU 14 -4.199 -5.124 -4.701
77 HA LEU 14 HA LEU 14 -6.167 -6.257 -4.807
78 1HB LEU 14 HB2 LEU 14 -6.899 -3.533 -5.546
79 2HB LEU 14 HB1 LEU 14 -7.945 -4.730 -6.286
80 HG LEU 14 HG LEU 14 -7.411 -4.464 -3.326
81 1HD1 LEU 14 1HD1 LEU 14 -9.648 -3.558 -5.099
82 2HD1 LEU 14 2HD1 LEU 14 -8.769 -2.656 -3.863
83 3HD1 LEU 14 3HD1 LEU 14 -9.919 -3.907 -3.391
84 1HD2 LEU 14 1HD2 LEU 14 -8.540 -6.372 -2.974
85 2HD2 LEU 14 2HD2 LEU 14 -8.097 -6.740 -4.642
86 3HD2 LEU 14 3HD2 LEU 14 -9.682 -6.056 -4.280
87 H VAL 15 HN VAL 15 -4.231 -5.590 -7.340
88 HA VAL 15 HA VAL 15 -5.717 -6.433 -9.591
89 HB VAL 15 HB VAL 15 -3.604 -5.211 -9.804
90 1HG1 VAL 15 1HG1 VAL 15 -2.368 -6.165 -7.963
91 2HG1 VAL 15 2HG1 VAL 15 -1.465 -6.394 -9.460
92 3HG1 VAL 15 3HG1 VAL 15 -2.353 -7.742 -8.751
93 1HG2 VAL 15 1HG2 VAL 15 -4.516 -6.873 -11.553
94 2HG2 VAL 15 2HG2 VAL 15 -3.159 -7.890 -11.067
95 3HG2 VAL 15 3HG2 VAL 15 -2.863 -6.283 -11.730
96 H ASP 16 HN ASP 16 -4.804 -8.111 -6.871
97 HA ASP 16 HA ASP 16 -4.503 -10.671 -8.241
98 1HB ASP 16 HB2 ASP 16 -3.174 -9.614 -6.108
99 2HB ASP 16 HB1 ASP 16 -4.412 -10.568 -5.291
100 H GLY 17 HN GLY 17 -7.014 -9.174 -8.131
101 1HA GLY 17 HA2 GLY 17 -8.754 -11.323 -7.398
102 2HA GLY 17 HA1 GLY 17 -8.882 -9.961 -6.291
103 HA PRO 18 HA PRO 18 -11.919 -8.097 -8.907
104 1HB PRO 18 HB2 PRO 18 -11.054 -5.446 -8.680
105 2HB PRO 18 HB1 PRO 18 -12.195 -6.260 -7.609
106 1HG PRO 18 HG2 PRO 18 -9.288 -5.750 -7.242
107 2HG PRO 18 HG1 PRO 18 -10.585 -5.784 -6.039
108 1HD PRO 18 HD2 PRO 18 -8.828 -7.803 -6.296
109 2HD PRO 18 HD1 PRO 18 -10.525 -8.087 -5.855
110 H ILE 19 HN ILE 19 -8.531 -7.283 -9.316
111 HA ILE 19 HA ILE 19 -7.253 -7.327 -11.207
112 HB ILE 19 HB ILE 19 -9.773 -7.300 -12.809
113 1HG1 ILE 19 2HG1 ILE 19 -9.819 -9.290 -11.475
114 2HG1 ILE 19 1HG1 ILE 19 -9.315 -9.756 -13.096
115 1HG2 ILE 19 1HG2 ILE 19 -7.947 -8.533 -14.352
116 2HG2 ILE 19 2HG2 ILE 19 -6.910 -7.413 -13.468
117 3HG2 ILE 19 3HG2 ILE 19 -8.267 -6.800 -14.412
118 1HD1 ILE 19 1HD1 ILE 19 -7.423 -9.282 -10.808
119 2HD1 ILE 19 2HD1 ILE 19 -7.036 -9.942 -12.397
120 3HD1 ILE 19 3HD1 ILE 19 -8.047 -10.861 -11.283
121 HA PRO 20 HA PRO 20 -8.692 -2.788 -11.705
122 1HB PRO 20 HB2 PRO 20 -7.625 -1.582 -9.545
123 2HB PRO 20 HB1 PRO 20 -9.247 -2.287 -9.519
124 1HG PRO 20 HG2 PRO 20 -6.670 -3.438 -8.523
125 2HG PRO 20 HG1 PRO 20 -8.260 -3.420 -7.737
126 1HD PRO 20 HD2 PRO 20 -7.302 -5.585 -9.060
127 2HD PRO 20 HD1 PRO 20 -9.031 -5.198 -8.983
128 H ASP 21 HN ASP 21 -5.789 -4.393 -10.719
129 HA ASP 21 HA ASP 21 -3.679 -4.319 -11.591
130 1HB ASP 21 HB2 ASP 21 -4.905 -3.477 -13.695
131 2HB ASP 21 HB1 ASP 21 -4.380 -1.873 -13.194
132 H PHE 22 HN PHE 22 -2.331 -3.796 -10.023
133 1HB PHE 22 HB2 PHE 22 -0.706 -0.751 -10.563
134 2HB PHE 22 HB1 PHE 22 0.266 -1.110 -9.141
135 HD1 PHE 22 HD1 PHE 22 0.754 -3.747 -8.871
136 HD2 PHE 22 HD2 PHE 22 -0.084 -1.730 -12.525
137 HE1 PHE 22 HE1 PHE 22 1.892 -5.537 -10.116
138 HE2 PHE 22 HE2 PHE 22 1.052 -3.518 -13.776
139 HZ PHE 22 HZ PHE 22 2.041 -5.425 -12.571
140 H GLU 23 HN GLU 23 -3.939 -1.940 -7.862
141 HA GLU 23 HA GLU 23 -4.243 0.925 -8.078
142 1HB GLU 23 HB2 GLU 23 -6.490 0.670 -7.522
143 2HB GLU 23 HB1 GLU 23 -6.129 -0.784 -8.434
144 1HG GLU 23 HG2 GLU 23 -6.983 -1.951 -6.764
145 2HG GLU 23 HG1 GLU 23 -5.609 -1.452 -5.779
146 H ILE 24 HN ILE 24 -2.100 0.582 -6.599
147 HA ILE 24 HA ILE 24 -2.391 0.214 -3.845
148 HB ILE 24 HB ILE 24 -0.430 2.096 -5.157
149 1HG1 ILE 24 2HG1 ILE 24 -0.287 -0.041 -6.288
150 2HG1 ILE 24 1HG1 ILE 24 1.100 0.131 -5.217
151 1HG2 ILE 24 1HG2 ILE 24 0.995 1.464 -3.226
152 2HG2 ILE 24 2HG2 ILE 24 -0.377 0.581 -2.554
153 3HG2 ILE 24 3HG2 ILE 24 -0.473 2.328 -2.768
154 1HD1 ILE 24 1HD1 ILE 24 -1.379 -1.471 -4.636
155 2HD1 ILE 24 2HD1 ILE 24 0.027 -1.314 -3.581
156 3HD1 ILE 24 3HD1 ILE 24 0.182 -2.117 -5.144
157 H ALA 25 HN ALA 25 -1.937 3.363 -5.461
158 HA ALA 25 HA ALA 25 -2.722 5.447 -4.991
159 1HB ALA 25 HB1 ALA 25 -4.941 3.698 -4.054
160 2HB ALA 25 HB2 ALA 25 -4.920 4.909 -5.336
161 3HB ALA 25 HB3 ALA 25 -4.987 5.413 -3.647
162 H GLY 26 HN GLY 26 -0.724 4.524 -3.331
163 1HA GLY 26 HA2 GLY 26 -0.416 6.272 -1.358
164 2HA GLY 26 HA1 GLY 26 -1.507 5.130 -0.587
165 H ALA 27 HN ALA 27 1.714 5.669 -1.790
166 HA ALA 27 HA ALA 27 2.705 3.043 -1.333
167 1HB ALA 27 HB1 ALA 27 4.417 3.851 -2.447
168 2HB ALA 27 HB2 ALA 27 4.799 4.945 -1.118
169 3HB ALA 27 HB3 ALA 27 3.698 5.458 -2.396
170 H THR 28 HN THR 28 2.289 5.865 0.672
171 HB THR 28 HB THR 28 4.792 6.406 2.500
172 HG1 THR 28 HG1 THR 28 5.801 4.829 1.605
173 1HG2 THR 28 1HG2 THR 28 5.856 5.641 4.505
174 2HG2 THR 28 2HG2 THR 28 4.584 4.448 4.774
175 3HG2 THR 28 3HG2 THR 28 4.218 6.169 4.889
176 H GLY 29 HN GLY 29 2.521 5.023 5.091
177 1HA GLY 29 HA2 GLY 29 1.370 3.480 6.381
178 2HA GLY 29 HA1 GLY 29 0.890 2.657 4.904
179 H LEU 30 HN LEU 30 3.188 1.869 3.753
180 HA LEU 30 HA LEU 30 3.904 -0.446 5.026
181 1HB LEU 30 HB2 LEU 30 5.593 1.244 3.182
182 2HB LEU 30 HB1 LEU 30 5.961 -0.412 3.621
183 HG LEU 30 HG LEU 30 3.560 0.536 2.058
184 1HD1 LEU 30 1HD1 LEU 30 5.143 0.474 0.446
185 2HD1 LEU 30 2HD1 LEU 30 4.784 -1.252 0.489
186 3HD1 LEU 30 3HD1 LEU 30 6.185 -0.620 1.355
187 1HD2 LEU 30 1HD2 LEU 30 3.503 -2.127 1.801
188 2HD2 LEU 30 2HD2 LEU 30 2.610 -1.262 3.052
189 3HD2 LEU 30 3HD2 LEU 30 4.160 -2.011 3.433
190 H PHE 31 HN PHE 31 5.096 2.764 5.635
191 1HB PHE 31 HB2 PHE 31 8.631 2.872 7.276
192 2HB PHE 31 HB1 PHE 31 8.152 1.184 7.350
193 HD1 PHE 31 HD1 PHE 31 7.840 4.038 4.950
194 HD2 PHE 31 HD2 PHE 31 8.685 -0.092 5.538
195 HE1 PHE 31 HE1 PHE 31 8.300 3.794 2.548
196 HE2 PHE 31 HE2 PHE 31 9.149 -0.342 3.135
197 HZ PHE 31 HZ PHE 31 8.957 1.603 1.636
198 H GLY 32 HN GLY 32 4.233 1.645 7.923
199 1HA GLY 32 HA2 GLY 32 4.482 1.795 10.719
200 2HA GLY 32 HA1 GLY 32 3.287 0.848 9.850
201 H LEU 33 HN LEU 33 5.109 -0.887 8.490
202 HA LEU 33 HA LEU 33 5.616 -2.718 10.648
203 1HB LEU 33 HB2 LEU 33 6.356 -4.252 8.800
204 2HB LEU 33 HB1 LEU 33 4.690 -3.712 8.740
205 HG LEU 33 HG LEU 33 5.223 -2.128 6.980
206 1HD1 LEU 33 1HD1 LEU 33 8.038 -3.081 7.418
207 2HD1 LEU 33 2HD1 LEU 33 7.413 -1.438 7.548
208 3HD1 LEU 33 3HD1 LEU 33 7.523 -2.217 5.968
209 1HD2 LEU 33 1HD2 LEU 33 5.795 -5.004 6.730
210 2HD2 LEU 33 2HD2 LEU 33 6.353 -3.994 5.397
211 3HD2 LEU 33 3HD2 LEU 33 4.650 -3.992 5.851
212 H TRP 34 HN TRP 34 7.383 -0.208 9.566
213 HA TRP 34 HA TRP 34 9.943 -1.597 10.003
214 1HB TRP 34 HB2 TRP 34 9.430 -0.302 7.789
215 2HB TRP 34 HB1 TRP 34 9.755 1.128 8.763
216 HD1 TRP 34 HD1 TRP 34 11.569 -2.244 8.059
217 HE1 TRP 34 HE1 TRP 34 14.083 -1.746 7.826
218 HE3 TRP 34 HE3 TRP 34 11.485 2.793 8.934
219 HZ2 TRP 34 HZ2 TRP 34 15.803 0.487 7.991
220 HZ3 TRP 34 HZ3 TRP 34 13.608 4.036 8.879
221 HH2 TRP 34 HH2 TRP 34 15.722 2.904 8.418
222 H GLY 35 HN GLY 35 8.194 -0.731 12.117
223 1HA GLY 35 HA2 GLY 35 8.321 0.348 14.137
224 2HA GLY 35 HA1 GLY 35 10.041 0.514 13.815
Start of MODEL 3
1 3H ASN 1 HT3 ASN 1 11.302 2.607 10.382
2 HA ASN 1 HA ASN 1 12.286 5.107 9.842
3 1HB ASN 1 HB2 ASN 1 11.956 3.328 8.150
4 2HB ASN 1 HB1 ASN 1 10.221 3.630 8.194
5 1HD2 ASN 1 1HD2 ASN 1 12.938 4.222 6.504
6 2HD2 ASN 1 2HD2 ASN 1 12.493 5.697 5.721
7 H LYS 2 HN LYS 2 11.592 7.051 10.413
8 HA LYS 2 HA LYS 2 8.825 7.497 11.123
9 1HB LYS 2 HB2 LYS 2 10.777 9.745 10.939
10 2HB LYS 2 HB1 LYS 2 9.517 9.453 12.127
11 1HG LYS 2 HG2 LYS 2 12.218 8.142 11.953
12 2HG LYS 2 HG1 LYS 2 11.610 9.211 13.219
13 1HD LYS 2 HD2 LYS 2 9.743 7.318 13.368
14 2HD LYS 2 HD1 LYS 2 11.063 6.336 12.729
15 1HE LYS 2 HE2 LYS 2 12.176 7.912 14.772
16 2HE LYS 2 HE1 LYS 2 10.641 7.310 15.398
17 1HZ LYS 2 HZ1 LYS 2 12.322 5.377 14.019
18 2HZ LYS 2 HZ2 LYS 2 11.376 5.191 15.408
19 3HZ LYS 2 HZ3 LYS 2 12.895 5.928 15.513
20 H GLY 3 HN GLY 3 7.764 7.220 9.131
21 1HA GLY 3 HA2 GLY 3 7.099 9.461 7.712
22 2HA GLY 3 HA1 GLY 3 8.471 8.796 6.838
23 H CYS 4 HN CYS 4 5.303 7.878 8.158
24 HA CYS 4 HA CYS 4 4.604 6.576 5.677
25 1HB CYS 4 HB2 CYS 4 4.687 4.931 8.219
26 2HB CYS 4 HB1 CYS 4 4.138 4.383 6.642
27 H ALA 5 HN ALA 5 3.682 8.762 7.474
28 HA ALA 5 HA ALA 5 1.149 7.818 8.517
29 1HB ALA 5 HB1 ALA 5 2.349 9.476 9.795
30 2HB ALA 5 HB2 ALA 5 0.832 10.163 9.215
31 3HB ALA 5 HB3 ALA 5 2.351 10.580 8.421
32 H THR 6 HN THR 6 2.296 9.899 5.887
33 HA THR 6 HA THR 6 -0.351 10.510 4.963
34 HB THR 6 HB THR 6 1.034 11.362 2.925
35 HG1 THR 6 HG1 THR 6 3.049 10.840 3.069
36 1HG2 THR 6 1HG2 THR 6 0.860 12.482 5.647
37 2HG2 THR 6 2HG2 THR 6 0.323 13.145 4.103
