NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
21959 |
2imu   |
15108 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H PHE 1 1H PHE 1 25.620 9.328 6.664
2 2H PHE 1 2H PHE 1 25.855 10.732 5.768
3 3H PHE 1 3H PHE 1 24.782 10.730 7.063
4 HA PHE 1 HA PHE 1 23.302 9.156 5.858
5 1HB PHE 1 2HB PHE 1 24.047 11.471 4.045
6 2HB PHE 1 1HB PHE 1 22.430 10.893 4.513
7 HD1 PHE 1 HD1 PHE 1 21.997 10.955 7.171
8 HD2 PHE 1 HD2 PHE 1 24.818 13.429 5.038
9 HE1 PHE 1 HE1 PHE 1 21.954 12.608 9.030
10 HE2 PHE 1 HE2 PHE 1 24.767 15.084 6.896
11 HZ PHE 1 HZ PHE 1 23.342 14.670 8.894
12 H GLY 2 H GLY 2 22.824 8.595 3.448
13 1HA GLY 2 1HA GLY 2 24.272 8.272 1.296
14 2HA GLY 2 2HA GLY 2 25.430 7.466 2.393
15 H PHE 3 H PHE 3 24.738 5.504 3.498
16 HA PHE 3 HA PHE 3 23.338 3.666 1.773
17 1HB PHE 3 1HB PHE 3 24.041 3.817 4.733
18 2HB PHE 3 2HB PHE 3 23.122 2.424 4.110
19 HD1 PHE 3 HD1 PHE 3 26.389 3.947 4.437
20 HD2 PHE 3 HD2 PHE 3 24.087 1.125 2.126
21 HE1 PHE 3 HE1 PHE 3 28.494 2.930 3.582
22 HE2 PHE 3 HE2 PHE 3 26.192 0.109 1.269
23 HZ PHE 3 HZ PHE 3 28.396 1.010 1.999
24 H LYS 4 H LYS 4 22.139 5.176 4.831
25 HA LYS 4 HA LYS 4 19.441 4.188 4.525
26 1HB LYS 4 1HB LYS 4 20.768 6.603 5.844
27 2HB LYS 4 2HB LYS 4 19.008 6.397 5.936
28 1HG LYS 4 1HG LYS 4 19.829 3.885 6.629
29 2HG LYS 4 2HG LYS 4 21.181 4.854 7.263
30 1HD LYS 4 1HD LYS 4 19.417 6.369 8.354
31 2HD LYS 4 2HD LYS 4 18.214 5.137 7.924
32 1HE LYS 4 1HE LYS 4 20.590 4.924 9.747
33 2HE LYS 4 2HE LYS 4 18.830 4.647 10.104
34 1HZ LYS 4 1HZ LYS 4 20.509 3.025 8.217
35 2HZ LYS 4 2HZ LYS 4 20.034 2.488 9.738
36 3HZ LYS 4 3HZ LYS 4 18.880 2.768 8.548
37 H ASP 5 H ASP 5 21.138 6.817 2.904
38 HA ASP 5 HA ASP 5 18.623 8.068 1.990
39 1HB ASP 5 1HB ASP 5 21.563 8.231 1.132
40 2HB ASP 5 2HB ASP 5 20.295 9.271 0.442
41 HD2 ASP 5 HD2 ASP 5 20.408 11.291 3.296
42 H ILE 6 H ILE 6 21.087 5.846 0.629
43 HA ILE 6 HA ILE 6 19.753 5.636 -1.935
44 HB ILE 6 HB ILE 6 21.446 3.578 -0.382
45 1HG1 ILE 6 1HG1 ILE 6 22.088 6.218 -1.362
46 2HG1 ILE 6 2HG1 ILE 6 23.157 5.040 -0.560
47 1HG2 ILE 6 1HG2 ILE 6 21.052 3.999 -3.378
48 2HG2 ILE 6 2HG2 ILE 6 22.131 2.799 -2.629
49 3HG2 ILE 6 3HG2 ILE 6 20.369 2.664 -2.420
50 1HD1 ILE 6 1HD1 ILE 6 22.481 5.091 -3.537
51 2HD1 ILE 6 2HD1 ILE 6 24.015 5.630 -2.814
52 3HD1 ILE 6 3HD1 ILE 6 23.549 3.914 -2.735
53 H ILE 7 H ILE 7 19.566 3.784 1.131
54 HA ILE 7 HA ILE 7 17.708 1.799 0.238
55 HB ILE 7 HB ILE 7 18.076 3.293 2.905
56 1HG1 ILE 7 1HG1 ILE 7 19.090 0.630 1.821
57 2HG1 ILE 7 2HG1 ILE 7 20.062 2.076 2.194
58 1HG2 ILE 7 1HG2 ILE 7 16.590 0.685 2.370
59 2HG2 ILE 7 2HG2 ILE 7 16.914 1.391 3.971
60 3HG2 ILE 7 3HG2 ILE 7 15.839 2.232 2.829
61 1HD1 ILE 7 1HD1 ILE 7 18.444 0.449 4.208
62 2HD1 ILE 7 2HD1 ILE 7 20.213 0.404 4.023
63 3HD1 ILE 7 3HD1 ILE 7 19.415 1.893 4.581
64 H ARG 8 H ARG 8 17.179 5.137 1.467
65 HA ARG 8 HA ARG 8 14.300 5.001 1.438
66 1HB ARG 8 1HB ARG 8 16.492 7.023 1.427
67 2HB ARG 8 2HB ARG 8 15.002 7.622 0.660
68 1HG ARG 8 1HG ARG 8 13.701 7.153 2.649
69 2HG ARG 8 2HG ARG 8 15.055 6.279 3.398
70 1HD ARG 8 1HD ARG 8 14.909 9.201 2.695