38 3HG2 THR 6 3HG2 THR 6 2.027 13.223 4.551
39 H CYS 7 HN CYS 7 -0.082 7.719 5.078
40 HA CYS 7 HA CYS 7 -1.139 6.904 2.668
41 1HB CYS 7 HB2 CYS 7 0.710 5.563 1.690
42 2HB CYS 7 HB1 CYS 7 1.000 7.293 1.609
43 H SER 8 HN SER 8 -1.565 6.470 5.402
44 HA SER 8 HA SER 8 -0.649 4.116 6.505
45 1HB SER 8 HB2 SER 8 -2.089 5.618 7.755
46 2HB SER 8 HB1 SER 8 -3.429 5.307 6.652
47 HG SER 8 HG SER 8 -3.819 3.949 8.287
48 H ILE 9 HN ILE 9 -2.791 4.566 3.831
49 HA ILE 9 HA ILE 9 -4.195 2.197 3.721
50 HB ILE 9 HB ILE 9 -3.126 4.026 1.599
51 1HG1 ILE 9 2HG1 ILE 9 -5.061 4.751 2.899
52 2HG1 ILE 9 1HG1 ILE 9 -5.523 4.446 1.227
53 1HG2 ILE 9 1HG2 ILE 9 -4.805 2.545 0.139
54 2HG2 ILE 9 2HG2 ILE 9 -4.166 1.291 1.202
55 3HG2 ILE 9 3HG2 ILE 9 -3.067 2.248 0.208
56 1HD1 ILE 9 1HD1 ILE 9 -6.105 2.786 3.654
57 2HD1 ILE 9 2HD1 ILE 9 -6.278 2.157 2.014
58 3HD1 ILE 9 3HD1 ILE 9 -7.239 3.542 2.535
59 H GLY 10 HN GLY 10 -3.277 0.278 4.138
60 1HA GLY 10 HA2 GLY 10 -0.688 -0.548 3.754
61 2HA GLY 10 HA1 GLY 10 -2.065 -1.637 3.746
62 H ALA 11 HN ALA 11 -0.052 -2.443 2.263
63 HA ALA 11 HA ALA 11 -0.075 -1.433 -0.413
64 1HB ALA 11 HB1 ALA 11 1.837 -2.642 0.763
65 2HB ALA 11 HB2 ALA 11 1.507 -3.092 -0.910
66 3HB ALA 11 HB3 ALA 11 0.959 -4.130 0.408
67 H ALA 12 HN ALA 12 -1.715 -1.700 -1.759
68 HA ALA 12 HA ALA 12 -2.776 -4.320 -2.290
69 1HB ALA 12 HB1 ALA 12 -4.384 -4.128 -0.710
70 2HB ALA 12 HB2 ALA 12 -5.186 -3.186 -1.968
71 3HB ALA 12 HB3 ALA 12 -4.300 -2.366 -0.682
72 H CYS 13 HN CYS 13 -1.770 -3.679 -4.311
73 HA CYS 13 HA CYS 13 -2.751 -1.446 -5.795
74 1HB CYS 13 HB2 CYS 13 -0.865 -3.673 -6.273
75 2HB CYS 13 HB1 CYS 13 -1.671 -3.036 -7.702
76 H LEU 14 HN LEU 14 -3.745 -4.744 -5.419
77 HA LEU 14 HA LEU 14 -5.541 -5.889 -6.222
78 1HB LEU 14 HB2 LEU 14 -6.280 -3.097 -6.647
79 2HB LEU 14 HB1 LEU 14 -7.013 -4.174 -7.818
80 HG LEU 14 HG LEU 14 -7.266 -5.237 -5.143
81 1HD1 LEU 14 1HD1 LEU 14 -7.202 -2.639 -4.845
82 2HD1 LEU 14 2HD1 LEU 14 -8.426 -3.607 -4.023
83 3HD1 LEU 14 3HD1 LEU 14 -8.838 -2.732 -5.498
84 1HD2 LEU 14 1HD2 LEU 14 -9.749 -4.949 -5.896
85 2HD2 LEU 14 2HD2 LEU 14 -8.713 -6.136 -6.688
86 3HD2 LEU 14 3HD2 LEU 14 -9.024 -4.581 -7.461
87 H VAL 15 HN VAL 15 -3.082 -4.700 -7.978
88 HA VAL 15 HA VAL 15 -3.853 -5.121 -10.663
89 HB VAL 15 HB VAL 15 -1.860 -3.833 -10.074
90 1HG1 VAL 15 1HG1 VAL 15 -1.086 -5.062 -8.154
91 2HG1 VAL 15 2HG1 VAL 15 0.197 -5.018 -9.364
92 3HG1 VAL 15 3HG1 VAL 15 -0.761 -6.483 -9.147
93 1HG2 VAL 15 1HG2 VAL 15 -0.558 -4.496 -11.879
94 2HG2 VAL 15 2HG2 VAL 15 -2.136 -5.185 -12.263
95 3HG2 VAL 15 3HG2 VAL 15 -0.865 -6.210 -11.597
96 H ASP 16 HN ASP 16 -3.667 -7.280 -8.176
97 HA ASP 16 HA ASP 16 -2.739 -9.512 -9.807
98 1HB ASP 16 HB2 ASP 16 -2.222 -8.883 -7.225
99 2HB ASP 16 HB1 ASP 16 -3.618 -9.940 -7.009
100 H GLY 17 HN GLY 17 -5.308 -8.060 -10.165
101 1HA GLY 17 HA2 GLY 17 -7.012 -10.389 -10.384
102 2HA GLY 17 HA1 GLY 17 -7.605 -9.141 -9.296
103 HA PRO 18 HA PRO 18 -9.683 -7.305 -12.766
104 1HB PRO 18 HB2 PRO 18 -9.444 -4.651 -11.889
105 2HB PRO 18 HB1 PRO 18 -10.780 -5.750 -11.543
106 1HG PRO 18 HG2 PRO 18 -8.459 -5.002 -9.849
107 2HG PRO 18 HG1 PRO 18 -10.109 -5.433 -9.376
108 1HD PRO 18 HD2 PRO 18 -8.027 -7.123 -9.071
109 2HD PRO 18 HD1 PRO 18 -9.670 -7.694 -9.432
110 H ILE 19 HN ILE 19 -6.557 -6.252 -11.654
111 HA ILE 19 HA ILE 19 -4.663 -5.860 -12.855
112 HB ILE 19 HB ILE 19 -6.388 -5.620 -15.282
113 1HG1 ILE 19 2HG1 ILE 19 -4.795 -7.923 -15.414
114 2HG1 ILE 19 1HG1 ILE 19 -5.462 -7.906 -13.785
115 1HG2 ILE 19 1HG2 ILE 19 -4.525 -4.638 -16.086
116 2HG2 ILE 19 2HG2 ILE 19 -3.940 -6.298 -16.194
117 3HG2 ILE 19 3HG2 ILE 19 -3.506 -5.299 -14.807
118 1HD1 ILE 19 1HD1 ILE 19 -6.734 -9.066 -15.733
119 2HD1 ILE 19 2HD1 ILE 19 -7.267 -7.424 -16.095
120 3HD1 ILE 19 3HD1 ILE 19 -7.611 -8.136 -14.520
121 HA PRO 20 HA PRO 20 -6.335 -1.364 -12.923
122 1HB PRO 20 HB2 PRO 20 -5.976 -0.673 -10.325
123 2HB PRO 20 HB1 PRO 20 -7.497 -1.327 -10.941
124 1HG PRO 20 HG2 PRO 20 -5.287 -2.726 -9.485
125 2HG PRO 20 HG1 PRO 20 -7.040 -2.867 -9.260
126 1HD PRO 20 HD2 PRO 20 -5.609 -4.689 -10.652
127 2HD PRO 20 HD1 PRO 20 -7.283 -4.283 -11.063
128 H ASP 21 HN ASP 21 -3.664 -3.054 -11.511
129 HA ASP 21 HA ASP 21 -1.415 -2.702 -11.675
130 1HB ASP 21 HB2 ASP 21 -2.331 -1.290 -13.803
131 2HB ASP 21 HB1 ASP 21 -1.571 -0.005 -12.868
132 H PHE 22 HN PHE 22 -0.619 -2.414 -9.711
133 1HB PHE 22 HB2 PHE 22 1.134 0.555 -7.817
134 2HB PHE 22 HB1 PHE 22 1.671 -0.917 -8.622
135 HD1 PHE 22 HD1 PHE 22 1.498 -1.118 -11.071
136 HD2 PHE 22 HD2 PHE 22 0.574 2.506 -9.041
137 HE1 PHE 22 HE1 PHE 22 1.670 0.111 -13.195
138 HE2 PHE 22 HE2 PHE 22 0.743 3.742 -11.162
139 HZ PHE 22 HZ PHE 22 1.291 2.544 -13.243
140 H GLU 23 HN GLU 23 -2.924 -1.048 -7.770
141 HA GLU 23 HA GLU 23 -3.399 1.811 -7.604
142 1HB GLU 23 HB2 GLU 23 -5.648 1.417 -7.949
143 2HB GLU 23 HB1 GLU 23 -4.909 0.105 -8.852
144 1HG GLU 23 HG2 GLU 23 -6.225 -1.281 -7.743
145 2HG GLU 23 HG1 GLU 23 -5.282 -0.929 -6.298
146 H ILE 24 HN ILE 24 -1.806 0.857 -5.549
147 HA ILE 24 HA ILE 24 -3.133 0.132 -3.197
148 HB ILE 24 HB ILE 24 -0.658 1.853 -3.383
149 1HG1 ILE 24 2HG1 ILE 24 -0.228 -0.965 -2.827
150 2HG1 ILE 24 1HG1 ILE 24 -1.013 -0.727 -4.384
151 1HG2 ILE 24 1HG2 ILE 24 -0.166 0.638 -1.190
152 2HG2 ILE 24 2HG2 ILE 24 -1.878 0.214 -1.187
153 3HG2 ILE 24 3HG2 ILE 24 -1.389 1.908 -1.162
154 1HD1 ILE 24 1HD1 ILE 24 1.493 -0.810 -4.416
155 2HD1 ILE 24 2HD1 ILE 24 1.477 0.736 -3.565
156 3HD1 ILE 24 3HD1 ILE 24 0.769 0.609 -5.175
157 H ALA 25 HN ALA 25 -2.664 3.258 -4.711
158 HA ALA 25 HA ALA 25 -3.498 5.328 -4.270
159 1HB ALA 25 HB1 ALA 25 -5.549 3.871 -2.609
160 2HB ALA 25 HB2 ALA 25 -5.633 4.062 -4.360
161 3HB ALA 25 HB3 ALA 25 -5.698 5.480 -3.314
162 H GLY 26 HN GLY 26 -1.527 4.036 -2.430
163 1HA GLY 26 HA2 GLY 26 -1.070 6.080 -0.657
164 2HA GLY 26 HA1 GLY 26 -2.102 4.957 0.216
165 H ALA 27 HN ALA 27 0.790 4.852 -1.862
166 HA ALA 27 HA ALA 27 1.810 2.498 -0.623
167 1HB ALA 27 HB1 ALA 27 3.257 2.467 -2.291
168 2HB ALA 27 HB2 ALA 27 3.748 4.140 -2.038
169 3HB ALA 27 HB3 ALA 27 2.296 3.776 -2.970
170 H THR 28 HN THR 28 1.431 3.588 1.517
171 HB THR 28 HB THR 28 4.739 5.389 1.955
172 HG1 THR 28 HG1 THR 28 4.839 2.646 2.643
173 1HG2 THR 28 1HG2 THR 28 5.861 5.589 3.843
174 2HG2 THR 28 2HG2 THR 28 5.718 3.864 4.174
175 3HG2 THR 28 3HG2 THR 28 4.450 4.970 4.696
176 H GLY 29 HN GLY 29 1.960 2.157 2.707
177 1HA GLY 29 HA2 GLY 29 1.158 2.184 5.502
178 2HA GLY 29 HA1 GLY 29 0.805 0.926 4.327
179 H LEU 30 HN LEU 30 3.780 1.042 3.602
180 HA LEU 30 HA LEU 30 4.573 -1.113 5.287
181 1HB LEU 30 HB2 LEU 30 6.449 0.413 3.513
182 2HB LEU 30 HB1 LEU 30 6.470 -1.290 3.926
183 HG LEU 30 HG LEU 30 4.538 0.090 2.059
184 1HD1 LEU 30 1HD1 LEU 30 6.713 -1.949 1.624
185 2HD1 LEU 30 2HD1 LEU 30 6.684 -0.283 1.048
186 3HD1 LEU 30 3HD1 LEU 30 5.538 -1.459 0.405
187 1HD2 LEU 30 1HD2 LEU 30 4.552 -2.672 3.226
188 2HD2 LEU 30 2HD2 LEU 30 3.824 -2.343 1.654
189 3HD2 LEU 30 3HD2 LEU 30 3.216 -1.528 3.095
190 H PHE 31 HN PHE 31 5.167 2.327 5.245
191 1HB PHE 31 HB2 PHE 31 8.431 2.991 7.583
192 2HB PHE 31 HB1 PHE 31 8.017 1.313 7.260
193 HD1 PHE 31 HD1 PHE 31 8.123 0.407 5.025
194 HD2 PHE 31 HD2 PHE 31 9.082 4.482 5.787
195 HE1 PHE 31 HE1 PHE 31 9.160 0.575 2.800
196 HE2 PHE 31 HE2 PHE 31 10.120 4.659 3.563
197 HZ PHE 31 HZ PHE 31 10.160 2.703 2.067
198 H GLY 32 HN GLY 32 4.075 1.897 7.565
199 1HA GLY 32 HA2 GLY 32 4.082 2.705 10.298
200 2HA GLY 32 HA1 GLY 32 2.869 1.704 9.515
201 H LEU 33 HN LEU 33 4.045 -0.550 8.831
202 HA LEU 33 HA LEU 33 4.392 -1.913 11.268
203 1HB LEU 33 HB2 LEU 33 5.351 -3.740 9.622
204 2HB LEU 33 HB1 LEU 33 3.639 -3.370 9.699
205 HG LEU 33 HG LEU 33 5.191 -1.805 7.731
206 1HD1 LEU 33 1HD1 LEU 33 5.813 -3.458 6.340
207 2HD1 LEU 33 2HD1 LEU 33 4.435 -4.475 6.760
208 3HD1 LEU 33 3HD1 LEU 33 5.846 -4.423 7.815
209 1HD2 LEU 33 1HD2 LEU 33 3.211 -1.913 6.497
210 2HD2 LEU 33 2HD2 LEU 33 2.670 -1.809 8.174
211 3HD2 LEU 33 3HD2 LEU 33 2.659 -3.363 7.338
212 H TRP 34 HN TRP 34 6.658 -0.459 9.057
213 HA TRP 34 HA TRP 34 8.847 -1.274 10.852
214 1HB TRP 34 HB2 TRP 34 8.580 -1.645 7.984
215 2HB TRP 34 HB1 TRP 34 10.023 -0.718 8.377
216 HD1 TRP 34 HD1 TRP 34 11.726 -1.952 10.222
217 HE1 TRP 34 HE1 TRP 34 12.307 -4.450 10.438
218 HE3 TRP 34 HE3 TRP 34 7.761 -3.930 7.674
219 HZ2 TRP 34 HZ2 TRP 34 11.228 -6.930 9.633
220 HZ3 TRP 34 HZ3 TRP 34 7.609 -6.375 7.442
221 HH2 TRP 34 HH2 TRP 34 9.307 -7.842 8.401
222 H GLY 35 HN GLY 35 8.242 0.763 11.934
223 1HA GLY 35 HA2 GLY 35 8.594 3.263 10.602
224 2HA GLY 35 HA1 GLY 35 8.475 3.018 12.337
Start of MODEL 4
1 3H ASN 1 HT3 ASN 1 10.859 3.036 9.211
2 HA ASN 1 HA ASN 1 8.553 3.100 9.178
3 1HB ASN 1 HB2 ASN 1 7.202 1.811 10.690
4 2HB ASN 1 HB1 ASN 1 8.524 0.798 10.135
5 1HD2 ASN 1 1HD2 ASN 1 10.293 2.460 12.073
6 2HD2 ASN 1 2HD2 ASN 1 9.999 1.706 13.594
7 H LYS 2 HN LYS 2 9.262 5.337 9.556
8 HA LYS 2 HA LYS 2 9.049 6.367 12.249
9 1HB LYS 2 HB2 LYS 2 9.168 8.009 9.727
10 2HB LYS 2 HB1 LYS 2 9.671 8.468 11.346
11 1HG LYS 2 HG2 LYS 2 11.723 7.699 11.014
12 2HG LYS 2 HG1 LYS 2 11.120 6.146 10.432
13 1HD LYS 2 HD2 LYS 2 11.158 8.621 8.719
14 2HD LYS 2 HD1 LYS 2 12.518 7.500 8.803
15 1HE LYS 2 HE2 LYS 2 11.351 6.720 6.966
16 2HE LYS 2 HE1 LYS 2 10.737 5.694 8.262
17 1HZ LYS 2 HZ1 LYS 2 9.115 6.862 6.612
18 2HZ LYS 2 HZ2 LYS 2 9.322 8.188 7.639
19 3HZ LYS 2 HZ3 LYS 2 8.716 6.733 8.250
20 H GLY 3 HN GLY 3 6.727 5.169 11.904
21 1HA GLY 3 HA2 GLY 3 4.534 5.837 12.460
22 2HA GLY 3 HA1 GLY 3 4.853 7.405 11.732
23 H CYS 4 HN CYS 4 5.652 6.840 9.229
24 HA CYS 4 HA CYS 4 4.670 6.621 7.170
25 1HB CYS 4 HB2 CYS 4 4.863 3.935 8.409
26 2HB CYS 4 HB1 CYS 4 3.885 4.051 6.949
27 H ALA 5 HN ALA 5 2.856 7.561 9.222
28 HA ALA 5 HA ALA 5 0.311 6.277 8.700
29 1HB ALA 5 HB1 ALA 5 0.785 7.094 10.939
30 2HB ALA 5 HB2 ALA 5 -0.603 7.937 10.249
31 3HB ALA 5 HB3 ALA 5 0.968 8.734 10.317
32 H THR 6 HN THR 6 2.161 8.486 7.042
33 HA THR 6 HA THR 6 0.145 10.337 6.237
34 HB THR 6 HB THR 6 1.757 11.204 4.716
35 HG1 THR 6 HG1 THR 6 3.156 8.757 5.036
36 1HG2 THR 6 1HG2 THR 6 3.340 11.877 6.147
37 2HG2 THR 6 2HG2 THR 6 3.773 10.231 6.609
38 3HG2 THR 6 3HG2 THR 6 2.368 11.011 7.335
39 H CYS 7 HN CYS 7 0.511 7.118 5.553
40 HA CYS 7 HA CYS 7 -1.360 7.269 3.362
41 1HB CYS 7 HB2 CYS 7 0.460 5.441 2.320
42 2HB CYS 7 HB1 CYS 7 0.156 7.065 1.722
43 H SER 8 HN SER 8 -2.319 6.373 5.456
44 HA SER 8 HA SER 8 -1.736 3.902 6.527
45 1HB SER 8 HB2 SER 8 -4.312 5.400 6.163
46 2HB SER 8 HB1 SER 8 -4.335 3.768 6.833
47 HG SER 8 HG SER 8 -2.657 5.801 7.858
48 H ILE 9 HN ILE 9 -3.099 4.663 3.442
49 HA ILE 9 HA ILE 9 -4.383 2.300 2.752
50 HB ILE 9 HB ILE 9 -3.096 4.527 1.285
51 1HG1 ILE 9 2HG1 ILE 9 -5.256 4.616 0.176
52 2HG1 ILE 9 1HG1 ILE 9 -5.715 3.073 0.888
53 1HG2 ILE 9 1HG2 ILE 9 -3.644 3.253 -0.903
54 2HG2 ILE 9 2HG2 ILE 9 -3.398 1.811 0.081
55 3HG2 ILE 9 3HG2 ILE 9 -2.097 2.988 -0.104
56 1HD1 ILE 9 1HD1 ILE 9 -6.434 5.444 1.891
57 2HD1 ILE 9 2HD1 ILE 9 -4.931 5.189 2.779
58 3HD1 ILE 9 3HD1 ILE 9 -6.226 3.995 2.875
59 H GLY 10 HN GLY 10 -1.073 3.189 1.749
60 1HA GLY 10 HA2 GLY 10 0.747 1.891 1.228
61 2HA GLY 10 HA1 GLY 10 0.300 0.996 2.670
62 H ALA 11 HN ALA 11 0.757 -1.031 2.016
63 HA ALA 11 HA ALA 11 0.445 -2.174 -0.464
64 1HB ALA 11 HB1 ALA 11 -0.087 -3.763 2.017
65 2HB ALA 11 HB2 ALA 11 1.517 -3.108 1.687
66 3HB ALA 11 HB3 ALA 11 0.774 -4.237 0.553
67 H ALA 12 HN ALA 12 -1.343 -2.043 -1.665
68 HA ALA 12 HA ALA 12 -3.678 -3.491 -0.918
69 1HB ALA 12 HB1 ALA 12 -4.604 -1.791 0.247
70 2HB ALA 12 HB2 ALA 12 -5.061 -1.236 -1.364
71 3HB ALA 12 HB3 ALA 12 -3.636 -0.563 -0.569
72 H CYS 13 HN CYS 13 -1.703 -3.266 -3.116
73 HA CYS 13 HA CYS 13 -3.143 -2.203 -5.367
74 1HB CYS 13 HB2 CYS 13 -0.772 -2.075 -5.527
75 2HB CYS 13 HB1 CYS 13 -0.579 -3.777 -5.111
76 H LEU 14 HN LEU 14 -2.727 -5.278 -3.821
77 HA LEU 14 HA LEU 14 -3.794 -7.258 -4.054
78 1HB LEU 14 HB2 LEU 14 -5.548 -5.435 -5.563
79 2HB LEU 14 HB1 LEU 14 -5.686 -7.129 -5.993
80 HG LEU 14 HG LEU 14 -6.117 -5.920 -3.262
81 1HD1 LEU 14 1HD1 LEU 14 -8.333 -6.079 -3.632
82 2HD1 LEU 14 2HD1 LEU 14 -8.177 -7.540 -4.606
83 3HD1 LEU 14 3HD1 LEU 14 -7.845 -5.964 -5.323
84 1HD2 LEU 14 1HD2 LEU 14 -5.876 -8.764 -4.168
85 2HD2 LEU 14 2HD2 LEU 14 -6.899 -8.338 -2.796
86 3HD2 LEU 14 3HD2 LEU 14 -5.174 -7.979 -2.754
87 H VAL 15 HN VAL 15 -1.823 -5.932 -6.272
88 HA VAL 15 HA VAL 15 -2.125 -7.633 -8.522
89 HB VAL 15 HB VAL 15 -0.812 -5.593 -8.706
90 1HG1 VAL 15 1HG1 VAL 15 0.108 -5.619 -6.408
91 2HG1 VAL 15 2HG1 VAL 15 1.339 -5.326 -7.637
92 3HG1 VAL 15 3HG1 VAL 15 1.199 -6.918 -6.891
93 1HG2 VAL 15 1HG2 VAL 15 0.856 -6.409 -10.099
94 2HG2 VAL 15 2HG2 VAL 15 -0.301 -7.740 -10.047
95 3HG2 VAL 15 3HG2 VAL 15 1.167 -7.808 -9.070
96 H ASP 16 HN ASP 16 -1.278 -8.306 -5.382
97 HA ASP 16 HA ASP 16 0.494 -10.521 -6.060
98 1HB ASP 16 HB2 ASP 16 0.533 -8.679 -4.011
99 2HB ASP 16 HB1 ASP 16 -0.184 -10.093 -3.236
100 H GLY 17 HN GLY 17 -2.322 -10.535 -6.754
101 1HA GLY 17 HA2 GLY 17 -3.002 -13.139 -5.827
102 2HA GLY 17 HA1 GLY 17 -4.004 -11.917 -5.055
103 HA PRO 18 HA PRO 18 -6.723 -12.212 -8.542
104 1HB PRO 18 HB2 PRO 18 -7.905 -9.757 -8.426
105 2HB PRO 18 HB1 PRO 18 -8.304 -11.082 -7.327
106 1HG PRO 18 HG2 PRO 18 -6.507 -8.731 -6.888
107 2HG PRO 18 HG1 PRO 18 -7.686 -9.461 -5.783
108 1HD PRO 18 HD2 PRO 18 -5.033 -9.933 -5.585
109 2HD PRO 18 HD1 PRO 18 -6.249 -11.157 -5.169
110 H ILE 19 HN ILE 19 -4.793 -9.269 -8.228
111 HA ILE 19 HA ILE 19 -3.388 -8.288 -9.739
112 HB ILE 19 HB ILE 19 -4.656 -9.993 -11.840
113 1HG1 ILE 19 2HG1 ILE 19 -3.470 -11.286 -10.083
114 2HG1 ILE 19 1HG1 ILE 19 -2.711 -11.425 -11.665
115 1HG2 ILE 19 1HG2 ILE 19 -3.666 -8.525 -13.211
116 2HG2 ILE 19 2HG2 ILE 19 -2.169 -9.330 -12.741
117 3HG2 ILE 19 3HG2 ILE 19 -2.673 -7.854 -11.919
118 1HD1 ILE 19 1HD1 ILE 19 -0.889 -10.156 -11.042
119 2HD1 ILE 19 2HD1 ILE 19 -1.243 -11.067 -9.575
120 3HD1 ILE 19 3HD1 ILE 19 -1.749 -9.383 -9.712
121 HA PRO 20 HA PRO 20 -6.975 -5.704 -11.130
122 1HB PRO 20 HB2 PRO 20 -7.532 -4.244 -8.992
123 2HB PRO 20 HB1 PRO 20 -8.095 -5.916 -9.096
124 1HG PRO 20 HG2 PRO 20 -5.883 -4.762 -7.489
125 2HG PRO 20 HG1 PRO 20 -6.932 -6.143 -7.134
126 1HD PRO 20 HD2 PRO 20 -4.295 -6.200 -8.232
127 2HD PRO 20 HD1 PRO 20 -5.393 -7.569 -7.985
128 H ASP 21 HN ASP 21 -3.947 -5.421 -11.052
129 HA ASP 21 HA ASP 21 -2.395 -3.836 -11.560
130 1HB ASP 21 HB2 ASP 21 -4.377 -3.079 -13.050
131 2HB ASP 21 HB1 ASP 21 -4.602 -1.809 -11.852
132 H PHE 22 HN PHE 22 -1.124 -3.128 -9.992
133 1HB PHE 22 HB2 PHE 22 0.364 -1.004 -7.429
134 2HB PHE 22 HB1 PHE 22 0.708 -2.264 -8.610
135 HD1 PHE 22 HD1 PHE 22 0.619 1.194 -8.057
136 HD2 PHE 22 HD2 PHE 22 -0.103 -1.741 -11.051
137 HE1 PHE 22 HE1 PHE 22 0.906 2.907 -9.800
138 HE2 PHE 22 HE2 PHE 22 0.185 -0.036 -12.800
139 HZ PHE 22 HZ PHE 22 0.690 2.293 -12.175
140 H GLU 23 HN GLU 23 -3.625 -2.058 -7.125
141 HA GLU 23 HA GLU 23 -4.378 0.697 -7.619
142 1HB GLU 23 HB2 GLU 23 -6.579 0.039 -6.879
143 2HB GLU 23 HB1 GLU 23 -5.970 -1.188 -7.986
144 1HG GLU 23 HG2 GLU 23 -6.469 -2.701 -6.458
145 2HG GLU 23 HG1 GLU 23 -5.170 -2.046 -5.465
146 H ILE 24 HN ILE 24 -2.311 0.921 -6.048
147 HA ILE 24 HA ILE 24 -3.082 0.894 -3.246
148 HB ILE 24 HB ILE 24 -0.509 1.762 -4.568
149 1HG1 ILE 24 2HG1 ILE 24 -0.692 -0.615 -2.798
150 2HG1 ILE 24 1HG1 ILE 24 -1.404 -0.755 -4.402
151 1HG2 ILE 24 1HG2 ILE 24 0.030 2.727 -2.643
152 2HG2 ILE 24 2HG2 ILE 24 -0.077 1.150 -1.862
153 3HG2 ILE 24 3HG2 ILE 24 -1.487 2.209 -1.909
154 1HD1 ILE 24 1HD1 ILE 24 0.693 -0.269 -5.440
155 2HD1 ILE 24 2HD1 ILE 24 0.942 -1.544 -4.246
156 3HD1 ILE 24 3HD1 ILE 24 1.428 0.112 -3.882
157 H ALA 25 HN ALA 25 -1.458 3.397 -5.196
158 HA ALA 25 HA ALA 25 -1.749 5.653 -5.330
159 1HB ALA 25 HB1 ALA 25 -4.418 5.362 -3.981
160 2HB ALA 25 HB2 ALA 25 -4.177 4.935 -5.675
161 3HB ALA 25 HB3 ALA 25 -3.893 6.590 -5.134
162 H GLY 26 HN GLY 26 -0.344 4.555 -3.196
163 1HA GLY 26 HA2 GLY 26 0.342 6.502 -1.548
164 2HA GLY 26 HA1 GLY 26 -1.165 6.004 -0.796
165 H ALA 27 HN ALA 27 2.010 4.807 -1.825
166 HA ALA 27 HA ALA 27 1.830 2.372 -0.356
167 1HB ALA 27 HB1 ALA 27 3.588 3.508 -2.240
168 2HB ALA 27 HB2 ALA 27 3.536 1.854 -1.631
169 3HB ALA 27 HB3 ALA 27 4.541 3.057 -0.826
170 H THR 28 HN THR 28 2.139 5.484 0.743
171 HB THR 28 HB THR 28 4.604 6.693 1.850
172 HG1 THR 28 HG1 THR 28 5.219 4.073 2.719
173 1HG2 THR 28 1HG2 THR 28 4.260 6.453 4.628
174 2HG2 THR 28 2HG2 THR 28 5.432 7.440 3.755
175 3HG2 THR 28 3HG2 THR 28 5.856 5.803 4.253
176 H GLY 29 HN GLY 29 1.252 3.665 2.850
177 1HA GLY 29 HA2 GLY 29 1.355 3.028 5.561
178 2HA GLY 29 HA1 GLY 29 0.694 1.987 4.312
179 H LEU 30 HN LEU 30 3.271 1.804 2.904
180 HA LEU 30 HA LEU 30 4.248 -0.537 4.051
181 1HB LEU 30 HB2 LEU 30 5.528 1.399 2.133
182 2HB LEU 30 HB1 LEU 30 6.258 -0.132 2.574
183 HG LEU 30 HG LEU 30 3.673 0.293 1.082
184 1HD1 LEU 30 1HD1 LEU 30 6.187 0.276 0.115
185 2HD1 LEU 30 2HD1 LEU 30 4.782 -0.290 -0.787
186 3HD1 LEU 30 3HD1 LEU 30 5.814 -1.447 0.057
187 1HD2 LEU 30 1HD2 LEU 30 3.823 -2.289 0.943
188 2HD2 LEU 30 2HD2 LEU 30 3.135 -1.546 2.387
189 3HD2 LEU 30 3HD2 LEU 30 4.795 -2.144 2.407
190 H PHE 31 HN PHE 31 4.913 2.752 4.839
191 1HB PHE 31 HB2 PHE 31 8.496 3.389 6.353
192 2HB PHE 31 HB1 PHE 31 8.324 1.712 5.859
193 HD1 PHE 31 HD1 PHE 31 7.771 1.136 3.561
194 HD2 PHE 31 HD2 PHE 31 8.321 5.182 4.759
195 HE1 PHE 31 HE1 PHE 31 7.976 1.801 1.201
196 HE2 PHE 31 HE2 PHE 31 8.527 5.856 2.401
197 HZ PHE 31 HZ PHE 31 8.354 4.165 0.619
198 H GLY 32 HN GLY 32 4.388 1.858 7.474
199 1HA GLY 32 HA2 GLY 32 5.453 1.292 10.017
200 2HA GLY 32 HA1 GLY 32 3.920 0.702 9.399
201 H LEU 33 HN LEU 33 4.905 -0.802 7.214
202 HA LEU 33 HA LEU 33 5.948 -3.086 8.694
203 1HB LEU 33 HB2 LEU 33 4.899 -2.962 5.871
204 2HB LEU 33 HB1 LEU 33 5.259 -4.415 6.786
205 HG LEU 33 HG LEU 33 3.062 -2.429 7.367
206 1HD1 LEU 33 1HD1 LEU 33 2.738 -5.340 6.744
207 2HD1 LEU 33 2HD1 LEU 33 2.866 -4.143 5.455
208 3HD1 LEU 33 3HD1 LEU 33 1.556 -4.036 6.631
209 1HD2 LEU 33 1HD2 LEU 33 4.293 -4.558 8.999
210 2HD2 LEU 33 2HD2 LEU 33 2.530 -4.508 8.976
211 3HD2 LEU 33 3HD2 LEU 33 3.447 -3.092 9.492
212 H TRP 34 HN TRP 34 7.412 -0.624 7.159
213 HA TRP 34 HA TRP 34 9.614 -2.364 6.284
214 1HB TRP 34 HB2 TRP 34 8.248 -1.333 4.367
215 2HB TRP 34 HB1 TRP 34 8.968 0.200 4.848
216 HD1 TRP 34 HD1 TRP 34 10.804 0.731 3.145
217 HE1 TRP 34 HE1 TRP 34 12.747 -0.567 2.065
218 HE3 TRP 34 HE3 TRP 34 9.872 -3.905 5.093
219 HZ2 TRP 34 HZ2 TRP 34 13.752 -3.204 2.042
220 HZ3 TRP 34 HZ3 TRP 34 11.373 -5.759 4.492
221 HH2 TRP 34 HH2 TRP 34 13.273 -5.415 2.998
222 H GLY 35 HN GLY 35 9.273 -1.046 8.805
223 1HA GLY 35 HA2 GLY 35 10.512 0.184 10.294
224 2HA GLY 35 HA1 GLY 35 11.827 0.057 9.135
Start of MODEL 5
1 3H ASN 1 HT3 ASN 1 12.199 4.329 10.588
2 HA ASN 1 HA ASN 1 10.589 4.548 8.844
3 1HB ASN 1 HB2 ASN 1 8.224 4.057 9.272
4 2HB ASN 1 HB1 ASN 1 9.233 2.665 9.649
5 1HD2 ASN 1 1HD2 ASN 1 8.677 1.659 11.428
6 2HD2 ASN 1 2HD2 ASN 1 7.966 2.376 12.829
7 H LYS 2 HN LYS 2 9.791 6.523 8.325
8 HA LYS 2 HA LYS 2 9.866 8.557 10.377
9 1HB LYS 2 HB2 LYS 2 9.621 10.141 8.550
10 2HB LYS 2 HB1 LYS 2 10.866 8.961 8.164
11 1HG LYS 2 HG2 LYS 2 9.355 7.779 6.703
12 2HG LYS 2 HG1 LYS 2 8.031 8.855 7.156
13 1HD LYS 2 HD2 LYS 2 9.583 10.742 6.315
14 2HD LYS 2 HD1 LYS 2 10.463 9.444 5.506
15 1HE LYS 2 HE2 LYS 2 8.961 10.155 3.883
16 2HE LYS 2 HE1 LYS 2 8.158 8.753 4.586
17 1HZ LYS 2 HZ1 LYS 2 7.561 11.316 5.817
18 2HZ LYS 2 HZ2 LYS 2 6.536 10.016 5.472
19 3HZ LYS 2 HZ3 LYS 2 6.969 11.100 4.247
20 H GLY 3 HN GLY 3 7.771 6.760 10.839
21 1HA GLY 3 HA2 GLY 3 5.627 7.145 11.699
22 2HA GLY 3 HA1 GLY 3 5.525 8.606 10.730
23 H CYS 4 HN CYS 4 6.039 7.648 8.201
24 HA CYS 4 HA CYS 4 4.820 6.912 6.411
25 1HB CYS 4 HB2 CYS 4 5.302 4.555 8.160
26 2HB CYS 4 HB1 CYS 4 4.173 4.344 6.826
27 H ALA 5 HN ALA 5 3.276 8.139 8.630
28 HA ALA 5 HA ALA 5 0.752 6.716 8.642
29 1HB ALA 5 HB1 ALA 5 1.019 7.678 10.692
30 2HB ALA 5 HB2 ALA 5 0.109 8.956 9.887
31 3HB ALA 5 HB3 ALA 5 1.860 9.087 10.046
32 H THR 6 HN THR 6 2.259 8.807 6.525
33 HA THR 6 HA THR 6 -0.004 10.398 5.774
34 HB THR 6 HB THR 6 1.389 11.294 4.066
35 HG1 THR 6 HG1 THR 6 2.922 8.951 4.426
36 1HG2 THR 6 1HG2 THR 6 3.520 10.659 6.033
37 2HG2 THR 6 2HG2 THR 6 2.117 11.586 6.566
38 3HG2 THR 6 3HG2 THR 6 3.121 12.187 5.247
39 H CYS 7 HN CYS 7 0.525 7.183 5.392
40 HA CYS 7 HA CYS 7 -1.391 7.011 3.242
41 1HB CYS 7 HB2 CYS 7 0.413 5.188 2.272
42 2HB CYS 7 HB1 CYS 7 0.163 6.802 1.624
43 H SER 8 HN SER 8 -1.844 6.339 5.781
44 HA SER 8 HA SER 8 -1.204 3.830 6.728
45 1HB SER 8 HB2 SER 8 -2.601 5.646 7.854
46 2HB SER 8 HB1 SER 8 -3.974 4.999 6.956
47 HG SER 8 HG SER 8 -3.463 2.944 7.952
48 H ILE 9 HN ILE 9 -3.184 4.655 4.032
49 HA ILE 9 HA ILE 9 -4.974 2.633 3.749
50 HB ILE 9 HB ILE 9 -4.008 4.588 2.102
51 1HG1 ILE 9 2HG1 ILE 9 -6.183 2.750 2.186
52 2HG1 ILE 9 1HG1 ILE 9 -6.114 4.331 1.424
53 1HG2 ILE 9 1HG2 ILE 9 -2.206 3.015 1.359
54 2HG2 ILE 9 2HG2 ILE 9 -3.203 3.679 0.065
55 3HG2 ILE 9 3HG2 ILE 9 -3.465 2.026 0.622
56 1HD1 ILE 9 1HD1 ILE 9 -5.263 3.296 -0.625
57 2HD1 ILE 9 2HD1 ILE 9 -6.829 2.639 -0.150
58 3HD1 ILE 9 3HD1 ILE 9 -5.359 1.712 0.146
59 H GLY 10 HN GLY 10 -1.503 2.398 3.457
60 1HA GLY 10 HA2 GLY 10 -0.142 0.542 3.441
61 2HA GLY 10 HA1 GLY 10 -1.573 -0.441 3.707
62 H ALA 11 HN ALA 11 0.181 -1.596 2.161
63 HA ALA 11 HA ALA 11 -0.137 -0.913 -0.623
64 1HB ALA 11 HB1 ALA 11 1.322 -3.059 0.866
65 2HB ALA 11 HB2 ALA 11 1.960 -1.792 -0.180
66 3HB ALA 11 HB3 ALA 11 1.107 -3.166 -0.882
67 H ALA 12 HN ALA 12 -1.713 -1.575 -1.918
68 HA ALA 12 HA ALA 12 -2.900 -4.183 -1.668
69 1HB ALA 12 HB1 ALA 12 -4.319 -1.765 -0.704
70 2HB ALA 12 HB2 ALA 12 -4.420 -3.437 -0.151
71 3HB ALA 12 HB3 ALA 12 -5.253 -2.943 -1.625
72 H CYS 13 HN CYS 13 -1.538 -3.507 -3.770
73 HA CYS 13 HA CYS 13 -2.962 -2.064 -5.765
74 1HB CYS 13 HB2 CYS 13 -0.622 -2.151 -6.049
75 2HB CYS 13 HB1 CYS 13 -0.579 -3.905 -5.845
76 H LEU 14 HN LEU 14 -2.859 -5.378 -4.742
77 HA LEU 14 HA LEU 14 -4.165 -7.163 -5.224
78 1HB LEU 14 HB2 LEU 14 -5.743 -4.955 -6.417
79 2HB LEU 14 HB1 LEU 14 -6.130 -6.583 -6.937
80 HG LEU 14 HG LEU 14 -6.300 -7.134 -4.426
81 1HD1 LEU 14 1HD1 LEU 14 -7.235 -4.791 -3.421
82 2HD1 LEU 14 2HD1 LEU 14 -5.864 -4.236 -4.382
83 3HD1 LEU 14 3HD1 LEU 14 -5.625 -5.443 -3.118
84 1HD2 LEU 14 1HD2 LEU 14 -8.182 -6.960 -6.059
85 2HD2 LEU 14 2HD2 LEU 14 -8.359 -5.269 -5.588
86 3HD2 LEU 14 3HD2 LEU 14 -8.614 -6.548 -4.400
87 H VAL 15 HN VAL 15 -2.146 -5.719 -7.331
88 HA VAL 15 HA VAL 15 -2.751 -7.001 -9.787
89 HB VAL 15 HB VAL 15 -1.206 -5.118 -9.739
90 1HG1 VAL 15 1HG1 VAL 15 -0.199 -5.676 -7.522
91 2HG1 VAL 15 2HG1 VAL 15 0.980 -5.240 -8.759
92 3HG1 VAL 15 3HG1 VAL 15 0.743 -6.932 -8.326
93 1HG2 VAL 15 1HG2 VAL 15 0.487 -7.433 -10.571
94 2HG2 VAL 15 2HG2 VAL 15 0.250 -5.876 -11.364
95 3HG2 VAL 15 3HG2 VAL 15 -1.026 -7.093 -11.412
96 H ASP 16 HN ASP 16 -1.880 -8.255 -6.848
97 HA ASP 16 HA ASP 16 -0.372 -10.501 -7.929
98 1HB ASP 16 HB2 ASP 16 -0.099 -9.039 -5.625
99 2HB ASP 16 HB1 ASP 16 -1.003 -10.442 -5.052
100 H GLY 17 HN GLY 17 -3.201 -10.091 -8.519
101 1HA GLY 17 HA2 GLY 17 -4.135 -12.744 -7.899
102 2HA GLY 17 HA1 GLY 17 -5.069 -11.474 -7.121
103 HA PRO 18 HA PRO 18 -7.438 -11.307 -10.875
104 1HB PRO 18 HB2 PRO 18 -8.676 -8.930 -10.548
105 2HB PRO 18 HB1 PRO 18 -9.094 -10.353 -9.585
106 1HG PRO 18 HG2 PRO 18 -7.354 -8.024 -8.868
107 2HG PRO 18 HG1 PRO 18 -8.585 -8.843 -7.890
108 1HD PRO 18 HD2 PRO 18 -5.922 -9.323 -7.622
109 2HD PRO 18 HD1 PRO 18 -7.162 -10.551 -7.302
110 H ILE 19 HN ILE 19 -5.315 -8.671 -9.987
111 HA ILE 19 HA ILE 19 -3.768 -7.568 -11.258
112 HB ILE 19 HB ILE 19 -5.182 -8.610 -13.677
113 1HG1 ILE 19 2HG1 ILE 19 -4.229 -10.403 -12.247
114 2HG1 ILE 19 1HG1 ILE 19 -3.444 -10.292 -13.817
115 1HG2 ILE 19 1HG2 ILE 19 -2.391 -7.953 -13.999
116 2HG2 ILE 19 2HG2 ILE 19 -3.326 -6.559 -13.460
117 3HG2 ILE 19 3HG2 ILE 19 -3.787 -7.414 -14.932
118 1HD1 ILE 19 1HD1 ILE 19 -2.096 -10.520 -11.542
119 2HD1 ILE 19 2HD1 ILE 19 -2.225 -8.763 -11.604
120 3HD1 ILE 19 3HD1 ILE 19 -1.470 -9.638 -12.936
121 HA PRO 20 HA PRO 20 -7.039 -4.377 -12.052
122 1HB PRO 20 HB2 PRO 20 -7.474 -3.340 -9.646
123 2HB PRO 20 HB1 PRO 20 -8.223 -4.871 -10.113
124 1HG PRO 20 HG2 PRO 20 -5.944 -4.364 -8.285
125 2HG PRO 20 HG1 PRO 20 -7.148 -5.661 -8.250
126 1HD PRO 20 HD2 PRO 20 -4.502 -5.773 -9.319
127 2HD PRO 20 HD1 PRO 20 -5.750 -7.029 -9.386
128 H ASP 21 HN ASP 21 -4.136 -4.311 -12.263
129 HA ASP 21 HA ASP 21 -2.349 -2.900 -12.279
130 1HB ASP 21 HB2 ASP 21 -3.182 -0.383 -12.613
131 2HB ASP 21 HB1 ASP 21 -3.252 -1.579 -13.901
132 H PHE 22 HN PHE 22 -1.169 -2.720 -10.527
133 1HB PHE 22 HB2 PHE 22 0.244 -0.154 -8.824
134 2HB PHE 22 HB1 PHE 22 0.640 -1.521 -7.793
135 HD1 PHE 22 HD1 PHE 22 0.196 -0.508 -11.328
136 HD2 PHE 22 HD2 PHE 22 1.912 -3.301 -8.614
137 HE1 PHE 22 HE1 PHE 22 1.485 -1.502 -13.173
138 HE2 PHE 22 HE2 PHE 22 3.206 -4.299 -10.454
139 HZ PHE 22 HZ PHE 22 2.994 -3.399 -12.737
140 H GLU 23 HN GLU 23 -3.518 -1.731 -7.492
141 HA GLU 23 HA GLU 23 -4.104 1.090 -7.707
142 1HB GLU 23 HB2 GLU 23 -6.295 0.538 -6.893
143 2HB GLU 23 HB1 GLU 23 -5.839 -0.668 -8.089
144 1HG GLU 23 HG2 GLU 23 -5.010 -1.973 -5.956
145 2HG GLU 23 HG1 GLU 23 -6.191 -0.942 -5.152
146 H ILE 24 HN ILE 24 -1.942 1.089 -6.272
147 HA ILE 24 HA ILE 24 -2.357 0.767 -3.455
148 HB ILE 24 HB ILE 24 -0.156 2.320 -4.817
149 1HG1 ILE 24 2HG1 ILE 24 -0.332 0.011 -5.706
150 2HG1 ILE 24 1HG1 ILE 24 1.155 0.273 -4.800
151 1HG2 ILE 24 1HG2 ILE 24 0.357 0.848 -2.328
152 2HG2 ILE 24 2HG2 ILE 24 -0.757 2.206 -2.178
153 3HG2 ILE 24 3HG2 ILE 24 0.865 2.463 -2.820
154 1HD1 ILE 24 1HD1 ILE 24 -1.310 -1.146 -3.822
155 2HD1 ILE 24 2HD1 ILE 24 0.136 -0.838 -2.860
156 3HD1 ILE 24 3HD1 ILE 24 0.225 -1.886 -4.276
157 H ALA 25 HN ALA 25 -1.620 3.666 -5.404
158 HA ALA 25 HA ALA 25 -2.218 5.848 -5.178
159 1HB ALA 25 HB1 ALA 25 -4.546 4.891 -3.529
160 2HB ALA 25 HB2 ALA 25 -4.505 4.798 -5.289
161 3HB ALA 25 HB3 ALA 25 -4.426 6.366 -4.488
162 H GLY 26 HN GLY 26 -0.568 4.440 -3.097
163 1HA GLY 26 HA2 GLY 26 0.393 6.281 -1.524
164 2HA GLY 26 HA1 GLY 26 -1.163 6.079 -0.737
165 H ALA 27 HN ALA 27 1.717 4.268 -1.755
166 HA ALA 27 HA ALA 27 1.187 2.045 -0.045
167 1HB ALA 27 HB1 ALA 27 3.021 2.672 -2.098
168 2HB ALA 27 HB2 ALA 27 2.686 1.114 -1.346
169 3HB ALA 27 HB3 ALA 27 3.940 2.160 -0.681
170 H THR 28 HN THR 28 1.975 5.111 0.770
171 HB THR 28 HB THR 28 4.493 6.237 1.543
172 HG1 THR 28 HG1 THR 28 5.241 3.769 2.712
173 1HG2 THR 28 1HG2 THR 28 5.178 7.283 3.379
174 2HG2 THR 28 2HG2 THR 28 6.115 5.827 3.706
175 3HG2 THR 28 3HG2 THR 28 4.528 6.038 4.446
176 H GLY 29 HN GLY 29 1.104 3.571 3.234
177 1HA GLY 29 HA2 GLY 29 1.429 3.024 5.887
178 2HA GLY 29 HA1 GLY 29 0.732 1.881 4.751
179 H LEU 30 HN LEU 30 3.207 1.559 3.234
180 HA LEU 30 HA LEU 30 4.303 -0.612 4.630
181 1HB LEU 30 HB2 LEU 30 5.527 0.960 2.363
182 2HB LEU 30 HB1 LEU 30 6.021 -0.640 2.884
183 HG LEU 30 HG LEU 30 3.376 0.102 1.635
184 1HD1 LEU 30 1HD1 LEU 30 4.098 -1.224 -0.227
185 2HD1 LEU 30 2HD1 LEU 30 5.572 -1.693 0.621
186 3HD1 LEU 30 3HD1 LEU 30 5.339 -0.019 0.118
187 1HD2 LEU 30 1HD2 LEU 30 4.357 -2.459 2.859
188 2HD2 LEU 30 2HD2 LEU 30 3.082 -2.429 1.642
189 3HD2 LEU 30 3HD2 LEU 30 2.856 -1.589 3.176
190 H PHE 31 HN PHE 31 4.936 2.741 4.899
191 1HB PHE 31 HB2 PHE 31 8.666 3.632 5.794
192 2HB PHE 31 HB1 PHE 31 8.517 1.881 5.802
193 HD1 PHE 31 HD1 PHE 31 7.997 4.918 3.788
194 HD2 PHE 31 HD2 PHE 31 8.074 0.664 3.820
195 HE1 PHE 31 HE1 PHE 31 7.970 4.902 1.327
196 HE2 PHE 31 HE2 PHE 31 8.047 0.639 1.360
197 HZ PHE 31 HZ PHE 31 7.997 2.760 0.110
198 H GLY 32 HN GLY 32 4.699 2.371 7.628
199 1HA GLY 32 HA2 GLY 32 6.102 2.176 10.098
200 2HA GLY 32 HA1 GLY 32 4.429 1.720 9.819
201 H LEU 33 HN LEU 33 5.804 -0.034 7.546
202 HA LEU 33 HA LEU 33 6.005 -2.368 9.280
203 1HB LEU 33 HB2 LEU 33 5.991 -2.249 6.267
204 2HB LEU 33 HB1 LEU 33 5.804 -3.682 7.261
205 HG LEU 33 HG LEU 33 3.845 -1.413 6.941
206 1HD1 LEU 33 1HD1 LEU 33 2.631 -2.792 5.643
207 2HD1 LEU 33 2HD1 LEU 33 3.062 -4.224 6.574
208 3HD1 LEU 33 3HD1 LEU 33 4.184 -3.582 5.375
209 1HD2 LEU 33 1HD2 LEU 33 4.041 -3.549 9.012
210 2HD2 LEU 33 2HD2 LEU 33 2.450 -3.048 8.437
211 3HD2 LEU 33 3HD2 LEU 33 3.534 -1.867 9.171
212 H TRP 34 HN TRP 34 8.178 -0.195 8.636
213 HA TRP 34 HA TRP 34 10.320 -2.170 8.253
214 1HB TRP 34 HB2 TRP 34 9.660 -0.156 6.420
215 2HB TRP 34 HB1 TRP 34 11.094 0.435 7.253
216 HD1 TRP 34 HD1 TRP 34 10.823 -0.735 4.144
217 HE1 TRP 34 HE1 TRP 34 12.540 -2.516 3.432
218 HE3 TRP 34 HE3 TRP 34 12.315 -2.322 8.770
219 HZ2 TRP 34 HZ2 TRP 34 14.294 -4.350 4.668
220 HZ3 TRP 34 HZ3 TRP 34 14.016 -4.093 8.918
221 HH2 TRP 34 HH2 TRP 34 14.984 -5.086 6.908
222 H GLY 35 HN GLY 35 10.359 1.344 8.795
223 1HA GLY 35 HA2 GLY 35 10.668 1.630 11.441
224 2HA GLY 35 HA1 GLY 35 12.229 0.964 10.983
Start of MODEL 6
1 3H ASN 1 HT3 ASN 1 9.745 7.501 10.532
2 HA ASN 1 HA ASN 1 8.266 6.547 8.912
3 1HB ASN 1 HB2 ASN 1 6.365 5.281 9.508
4 2HB ASN 1 HB1 ASN 1 7.614 4.770 10.635
5 1HD2 ASN 1 1HD2 ASN 1 7.609 6.629 12.555
6 2HD2 ASN 1 2HD2 ASN 1 6.070 6.717 13.332
7 H LYS 2 HN LYS 2 8.697 9.159 9.840
8 HA LYS 2 HA LYS 2 6.344 10.542 10.516
9 1HB LYS 2 HB2 LYS 2 8.826 11.490 9.080
10 2HB LYS 2 HB1 LYS 2 7.559 12.555 9.673
11 1HG LYS 2 HG2 LYS 2 8.264 12.425 11.795
12 2HG LYS 2 HG1 LYS 2 8.635 10.704 11.676
13 1HD LYS 2 HD2 LYS 2 10.758 11.096 10.806
14 2HD LYS 2 HD1 LYS 2 10.348 12.733 10.290
15 1HE LYS 2 HE2 LYS 2 10.201 13.404 12.665
16 2HE LYS 2 HE1 LYS 2 10.709 11.781 13.129
17 1HZ LYS 2 HZ1 LYS 2 12.593 13.234 13.152
18 2HZ LYS 2 HZ2 LYS 2 12.288 13.753 11.572
19 3HZ LYS 2 HZ3 LYS 2 12.771 12.158 11.858
20 H GLY 3 HN GLY 3 7.332 9.119 7.565
21 1HA GLY 3 HA2 GLY 3 5.458 10.785 6.030
22 2HA GLY 3 HA1 GLY 3 6.705 9.757 5.342
23 H CYS 4 HN CYS 4 5.933 7.540 7.213
24 HA CYS 4 HA CYS 4 3.995 6.345 5.484
25 1HB CYS 4 HB2 CYS 4 5.043 5.253 8.093
26 2HB CYS 4 HB1 CYS 4 4.284 4.343 6.791
27 H ALA 5 HN ALA 5 3.573 8.505 7.919
28 HA ALA 5 HA ALA 5 1.377 7.337 9.315
29 1HB ALA 5 HB1 ALA 5 2.463 10.129 9.125
30 2HB ALA 5 HB2 ALA 5 2.519 9.011 10.488
31 3HB ALA 5 HB3 ALA 5 0.991 9.760 10.025
32 H THR 6 HN THR 6 1.596 9.852 6.800
33 HA THR 6 HA THR 6 -1.252 9.959 6.453
34 HB THR 6 HB THR 6 0.041 11.967 6.103
35 HG1 THR 6 HG1 THR 6 -1.807 11.472 4.692
36 1HG2 THR 6 1HG2 THR 6 1.997 12.030 5.090
37 2HG2 THR 6 2HG2 THR 6 1.270 11.451 3.590
38 3HG2 THR 6 3HG2 THR 6 1.876 10.298 4.780
39 H CYS 7 HN CYS 7 -0.652 7.357 6.120
40 HA CYS 7 HA CYS 7 -1.743 6.722 3.623
41 1HB CYS 7 HB2 CYS 7 0.131 5.731 2.449
42 2HB CYS 7 HB1 CYS 7 0.523 7.407 2.817
43 H SER 8 HN SER 8 -2.302 6.004 6.215
44 HA SER 8 HA SER 8 -1.230 3.682 7.238
45 1HB SER 8 HB2 SER 8 -3.098 5.177 8.189
46 2HB SER 8 HB1 SER 8 -4.202 4.177 7.245
47 HG SER 8 HG SER 8 -2.321 3.074 9.048
48 H ILE 9 HN ILE 9 -3.212 4.087 4.426
49 HA ILE 9 HA ILE 9 -4.258 1.518 4.131
50 HB ILE 9 HB ILE 9 -3.618 3.744 2.249
51 1HG1 ILE 9 2HG1 ILE 9 -5.710 3.734 3.536
52 2HG1 ILE 9 1HG1 ILE 9 -6.021 3.614 1.807
53 1HG2 ILE 9 1HG2 ILE 9 -3.996 0.906 1.453
54 2HG2 ILE 9 2HG2 ILE 9 -3.006 2.168 0.717
55 3HG2 ILE 9 3HG2 ILE 9 -4.754 2.165 0.476
56 1HD1 ILE 9 1HD1 ILE 9 -5.794 0.995 2.945
57 2HD1 ILE 9 2HD1 ILE 9 -7.150 1.738 2.098
58 3HD1 ILE 9 3HD1 ILE 9 -6.974 1.954 3.839
59 H GLY 10 HN GLY 10 -1.577 2.733 2.127
60 1HA GLY 10 HA2 GLY 10 0.472 1.767 1.643
61 2HA GLY 10 HA1 GLY 10 0.116 0.506 2.814
62 H ALA 11 HN ALA 11 0.677 -1.235 1.607
63 HA ALA 11 HA ALA 11 0.202 -1.672 -1.085
64 1HB ALA 11 HB1 ALA 11 1.628 -3.017 0.555
65 2HB ALA 11 HB2 ALA 11 0.785 -3.905 -0.716
66 3HB ALA 11 HB3 ALA 11 0.144 -3.896 0.926
67 H ALA 12 HN ALA 12 -1.712 -1.454 -2.039
68 HA ALA 12 HA ALA 12 -3.831 -3.286 -1.459
69 1HB ALA 12 HB1 ALA 12 -3.995 -0.502 -0.483
70 2HB ALA 12 HB2 ALA 12 -4.774 -1.964 0.120
71 3HB ALA 12 HB3 ALA 12 -5.429 -1.134 -1.293
72 H CYS 13 HN CYS 13 -3.173 -3.730 -3.660
73 HA CYS 13 HA CYS 13 -3.401 -1.852 -5.750
74 1HB CYS 13 HB2 CYS 13 -3.231 -4.830 -5.603
75 2HB CYS 13 HB1 CYS 13 -3.714 -4.077 -7.122
76 H LEU 14 HN LEU 14 -5.722 -3.974 -4.233
77 HA LEU 14 HA LEU 14 -7.990 -4.100 -4.415
78 1HB LEU 14 HB2 LEU 14 -7.388 -1.482 -5.516
79 2HB LEU 14 HB1 LEU 14 -8.756 -2.214 -6.332
80 HG LEU 14 HG LEU 14 -8.558 -1.880 -3.341
81 1HD1 LEU 14 1HD1 LEU 14 -8.656 0.310 -4.232
82 2HD1 LEU 14 2HD1 LEU 14 -10.300 -0.100 -3.743
83 3HD1 LEU 14 3HD1 LEU 14 -9.845 -0.159 -5.447
84 1HD2 LEU 14 1HD2 LEU 14 -10.560 -3.035 -5.202
85 2HD2 LEU 14 2HD2 LEU 14 -11.154 -2.123 -3.815
86 3HD2 LEU 14 3HD2 LEU 14 -10.115 -3.525 -3.568
87 H VAL 15 HN VAL 15 -5.796 -4.851 -6.636
88 HA VAL 15 HA VAL 15 -7.255 -5.322 -9.011
89 HB VAL 15 HB VAL 15 -4.802 -5.268 -8.967
90 1HG1 VAL 15 1HG1 VAL 15 -3.465 -6.831 -7.901
91 2HG1 VAL 15 2HG1 VAL 15 -4.772 -8.005 -7.760
92 3HG1 VAL 15 3HG1 VAL 15 -4.759 -6.574 -6.730
93 1HG2 VAL 15 1HG2 VAL 15 -5.267 -8.039 -9.843
94 2HG2 VAL 15 2HG2 VAL 15 -4.633 -6.656 -10.734
95 3HG2 VAL 15 3HG2 VAL 15 -6.372 -6.837 -10.509
96 H ASP 16 HN ASP 16 -7.701 -6.615 -6.025
97 HA ASP 16 HA ASP 16 -8.391 -9.289 -6.956
98 1HB ASP 16 HB2 ASP 16 -7.111 -8.497 -4.720
99 2HB ASP 16 HB1 ASP 16 -8.770 -8.496 -4.121
100 H GLY 17 HN GLY 17 -9.873 -6.739 -7.544
101 1HA GLY 17 HA2 GLY 17 -12.533 -7.758 -6.919
102 2HA GLY 17 HA1 GLY 17 -12.160 -6.126 -6.379
103 HA PRO 18 HA PRO 18 -13.733 -4.717 -10.300
104 1HB PRO 18 HB2 PRO 18 -12.177 -2.401 -10.434
105 2HB PRO 18 HB1 PRO 18 -13.770 -2.535 -9.688
106 1HG PRO 18 HG2 PRO 18 -11.081 -2.543 -8.424
107 2HG PRO 18 HG1 PRO 18 -12.615 -1.913 -7.806
108 1HD PRO 18 HD2 PRO 18 -11.533 -4.225 -6.921
109 2HD PRO 18 HD1 PRO 18 -13.287 -3.969 -7.017
110 H ILE 19 HN ILE 19 -10.385 -5.173 -9.567
111 HA ILE 19 HA ILE 19 -8.772 -6.196 -10.801
112 HB ILE 19 HB ILE 19 -10.474 -5.732 -13.212
113 1HG1 ILE 19 2HG1 ILE 19 -10.354 -8.461 -12.634
114 2HG1 ILE 19 1HG1 ILE 19 -10.613 -7.682 -11.076
115 1HG2 ILE 19 1HG2 ILE 19 -8.767 -6.456 -14.438
116 2HG2 ILE 19 2HG2 ILE 19 -8.668 -7.926 -13.466
117 3HG2 ILE 19 3HG2 ILE 19 -7.763 -6.488 -12.989
118 1HD1 ILE 19 1HD1 ILE 19 -12.299 -6.803 -13.339
119 2HD1 ILE 19 2HD1 ILE 19 -12.685 -6.965 -11.627
120 3HD1 ILE 19 3HD1 ILE 19 -12.605 -8.398 -12.653
121 HA PRO 20 HA PRO 20 -7.914 -1.630 -12.076
122 1HB PRO 20 HB2 PRO 20 -6.232 -1.135 -9.941
123 2HB PRO 20 HB1 PRO 20 -7.922 -0.637 -10.021
124 1HG PRO 20 HG2 PRO 20 -6.718 -3.037 -8.697
125 2HG PRO 20 HG1 PRO 20 -7.992 -1.950 -8.107
126 1HD PRO 20 HD2 PRO 20 -8.607 -4.340 -9.124
127 2HD PRO 20 HD1 PRO 20 -9.619 -2.924 -9.461
128 H ASP 21 HN ASP 21 -5.245 -2.672 -10.101
129 HA ASP 21 HA ASP 21 -3.718 -4.368 -11.433
130 1HB ASP 21 HB2 ASP 21 -2.300 -2.912 -13.003
131 2HB ASP 21 HB1 ASP 21 -3.886 -3.414 -13.578
132 H PHE 22 HN PHE 22 -3.049 -4.321 -9.211
133 1HB PHE 22 HB2 PHE 22 0.202 -2.695 -9.513
134 2HB PHE 22 HB1 PHE 22 0.583 -3.450 -7.971
135 HD1 PHE 22 HD1 PHE 22 -0.036 -3.956 -11.464
136 HD2 PHE 22 HD2 PHE 22 0.107 -5.906 -7.684
137 HE1 PHE 22 HE1 PHE 22 0.165 -6.130 -12.598
138 HE2 PHE 22 HE2 PHE 22 0.309 -8.085 -8.811
139 HZ PHE 22 HZ PHE 22 0.338 -8.198 -11.271
140 H GLU 23 HN GLU 23 -3.638 -1.803 -7.921
141 HA GLU 23 HA GLU 23 -2.613 0.780 -8.279
142 1HB GLU 23 HB2 GLU 23 -4.750 1.510 -8.045
143 2HB GLU 23 HB1 GLU 23 -5.087 -0.195 -8.292
144 1HG GLU 23 HG2 GLU 23 -6.435 0.335 -6.501
145 2HG GLU 23 HG1 GLU 23 -5.014 -0.345 -5.713
146 H ILE 24 HN ILE 24 -1.258 1.851 -7.030
147 HA ILE 24 HA ILE 24 -1.022 1.169 -4.212
148 HB ILE 24 HB ILE 24 0.600 3.112 -5.868
149 1HG1 ILE 24 2HG1 ILE 24 1.873 0.658 -4.896
150 2HG1 ILE 24 1HG1 ILE 24 0.569 0.362 -6.040
151 1HG2 ILE 24 1HG2 ILE 24 2.181 2.447 -3.789
152 2HG2 ILE 24 2HG2 ILE 24 0.598 2.396 -3.011
153 3HG2 ILE 24 3HG2 ILE 24 1.139 3.870 -3.813
154 1HD1 ILE 24 1HD1 ILE 24 2.226 0.594 -7.535
155 2HD1 ILE 24 2HD1 ILE 24 3.215 1.575 -6.451
156 3HD1 ILE 24 3HD1 ILE 24 1.878 2.311 -7.334
157 H ALA 25 HN ALA 25 -0.809 4.370 -5.742
158 HA ALA 25 HA ALA 25 -1.508 6.416 -4.985
159 1HB ALA 25 HB1 ALA 25 -3.948 4.704 -5.119
160 2HB ALA 25 HB2 ALA 25 -3.434 6.013 -6.183
161 3HB ALA 25 HB3 ALA 25 -4.073 6.378 -4.580
162 H GLY 26 HN GLY 26 -0.439 4.675 -2.874
163 1HA GLY 26 HA2 GLY 26 -0.664 6.175 -0.652
164 2HA GLY 26 HA1 GLY 26 -2.107 5.178 -0.557
165 H ALA 27 HN ALA 27 1.194 4.403 -1.631
166 HA ALA 27 HA ALA 27 1.193 1.929 -0.208
167 1HB ALA 27 HB1 ALA 27 2.607 1.556 -1.858
168 2HB ALA 27 HB2 ALA 27 3.811 2.402 -0.891
169 3HB ALA 27 HB3 ALA 27 2.896 3.273 -2.122
170 H THR 28 HN THR 28 1.369 4.903 1.060
171 HB THR 28 HB THR 28 4.472 4.919 1.801
172 HG1 THR 28 HG1 THR 28 5.402 4.829 3.673
173 1HG2 THR 28 1HG2 THR 28 3.974 7.613 2.846
174 2HG2 THR 28 2HG2 THR 28 2.902 7.074 1.554
175 3HG2 THR 28 3HG2 THR 28 4.647 7.093 1.300
176 H GLY 29 HN GLY 29 0.883 3.030 3.247
177 1HA GLY 29 HA2 GLY 29 1.265 2.232 5.805
178 2HA GLY 29 HA1 GLY 29 0.799 1.118 4.533
179 H LEU 30 HN LEU 30 3.402 1.477 3.136
180 HA LEU 30 HA LEU 30 4.775 -0.659 4.361
181 1HB LEU 30 HB2 LEU 30 5.860 1.306 2.344
182 2HB LEU 30 HB1 LEU 30 6.497 -0.289 2.695
183 HG LEU 30 HG LEU 30 3.856 0.346 1.382
184 1HD1 LEU 30 1HD1 LEU 30 5.110 -1.247 -0.337
185 2HD1 LEU 30 2HD1 LEU 30 6.523 -0.516 0.428
186 3HD1 LEU 30 3HD1 LEU 30 5.314 0.506 -0.348
187 1HD2 LEU 30 1HD2 LEU 30 3.764 -1.606 2.948
188 2HD2 LEU 30 2HD2 LEU 30 5.005 -2.377 1.960
189 3HD2 LEU 30 3HD2 LEU 30 3.430 -1.997 1.260
190 H PHE 31 HN PHE 31 5.086 2.817 4.639
191 1HB PHE 31 HB2 PHE 31 8.693 3.446 6.473
192 2HB PHE 31 HB1 PHE 31 8.332 1.870 5.784
193 HD1 PHE 31 HD1 PHE 31 9.514 5.141 5.132
194 HD2 PHE 31 HD2 PHE 31 7.531 1.835 3.328
195 HE1 PHE 31 HE1 PHE 31 10.150 5.978 2.907
196 HE2 PHE 31 HE2 PHE 31 8.163 2.666 1.101
197 HZ PHE 31 HZ PHE 31 9.474 4.739 0.888
198 H GLY 32 HN GLY 32 4.646 1.782 7.025
199 1HA GLY 32 HA2 GLY 32 4.569 2.417 9.682
200 2HA GLY 32 HA1 GLY 32 4.086 0.853 9.051
201 H LEU 33 HN LEU 33 6.647 -0.038 8.188
202 HA LEU 33 HA LEU 33 7.737 -0.757 10.782
203 1HB LEU 33 HB2 LEU 33 9.212 -2.268 9.311
204 2HB LEU 33 HB1 LEU 33 7.509 -2.647 9.478
205 HG LEU 33 HG LEU 33 7.018 -1.804 7.297
206 1HD1 LEU 33 1HD1 LEU 33 8.710 -0.793 5.863
207 2HD1 LEU 33 2HD1 LEU 33 9.890 -0.898 7.172
208 3HD1 LEU 33 3HD1 LEU 33 8.477 0.146 7.339
209 1HD2 LEU 33 1HD2 LEU 33 7.986 -4.072 7.452
210 2HD2 LEU 33 2HD2 LEU 33 9.580 -3.384 7.135
211 3HD2 LEU 33 3HD2 LEU 33 8.317 -3.286 5.908
212 H TRP 34 HN TRP 34 8.212 1.870 9.107
213 HA TRP 34 HA TRP 34 11.065 1.985 9.763
214 1HB TRP 34 HB2 TRP 34 10.043 1.999 7.137
215 2HB TRP 34 HB1 TRP 34 10.495 3.665 7.486
216 HD1 TRP 34 HD1 TRP 34 12.360 0.469 8.631
217 HE1 TRP 34 HE1 TRP 34 14.769 0.590 7.732
218 HE3 TRP 34 HE3 TRP 34 11.987 4.765 5.884
219 HZ2 TRP 34 HZ2 TRP 34 16.308 2.283 6.079
220 HZ3 TRP 34 HZ3 TRP 34 13.975 5.568 4.676
221 HH2 TRP 34 HH2 TRP 34 16.089 4.352 4.772
222 H GLY 35 HN GLY 35 10.348 3.035 11.671
223 1HA GLY 35 HA2 GLY 35 8.706 5.069 12.176
224 2HA GLY 35 HA1 GLY 35 10.319 5.032 12.862
Start of MODEL 7
1 3H ASN 1 HT3 ASN 1 8.207 1.341 12.493
2 HA ASN 1 HA ASN 1 6.662 1.375 10.668
3 1HB ASN 1 HB2 ASN 1 5.247 -0.522 10.183
4 2HB ASN 1 HB1 ASN 1 6.908 -1.079 10.309
5 1HD2 ASN 1 1HD2 ASN 1 7.501 -1.741 12.640
6 2HD2 ASN 1 2HD2 ASN 1 6.352 -2.761 13.430
7 H LYS 2 HN LYS 2 6.423 2.849 12.777
8 HA LYS 2 HA LYS 2 4.179 2.262 14.449
9 1HB LYS 2 HB2 LYS 2 6.206 4.304 14.252
10 2HB LYS 2 HB1 LYS 2 4.628 5.046 14.464
11 1HG LYS 2 HG2 LYS 2 4.693 2.946 16.296
12 2HG LYS 2 HG1 LYS 2 6.293 3.686 16.378
13 1HD LYS 2 HD2 LYS 2 4.399 5.787 16.263
14 2HD LYS 2 HD1 LYS 2 3.820 4.625 17.458
15 1HE LYS 2 HE2 LYS 2 5.700 4.870 18.795
16 2HE LYS 2 HE1 LYS 2 6.681 5.499 17.470
17 1HZ LYS 2 HZ1 LYS 2 4.762 6.889 19.187
18 2HZ LYS 2 HZ2 LYS 2 4.906 7.414 17.586
19 3HZ LYS 2 HZ3 LYS 2 6.261 7.410 18.599
20 H GLY 3 HN GLY 3 3.010 1.730 12.233
21 1HA GLY 3 HA2 GLY 3 1.168 2.204 10.949
22 2HA GLY 3 HA1 GLY 3 0.924 3.623 11.956
23 H CYS 4 HN CYS 4 4.012 3.642 10.640
24 HA CYS 4 HA CYS 4 4.972 5.225 9.296
25 1HB CYS 4 HB2 CYS 4 3.727 3.137 7.845
26 2HB CYS 4 HB1 CYS 4 3.528 4.609 6.903
27 H ALA 5 HN ALA 5 4.008 6.479 6.946
28 HA ALA 5 HA ALA 5 2.783 8.757 8.105
29 1HB ALA 5 HB1 ALA 5 3.220 8.103 5.200
30 2HB ALA 5 HB2 ALA 5 4.362 8.927 6.259
31 3HB ALA 5 HB3 ALA 5 2.824 9.690 5.854
32 H THR 6 HN THR 6 0.968 9.777 6.532
33 HA THR 6 HA THR 6 -1.399 8.282 7.113
34 HB THR 6 HB THR 6 -2.603 10.239 6.476
35 HG1 THR 6 HG1 THR 6 -1.844 11.725 5.138
36 1HG2 THR 6 1HG2 THR 6 -1.956 11.308 8.291
37 2HG2 THR 6 2HG2 THR 6 -0.585 11.973 7.404
38 3HG2 THR 6 3HG2 THR 6 -0.417 10.448 8.271
39 H CYS 7 HN CYS 7 -0.299 6.624 5.510
40 HA CYS 7 HA CYS 7 -1.956 6.710 3.130
41 1HB CYS 7 HB2 CYS 7 0.269 5.949 1.842
42 2HB CYS 7 HB1 CYS 7 -0.250 7.627 1.927
43 H SER 8 HN SER 8 -1.904 5.077 5.482
44 HA SER 8 HA SER 8 -0.652 2.630 5.285
45 1HB SER 8 HB2 SER 8 -3.508 3.021 6.197
46 2HB SER 8 HB1 SER 8 -2.398 1.743 6.691
47 HG SER 8 HG SER 8 -2.760 3.947 7.940
48 H ILE 9 HN ILE 9 -3.285 3.874 3.397
49 HA ILE 9 HA ILE 9 -4.343 1.480 2.391
50 HB ILE 9 HB ILE 9 -4.305 4.312 1.427
51 1HG1 ILE 9 2HG1 ILE 9 -5.886 3.574 3.179
52 2HG1 ILE 9 1HG1 ILE 9 -6.713 4.117 1.722
53 1HG2 ILE 9 1HG2 ILE 9 -5.266 1.953 -0.177
54 2HG2 ILE 9 2HG2 ILE 9 -4.070 3.163 -0.643
55 3HG2 ILE 9 3HG2 ILE 9 -5.767 3.617 -0.483
56 1HD1 ILE 9 1HD1 ILE 9 -7.888 2.226 2.158
57 2HD1 ILE 9 2HD1 ILE 9 -6.514 1.405 2.897
58 3HD1 ILE 9 3HD1 ILE 9 -6.618 1.546 1.142
59 H GLY 10 HN GLY 10 -1.358 3.067 1.763
60 1HA GLY 10 HA2 GLY 10 -0.710 2.451 -0.818
61 2HA GLY 10 HA1 GLY 10 0.448 2.414 0.501
62 H ALA 11 HN ALA 11 0.341 0.327 1.844
63 HA ALA 11 HA ALA 11 0.863 -1.840 0.085
64 1HB ALA 11 HB1 ALA 11 1.423 -3.095 2.032
65 2HB ALA 11 HB2 ALA 11 0.509 -2.002 3.072
66 3HB ALA 11 HB3 ALA 11 1.989 -1.443 2.287
67 H ALA 12 HN ALA 12 -1.438 -1.534 -0.857
68 HA ALA 12 HA ALA 12 -2.954 -3.824 -0.162
69 1HB ALA 12 HB1 ALA 12 -5.042 -2.190 0.253
70 2HB ALA 12 HB2 ALA 12 -3.752 -1.222 0.967
71 3HB ALA 12 HB3 ALA 12 -4.058 -2.856 1.556
72 H CYS 13 HN CYS 13 -2.316 -3.905 -2.472
73 HA CYS 13 HA CYS 13 -3.468 -2.114 -4.363
74 1HB CYS 13 HB2 CYS 13 -2.040 -4.731 -4.498
75 2HB CYS 13 HB1 CYS 13 -3.017 -4.254 -5.882
76 H LEU 14 HN LEU 14 -4.416 -5.189 -2.974
77 HA LEU 14 HA LEU 14 -6.425 -6.259 -2.892
78 1HB LEU 14 HB2 LEU 14 -7.356 -3.757 -4.284
79 2HB LEU 14 HB1 LEU 14 -8.427 -5.118 -4.027
80 HG LEU 14 HG LEU 14 -7.757 -4.881 -1.532
81 1HD1 LEU 14 1HD1 LEU 14 -5.999 -3.357 -1.557
82 2HD1 LEU 14 2HD1 LEU 14 -7.380 -2.386 -1.049
83 3HD1 LEU 14 3HD1 LEU 14 -6.807 -2.298 -2.714
84 1HD2 LEU 14 1HD2 LEU 14 -9.739 -3.839 -1.202
85 2HD2 LEU 14 2HD2 LEU 14 -9.915 -4.139 -2.930
86 3HD2 LEU 14 3HD2 LEU 14 -9.384 -2.557 -2.359
87 H VAL 15 HN VAL 15 -4.498 -5.806 -5.432
88 HA VAL 15 HA VAL 15 -5.956 -6.767 -7.656
89 HB VAL 15 HB VAL 15 -3.810 -5.611 -7.901
90 1HG1 VAL 15 1HG1 VAL 15 -2.415 -8.094 -6.964
91 2HG1 VAL 15 2HG1 VAL 15 -2.824 -6.793 -5.846
92 3HG1 VAL 15 3HG1 VAL 15 -1.756 -6.478 -7.213
93 1HG2 VAL 15 1HG2 VAL 15 -4.697 -7.307 -9.584
94 2HG2 VAL 15 2HG2 VAL 15 -3.475 -8.407 -8.948
95 3HG2 VAL 15 3HG2 VAL 15 -2.988 -6.886 -9.696
96 H ASP 16 HN ASP 16 -5.276 -8.302 -4.813
97 HA ASP 16 HA ASP 16 -4.877 -10.933 -6.009
98 1HB ASP 16 HB2 ASP 16 -3.754 -9.796 -3.813
99 2HB ASP 16 HB1 ASP 16 -5.101 -10.658 -3.071
100 H GLY 17 HN GLY 17 -7.388 -9.297 -6.091
101 1HA GLY 17 HA2 GLY 17 -9.204 -11.448 -5.427
102 2HA GLY 17 HA1 GLY 17 -9.454 -9.966 -4.513
103 HA PRO 18 HA PRO 18 -12.216 -8.590 -7.697
104 1HB PRO 18 HB2 PRO 18 -11.578 -5.863 -7.524
105 2HB PRO 18 HB1 PRO 18 -12.842 -6.701 -6.622
106 1HG PRO 18 HG2 PRO 18 -10.108 -5.917 -5.765
107 2HG PRO 18 HG1 PRO 18 -11.597 -6.043 -4.815
108 1HD PRO 18 HD2 PRO 18 -9.624 -7.878 -4.664
109 2HD PRO 18 HD1 PRO 18 -11.336 -8.304 -4.469
110 H ILE 19 HN ILE 19 -8.832 -7.834 -7.697
111 HA ILE 19 HA ILE 19 -7.340 -7.916 -9.416
112 HB ILE 19 HB ILE 19 -9.669 -7.795 -11.287
113 1HG1 ILE 19 2HG1 ILE 19 -8.465 -10.306 -11.436
114 2HG1 ILE 19 1HG1 ILE 19 -8.540 -9.951 -9.713
115 1HG2 ILE 19 1HG2 ILE 19 -6.759 -7.850 -11.682
116 2HG2 ILE 19 2HG2 ILE 19 -8.035 -7.235 -12.733
117 3HG2 ILE 19 3HG2 ILE 19 -7.686 -8.963 -12.689
118 1HD1 ILE 19 1HD1 ILE 19 -10.803 -10.026 -9.658
119 2HD1 ILE 19 2HD1 ILE 19 -10.510 -11.144 -10.989
120 3HD1 ILE 19 3HD1 ILE 19 -10.976 -9.477 -11.324
121 HA PRO 20 HA PRO 20 -8.597 -3.274 -9.852
122 1HB PRO 20 HB2 PRO 20 -7.383 -2.295 -7.618
123 2HB PRO 20 HB1 PRO 20 -9.088 -2.751 -7.677
124 1HG PRO 20 HG2 PRO 20 -6.744 -4.307 -6.654
125 2HG PRO 20 HG1 PRO 20 -8.355 -4.112 -5.938
126 1HD PRO 20 HD2 PRO 20 -7.673 -6.323 -7.297
127 2HD PRO 20 HD1 PRO 20 -9.313 -5.654 -7.371
128 H ASP 21 HN ASP 21 -5.748 -5.021 -8.886
129 HA ASP 21 HA ASP 21 -3.626 -4.994 -9.742
130 1HB ASP 21 HB2 ASP 21 -5.056 -3.766 -11.754
131 2HB ASP 21 HB1 ASP 21 -3.810 -2.578 -11.379
132 H PHE 22 HN PHE 22 -2.187 -4.460 -8.283
133 1HB PHE 22 HB2 PHE 22 0.389 -1.722 -7.434
134 2HB PHE 22 HB1 PHE 22 0.407 -3.442 -7.814
135 HD1 PHE 22 HD1 PHE 22 -0.747 -4.132 -10.030
136 HD2 PHE 22 HD2 PHE 22 0.491 -0.164 -9.123
137 HE1 PHE 22 HE1 PHE 22 -0.737 -3.592 -12.431
138 HE2 PHE 22 HE2 PHE 22 0.502 0.386 -11.521
139 HZ PHE 22 HZ PHE 22 -0.113 -1.329 -13.178
140 H GLU 23 HN GLU 23 -3.800 -2.105 -6.319
141 HA GLU 23 HA GLU 23 -3.852 0.650 -7.054
142 1HB GLU 23 HB2 GLU 23 -5.649 -1.144 -5.485
143 2HB GLU 23 HB1 GLU 23 -5.866 0.597 -5.363
144 1HG GLU 23 HG2 GLU 23 -5.919 -0.999 -7.913
145 2HG GLU 23 HG1 GLU 23 -7.333 -0.406 -7.038
146 H ILE 24 HN ILE 24 -1.695 1.027 -6.013
147 HA ILE 24 HA ILE 24 -1.420 1.080 -3.201
148 HB ILE 24 HB ILE 24 0.073 2.814 -5.165
149 1HG1 ILE 24 2HG1 ILE 24 1.429 0.381 -4.323
150 2HG1 ILE 24 1HG1 ILE 24 -0.061 0.028 -5.193
151 1HG2 ILE 24 1HG2 ILE 24 0.170 2.997 -2.522
152 2HG2 ILE 24 2HG2 ILE 24 1.605 3.203 -3.528
153 3HG2 ILE 24 3HG2 ILE 24 1.305 1.661 -2.725
154 1HD1 ILE 24 1HD1 ILE 24 1.221 0.201 -7.009
155 2HD1 ILE 24 2HD1 ILE 24 2.474 1.107 -6.160
156 3HD1 ILE 24 3HD1 ILE 24 1.045 1.939 -6.773
157 H ALA 25 HN ALA 25 -1.591 3.880 -5.406
158 HA ALA 25 HA ALA 25 -2.455 5.969 -5.148
159 1HB ALA 25 HB1 ALA 25 -4.451 5.955 -3.354
160 2HB ALA 25 HB2 ALA 25 -4.348 4.227 -3.695
161 3HB ALA 25 HB3 ALA 25 -4.632 5.370 -5.008
162 H GLY 26 HN GLY 26 -0.221 5.120 -3.494
163 1HA GLY 26 HA2 GLY 26 0.697 7.062 -2.110
164 2HA GLY 26 HA1 GLY 26 -0.671 6.719 -1.060
165 H ALA 27 HN ALA 27 2.486 5.737 -2.073
166 HA ALA 27 HA ALA 27 2.621 3.208 -0.859
167 1HB ALA 27 HB1 ALA 27 4.594 3.210 -1.818
168 2HB ALA 27 HB2 ALA 27 5.161 4.489 -0.744
169 3HB ALA 27 HB3 ALA 27 4.362 4.899 -2.261
170 H THR 28 HN THR 28 2.216 6.190 0.610
171 HB THR 28 HB THR 28 4.041 7.421 3.638
172 HG1 THR 28 HG1 THR 28 4.859 6.484 1.096
173 1HG2 THR 28 1HG2 THR 28 5.025 5.543 4.539
174 2HG2 THR 28 2HG2 THR 28 6.180 6.047 3.305
175 3HG2 THR 28 3HG2 THR 28 5.084 4.702 2.990
176 H GLY 29 HN GLY 29 1.443 3.864 2.183
177 1HA GLY 29 HA2 GLY 29 1.161 3.034 4.917
178 2HA GLY 29 HA1 GLY 29 0.589 2.169 3.501
179 H LEU 30 HN LEU 30 3.459 2.390 2.432
180 HA LEU 30 HA LEU 30 4.305 -0.172 3.082
181 1HB LEU 30 HB2 LEU 30 5.904 2.196 2.115
182 2HB LEU 30 HB1 LEU 30 6.530 0.559 2.193
183 HG LEU 30 HG LEU 30 4.266 1.540 0.458
184 1HD1 LEU 30 1HD1 LEU 30 7.138 0.981 0.044
185 2HD1 LEU 30 2HD1 LEU 30 6.077 2.140 -0.757
186 3HD1 LEU 30 3HD1 LEU 30 6.031 0.438 -1.217
187 1HD2 LEU 30 1HD2 LEU 30 5.355 -1.241 0.859
188 2HD2 LEU 30 2HD2 LEU 30 4.287 -0.768 -0.461
189 3HD2 LEU 30 3HD2 LEU 30 3.720 -0.677 1.206
190 H PHE 31 HN PHE 31 4.749 2.818 4.782
191 1HB PHE 31 HB2 PHE 31 7.888 2.303 7.330
192 2HB PHE 31 HB1 PHE 31 7.663 1.159 6.013
193 HD1 PHE 31 HD1 PHE 31 9.218 4.119 6.931
194 HD2 PHE 31 HD2 PHE 31 7.135 2.356 3.666
195 HE1 PHE 31 HE1 PHE 31 10.291 5.710 5.391
196 HE2 PHE 31 HE2 PHE 31 8.203 3.944 2.122
197 HZ PHE 31 HZ PHE 31 9.786 5.624 2.983
198 H GLY 32 HN GLY 32 3.745 1.009 6.438
199 1HA GLY 32 HA2 GLY 32 3.817 0.233 9.226
200 2HA GLY 32 HA1 GLY 32 2.536 -0.113 8.077
201 H LEU 33 HN LEU 33 4.538 -1.231 6.150
202 HA LEU 33 HA LEU 33 4.601 -3.898 7.320
203 1HB LEU 33 HB2 LEU 33 4.612 -4.753 5.181
204 2HB LEU 33 HB1 LEU 33 3.643 -3.302 5.015
205 HG LEU 33 HG LEU 33 5.935 -2.220 4.306
206 1HD1 LEU 33 1HD1 LEU 33 6.802 -4.441 2.858
207 2HD1 LEU 33 2HD1 LEU 33 6.564 -5.022 4.507
208 3HD1 LEU 33 3HD1 LEU 33 7.629 -3.650 4.201
209 1HD2 LEU 33 1HD2 LEU 33 5.421 -3.180 1.928
210 2HD2 LEU 33 2HD2 LEU 33 4.260 -2.123 2.732
211 3HD2 LEU 33 3HD2 LEU 33 4.011 -3.869 2.732
212 H TRP 34 HN TRP 34 6.727 -1.405 7.311
213 HA TRP 34 HA TRP 34 9.051 -3.163 6.905
214 1HB TRP 34 HB2 TRP 34 8.644 -0.746 5.784
215 2HB TRP 34 HB1 TRP 34 9.491 -0.255 7.246
216 HD1 TRP 34 HD1 TRP 34 11.018 -3.409 6.698
217 HE1 TRP 34 HE1 TRP 34 13.157 -3.252 5.275
218 HE3 TRP 34 HE3 TRP 34 10.339 1.258 4.724
219 HZ2 TRP 34 HZ2 TRP 34 14.393 -1.396 3.545
220 HZ3 TRP 34 HZ3 TRP 34 12.046 2.150 3.193
221 HH2 TRP 34 HH2 TRP 34 14.031 0.850 2.617
222 H GLY 35 HN GLY 35 8.680 -0.224 8.899
223 1HA GLY 35 HA2 GLY 35 8.972 -1.725 11.345
224 2HA GLY 35 HA1 GLY 35 10.420 -0.843 10.888
Start of MODEL 8
1 3H ASN 1 HT3 ASN 1 9.540 1.019 12.474
2 HA ASN 1 HA ASN 1 8.188 1.445 10.287
3 1HB ASN 1 HB2 ASN 1 5.683 1.270 11.034
4 2HB ASN 1 HB1 ASN 1 6.517 -0.154 10.421
5 1HD2 ASN 1 1HD2 ASN 1 6.053 1.547 13.508
6 2HD2 ASN 1 2HD2 ASN 1 5.769 0.122 14.442
7 H LYS 2 HN LYS 2 8.351 3.579 10.283
8 HA LYS 2 HA LYS 2 8.023 5.106 12.712
9 1HB LYS 2 HB2 LYS 2 9.265 5.490 10.118
10 2HB LYS 2 HB1 LYS 2 8.325 6.898 10.590
11 1HG LYS 2 HG2 LYS 2 10.141 5.713 12.612
12 2HG LYS 2 HG1 LYS 2 10.860 6.605 11.269
13 1HD LYS 2 HD2 LYS 2 8.575 7.807 12.770
14 2HD LYS 2 HD1 LYS 2 10.190 7.840 13.482
15 1HE LYS 2 HE2 LYS 2 10.301 9.791 12.330
16 2HE LYS 2 HE1 LYS 2 10.804 8.704 11.036
17 1HZ LYS 2 HZ1 LYS 2 7.942 9.126 11.303
18 2HZ LYS 2 HZ2 LYS 2 8.896 9.020 9.911
19 3HZ LYS 2 HZ3 LYS 2 8.835 10.466 10.785
20 H GLY 3 HN GLY 3 5.648 4.101 12.493
21 1HA GLY 3 HA2 GLY 3 3.445 4.795 12.567
22 2HA GLY 3 HA1 GLY 3 3.962 6.364 11.970
23 H CYS 4 HN CYS 4 4.841 6.134 9.565
24 HA CYS 4 HA CYS 4 4.093 6.056 7.406
25 1HB CYS 4 HB2 CYS 4 4.086 3.226 8.374
26 2HB CYS 4 HB1 CYS 4 3.473 3.577 6.763
27 H ALA 5 HN ALA 5 2.052 6.694 9.417
28 HA ALA 5 HA ALA 5 -0.379 5.444 8.458
29 1HB ALA 5 HB1 ALA 5 -0.682 5.832 10.672
30 2HB ALA 5 HB2 ALA 5 -1.306 7.363 10.058
31 3HB ALA 5 HB3 ALA 5 0.343 7.267 10.675
32 H THR 6 HN THR 6 1.522 8.172 7.677
33 HA THR 6 HA THR 6 -0.425 9.981 6.785
34 HB THR 6 HB THR 6 1.429 10.880 5.338
35 HG1 THR 6 HG1 THR 6 3.426 9.911 5.483
36 1HG2 THR 6 1HG2 THR 6 1.746 10.457 8.263
37 2HG2 THR 6 2HG2 THR 6 1.481 11.946 7.356
38 3HG2 THR 6 3HG2 THR 6 3.069 11.179 7.347
39 H CYS 7 HN CYS 7 0.516 6.957 5.501
40 HA CYS 7 HA CYS 7 -1.275 7.319 3.253
41 1HB CYS 7 HB2 CYS 7 0.682 6.233 1.800
42 2HB CYS 7 HB1 CYS 7 0.485 7.975 1.942
43 H SER 8 HN SER 8 -1.571 5.717 5.487
44 HA SER 8 HA SER 8 -0.633 3.127 5.404
45 1HB SER 8 HB2 SER 8 -3.519 3.383 6.004
46 2HB SER 8 HB1 SER 8 -2.225 2.675 6.969
47 HG SER 8 HG SER 8 -2.101 4.479 8.017
48 H ILE 9 HN ILE 9 -3.001 4.682 3.388
49 HA ILE 9 HA ILE 9 -3.979 2.280 2.164
50 HB ILE 9 HB ILE 9 -4.307 5.213 1.646
51 1HG1 ILE 9 2HG1 ILE 9 -5.709 3.969 3.303
52 2HG1 ILE 9 1HG1 ILE 9 -6.636 4.746 2.023
53 1HG2 ILE 9 1HG2 ILE 9 -4.229 4.725 -0.572
54 2HG2 ILE 9 2HG2 ILE 9 -5.915 4.315 -0.257
55 3HG2 ILE 9 3HG2 ILE 9 -4.698 3.041 -0.336
56 1HD1 ILE 9 1HD1 ILE 9 -7.202 2.741 1.041
57 2HD1 ILE 9 2HD1 ILE 9 -7.223 2.339 2.757
58 3HD1 ILE 9 3HD1 ILE 9 -5.841 1.883 1.760
59 H GLY 10 HN GLY 10 -2.165 1.157 1.393
60 1HA GLY 10 HA2 GLY 10 -1.320 1.776 -1.221
61 2HA GLY 10 HA1 GLY 10 -0.068 2.272 -0.095
62 H ALA 11 HN ALA 11 -0.443 0.167 1.800
63 HA ALA 11 HA ALA 11 1.036 -1.900 0.435
64 1HB ALA 11 HB1 ALA 11 0.568 -2.798 3.012
65 2HB ALA 11 HB2 ALA 11 0.638 -1.042 3.174
66 3HB ALA 11 HB3 ALA 11 1.988 -1.916 2.446
67 H ALA 12 HN ALA 12 -1.490 -1.781 -0.635
68 HA ALA 12 HA ALA 12 -2.376 -4.448 -0.420
69 1HB ALA 12 HB1 ALA 12 -3.598 -4.160 1.462
70 2HB ALA 12 HB2 ALA 12 -4.774 -3.493 0.329
71 3HB ALA 12 HB3 ALA 12 -3.716 -2.414 1.240
72 H CYS 13 HN CYS 13 -2.270 -4.418 -2.651
73 HA CYS 13 HA CYS 13 -3.359 -2.389 -4.284
74 1HB CYS 13 HB2 CYS 13 -2.349 -5.154 -4.732
75 2HB CYS 13 HB1 CYS 13 -3.362 -4.437 -5.982
76 H LEU 14 HN LEU 14 -4.622 -5.485 -3.170
77 HA LEU 14 HA LEU 14 -6.766 -6.232 -2.953
78 1HB LEU 14 HB2 LEU 14 -7.687 -3.647 -4.205
79 2HB LEU 14 HB1 LEU 14 -8.660 -4.789 -3.301
80 HG LEU 14 HG LEU 14 -6.410 -3.147 -2.137
81 1HD1 LEU 14 1HD1 LEU 14 -7.978 -1.527 -2.425
82 2HD1 LEU 14 2HD1 LEU 14 -8.562 -2.207 -0.905
83 3HD1 LEU 14 3HD1 LEU 14 -9.321 -2.670 -2.429
84 1HD2 LEU 14 1HD2 LEU 14 -8.464 -4.405 -0.436
85 2HD2 LEU 14 2HD2 LEU 14 -6.735 -4.188 -0.162
86 3HD2 LEU 14 3HD2 LEU 14 -7.306 -5.499 -1.194
87 H VAL 15 HN VAL 15 -5.021 -5.812 -5.595
88 HA VAL 15 HA VAL 15 -6.808 -6.211 -7.752
89 HB VAL 15 HB VAL 15 -4.535 -5.432 -8.128
90 1HG1 VAL 15 1HG1 VAL 15 -3.756 -7.239 -6.280
91 2HG1 VAL 15 2HG1 VAL 15 -2.662 -6.459 -7.421
92 3HG1 VAL 15 3HG1 VAL 15 -3.289 -8.071 -7.763
93 1HG2 VAL 15 1HG2 VAL 15 -5.813 -6.795 -9.852
94 2HG2 VAL 15 2HG2 VAL 15 -4.764 -8.142 -9.409
95 3HG2 VAL 15 3HG2 VAL 15 -4.069 -6.666 -10.080
96 H ASP 16 HN ASP 16 -6.109 -8.172 -5.173
97 HA ASP 16 HA ASP 16 -6.409 -10.674 -6.646
98 1HB ASP 16 HB2 ASP 16 -4.820 -9.991 -4.523
99 2HB ASP 16 HB1 ASP 16 -6.186 -10.754 -3.709
100 H GLY 17 HN GLY 17 -8.531 -8.660 -6.302
101 1HA GLY 17 HA2 GLY 17 -10.668 -10.429 -5.596
102 2HA GLY 17 HA1 GLY 17 -10.451 -9.137 -4.421
103 HA PRO 18 HA PRO 18 -13.071 -6.466 -6.782
104 1HB PRO 18 HB2 PRO 18 -11.550 -4.125 -6.556
105 2HB PRO 18 HB1 PRO 18 -12.799 -4.663 -5.432
106 1HG PRO 18 HG2 PRO 18 -9.836 -4.933 -5.244
107 2HG PRO 18 HG1 PRO 18 -11.026 -4.664 -3.960
108 1HD PRO 18 HD2 PRO 18 -9.893 -7.062 -4.340
109 2HD PRO 18 HD1 PRO 18 -11.588 -6.907 -3.837
110 H ILE 19 HN ILE 19 -9.614 -6.488 -7.386
111 HA ILE 19 HA ILE 19 -8.491 -6.787 -9.351
112 HB ILE 19 HB ILE 19 -10.985 -6.078 -10.823
113 1HG1 ILE 19 2HG1 ILE 19 -10.053 -8.654 -9.622
114 2HG1 ILE 19 1HG1 ILE 19 -11.671 -7.961 -9.641
115 1HG2 ILE 19 1HG2 ILE 19 -8.407 -6.316 -11.734
116 2HG2 ILE 19 2HG2 ILE 19 -9.858 -6.480 -12.720
117 3HG2 ILE 19 3HG2 ILE 19 -9.081 -7.913 -12.050
118 1HD1 ILE 19 1HD1 ILE 19 -11.532 -9.940 -11.035
119 2HD1 ILE 19 2HD1 ILE 19 -10.252 -9.190 -11.989
120 3HD1 ILE 19 3HD1 ILE 19 -11.879 -8.508 -12.005
121 HA PRO 20 HA PRO 20 -8.830 -2.015 -9.704
122 1HB PRO 20 HB2 PRO 20 -7.401 -1.154 -7.587
123 2HB PRO 20 HB1 PRO 20 -9.144 -1.438 -7.493
124 1HG PRO 20 HG2 PRO 20 -6.891 -3.210 -6.629
125 2HG PRO 20 HG1 PRO 20 -8.392 -2.817 -5.773
126 1HD PRO 20 HD2 PRO 20 -8.063 -5.123 -7.151
127 2HD PRO 20 HD1 PRO 20 -9.633 -4.316 -7.006
128 H ASP 21 HN ASP 21 -6.356 -4.306 -8.944
129 HA ASP 21 HA ASP 21 -4.319 -4.684 -9.908
130 1HB ASP 21 HB2 ASP 21 -5.560 -3.116 -11.803
131 2HB ASP 21 HB1 ASP 21 -4.084 -2.216 -11.464
132 H PHE 22 HN PHE 22 -2.891 -4.504 -8.307
133 1HB PHE 22 HB2 PHE 22 0.145 -2.058 -7.730
134 2HB PHE 22 HB1 PHE 22 0.052 -3.791 -8.024
135 HD1 PHE 22 HD1 PHE 22 0.148 -4.530 -10.187
136 HD2 PHE 22 HD2 PHE 22 -1.270 -0.592 -9.421
137 HE1 PHE 22 HE1 PHE 22 -0.005 -4.120 -12.607
138 HE2 PHE 22 HE2 PHE 22 -1.427 -0.174 -11.840
139 HZ PHE 22 HZ PHE 22 -0.794 -1.939 -13.437
140 H GLU 23 HN GLU 23 -3.974 -2.171 -6.311
141 HA GLU 23 HA GLU 23 -3.985 0.543 -6.869
142 1HB GLU 23 HB2 GLU 23 -5.882 0.692 -5.592
143 2HB GLU 23 HB1 GLU 23 -5.831 -1.040 -5.872
144 1HG GLU 23 HG2 GLU 23 -6.297 -0.936 -3.633
145 2HG GLU 23 HG1 GLU 23 -4.545 -1.104 -3.621
146 H ILE 24 HN ILE 24 -2.537 2.024 -6.343
147 HA ILE 24 HA ILE 24 -0.918 1.700 -3.949
148 HB ILE 24 HB ILE 24 -0.751 3.866 -6.049
149 1HG1 ILE 24 2HG1 ILE 24 1.428 2.273 -6.426
150 2HG1 ILE 24 1HG1 ILE 24 0.210 1.081 -5.983
151 1HG2 ILE 24 1HG2 ILE 24 0.976 4.737 -4.925
152 2HG2 ILE 24 2HG2 ILE 24 1.643 3.151 -4.537
153 3HG2 ILE 24 3HG2 ILE 24 0.354 3.831 -3.546
154 1HD1 ILE 24 1HD1 ILE 24 -1.114 1.578 -7.827
155 2HD1 ILE 24 2HD1 ILE 24 0.533 1.633 -8.458
156 3HD1 ILE 24 3HD1 ILE 24 -0.323 3.131 -8.095
157 H ALA 25 HN ALA 25 -2.278 4.691 -5.322
158 HA ALA 25 HA ALA 25 -3.216 6.512 -4.335
159 1HB ALA 25 HB1 ALA 25 -5.094 6.100 -2.902
160 2HB ALA 25 HB2 ALA 25 -4.505 4.481 -2.522
161 3HB ALA 25 HB3 ALA 25 -5.057 4.858 -4.153
162 H GLY 26 HN GLY 26 -0.618 5.695 -3.312
163 1HA GLY 26 HA2 GLY 26 0.414 7.236 -1.657
164 2HA GLY 26 HA1 GLY 26 -0.856 6.733 -0.553
165 H ALA 27 HN ALA 27 2.191 5.942 -1.967
166 HA ALA 27 HA ALA 27 2.389 3.261 -1.080
167 1HB ALA 27 HB1 ALA 27 4.174 3.327 -2.352
168 2HB ALA 27 HB2 ALA 27 4.968 4.427 -1.227
169 3HB ALA 27 HB3 ALA 27 3.982 5.069 -2.541
170 H THR 28 HN THR 28 2.314 6.104 0.693
171 HB THR 28 HB THR 28 4.733 6.876 3.471
172 HG1 THR 28 HG1 THR 28 5.253 5.823 0.898
173 1HG2 THR 28 1HG2 THR 28 6.553 5.116 2.871
174 2HG2 THR 28 2HG2 THR 28 5.177 4.012 2.810
175 3HG2 THR 28 3HG2 THR 28 5.528 4.902 4.291
176 H GLY 29 HN GLY 29 1.634 3.704 2.069
177 1HA GLY 29 HA2 GLY 29 1.192 2.775 4.708
178 2HA GLY 29 HA1 GLY 29 0.784 1.918 3.232
179 H LEU 30 HN LEU 30 3.579 1.941 2.283
180 HA LEU 30 HA LEU 30 4.400 -0.540 3.208
181 1HB LEU 30 HB2 LEU 30 6.102 1.667 2.047
182 2HB LEU 30 HB1 LEU 30 6.586 -0.014 2.189
183 HG LEU 30 HG LEU 30 4.389 1.099 0.443
184 1HD1 LEU 30 1HD1 LEU 30 5.804 0.076 -1.350
185 2HD1 LEU 30 2HD1 LEU 30 7.052 -0.182 -0.131
186 3HD1 LEU 30 3HD1 LEU 30 6.534 1.456 -0.529
187 1HD2 LEU 30 1HD2 LEU 30 3.661 -1.020 1.375
188 2HD2 LEU 30 2HD2 LEU 30 5.192 -1.769 0.921
189 3HD2 LEU 30 3HD2 LEU 30 4.078 -1.216 -0.327
190 H PHE 31 HN PHE 31 4.827 2.572 4.644
191 1HB PHE 31 HB2 PHE 31 8.025 2.631 7.066
192 2HB PHE 31 HB1 PHE 31 7.861 1.138 6.150
193 HD1 PHE 31 HD1 PHE 31 8.218 4.781 5.915
194 HD2 PHE 31 HD2 PHE 31 8.061 1.109 3.769
195 HE1 PHE 31 HE1 PHE 31 9.073 5.921 3.908
196 HE2 PHE 31 HE2 PHE 31 8.916 2.241 1.759
197 HZ PHE 31 HZ PHE 31 9.424 4.650 1.828
198 H GLY 32 HN GLY 32 3.841 0.975 6.537
199 1HA GLY 32 HA2 GLY 32 4.221 0.169 9.308
200 2HA GLY 32 HA1 GLY 32 2.765 -0.046 8.350
201 H LEU 33 HN LEU 33 4.648 -1.205 6.183
202 HA LEU 33 HA LEU 33 4.484 -3.932 7.203
203 1HB LEU 33 HB2 LEU 33 4.925 -2.813 4.441
204 2HB LEU 33 HB1 LEU 33 5.013 -4.526 4.804
205 HG LEU 33 HG LEU 33 2.595 -2.737 4.968
206 1HD1 LEU 33 1HD1 LEU 33 1.673 -4.389 3.389
207 2HD1 LEU 33 2HD1 LEU 33 3.236 -5.209 3.367
208 3HD1 LEU 33 3HD1 LEU 33 3.095 -3.561 2.753
209 1HD2 LEU 33 1HD2 LEU 33 1.403 -4.830 5.693
210 2HD2 LEU 33 2HD2 LEU 33 2.455 -4.103 6.908
211 3HD2 LEU 33 3HD2 LEU 33 2.988 -5.530 6.020
212 H TRP 34 HN TRP 34 6.625 -2.009 8.019
213 HA TRP 34 HA TRP 34 8.906 -3.709 7.274
214 1HB TRP 34 HB2 TRP 34 8.580 -0.971 6.625
215 2HB TRP 34 HB1 TRP 34 9.815 -1.056 7.877
216 HD1 TRP 34 HD1 TRP 34 10.116 -0.477 4.579
217 HE1 TRP 34 HE1 TRP 34 11.957 -1.804 3.364
218 HE3 TRP 34 HE3 TRP 34 10.772 -4.252 7.967
219 HZ2 TRP 34 HZ2 TRP 34 13.483 -4.141 3.784
220 HZ3 TRP 34 HZ3 TRP 34 12.442 -5.994 7.483
221 HH2 TRP 34 HH2 TRP 34 13.769 -5.937 5.434
222 H GLY 35 HN GLY 35 8.573 -0.902 9.434
223 1HA GLY 35 HA2 GLY 35 8.181 -1.830 11.873
224 2HA GLY 35 HA1 GLY 35 9.784 -2.482 11.574
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