71 2HD ARG 8 2HD ARG 8 14.891 8.446 4.354
72 HE ARG 8 HE ARG 8 17.231 7.380 3.343
73 1HH1 ARG 8 1HH2 ARG 8 17.069 9.716 1.271
74 2HH1 ARG 8 2HH2 ARG 8 18.159 10.907 2.029
75 1HH2 ARG 8 2HH1 ARG 8 18.097 9.304 5.187
76 2HH2 ARG 8 1HH1 ARG 8 18.741 10.674 4.243
77 H ALA 9 H ALA 9 16.669 5.919 -1.105
78 HA ALA 9 HA ALA 9 14.690 6.515 -3.122
79 1HB ALA 9 1HB ALA 9 17.490 5.251 -3.335
80 2HB ALA 9 2HB ALA 9 16.639 6.058 -4.674
81 3HB ALA 9 3HB ALA 9 17.161 6.998 -3.256
82 H ILE 10 H ILE 10 16.376 3.471 -2.263
83 HA ILE 10 HA ILE 10 15.081 1.898 -4.320
84 HB ILE 10 HB ILE 10 15.973 1.078 -1.489
85 1HG1 ILE 10 1HG1 ILE 10 17.480 2.260 -3.634
86 2HG1 ILE 10 2HG1 ILE 10 18.081 1.624 -2.083
87 1HG2 ILE 10 1HG2 ILE 10 15.886 -0.472 -4.114
88 2HG2 ILE 10 2HG2 ILE 10 16.486 -1.092 -2.558
89 3HG2 ILE 10 3HG2 ILE 10 14.764 -0.681 -2.748
90 1HD1 ILE 10 1HD1 ILE 10 17.562 -0.022 -4.600
91 2HD1 ILE 10 2HD1 ILE 10 19.162 0.471 -3.996
92 3HD1 ILE 10 3HD1 ILE 10 18.163 -0.658 -3.050
93 H ARG 11 H ARG 11 14.187 2.699 -0.949
94 HA ARG 11 HA ARG 11 11.801 1.037 -0.911
95 1HB ARG 11 1HB ARG 11 13.205 2.950 0.721
96 2HB ARG 11 2HB ARG 11 11.526 3.528 0.599
97 1HG ARG 11 1HG ARG 11 12.333 0.688 1.383
98 2HG ARG 11 2HG ARG 11 11.874 1.963 2.534
99 1HD ARG 11 1HD ARG 11 10.194 0.861 0.286
100 2HD ARG 11 2HD ARG 11 10.012 0.513 2.063
101 HE ARG 11 HE ARG 11 10.013 3.365 1.858
102 1HH1 ARG 11 2HH1 ARG 11 8.652 2.542 -0.856
103 2HH1 ARG 11 1HH1 ARG 11 6.930 2.658 -0.404
104 1HH2 ARG 11 1HH2 ARG 11 7.608 2.662 3.079
105 2HH2 ARG 11 2HH2 ARG 11 6.338 2.727 1.827
106 H ARG 12 H ARG 12 12.538 4.118 -2.423
107 HA ARG 12 HA ARG 12 9.594 4.657 -2.822
108 1HB ARG 12 1HB ARG 12 12.223 6.095 -3.015
109 2HB ARG 12 2HB ARG 12 11.012 6.581 -4.219
110 1HG ARG 12 1HG ARG 12 9.875 6.298 -1.519
111 2HG ARG 12 2HG ARG 12 11.171 7.515 -1.599
112 1HD ARG 12 1HD ARG 12 8.846 8.327 -2.067
113 2HD ARG 12 2HD ARG 12 10.112 8.693 -3.322
114 HE ARG 12 HE ARG 12 8.290 6.230 -3.578
115 1HH1 ARG 12 1HH2 ARG 12 8.000 9.409 -4.552
116 2HH1 ARG 12 2HH2 ARG 12 8.136 9.119 -6.307
117 1HH2 ARG 12 2HH1 ARG 12 9.207 5.762 -5.908
118 2HH2 ARG 12 1HH1 ARG 12 8.819 7.054 -7.075
119 H ILE 13 H ILE 13 12.446 3.482 -4.566
120 HA ILE 13 HA ILE 13 10.972 3.708 -7.144
121 HB ILE 13 HB ILE 13 13.538 3.928 -6.706
122 1HG1 ILE 13 1HG1 ILE 13 12.128 3.054 -8.925
123 2HG1 ILE 13 2HG1 ILE 13 13.853 3.498 -8.900
124 1HG2 ILE 13 1HG2 ILE 13 13.281 0.898 -6.575
125 2HG2 ILE 13 2HG2 ILE 13 14.802 1.820 -6.631
126 3HG2 ILE 13 3HG2 ILE 13 13.727 1.962 -5.220
127 1HD1 ILE 13 1HD1 ILE 13 12.727 0.703 -8.405
128 2HD1 ILE 13 2HD1 ILE 13 13.527 1.249 -9.898
129 3HD1 ILE 13 3HD1 ILE 13 14.450 1.147 -8.380
130 H ALA 14 H ALA 14 11.657 1.324 -4.624
131 HA ALA 14 HA ALA 14 10.501 -0.879 -6.318
132 1HB ALA 14 1HB ALA 14 11.414 -0.708 -3.390
133 2HB ALA 14 2HB ALA 14 11.035 -2.213 -4.259
134 3HB ALA 14 3HB ALA 14 12.437 -1.233 -4.748
135 H VAL 15 H VAL 15 9.091 1.685 -4.743
136 HA VAL 15 HA VAL 15 7.166 0.555 -2.977
137 HB VAL 15 HB VAL 15 6.724 2.611 -5.210
138 1HG1 VAL 15 1HG1 VAL 15 5.328 2.203 -2.528
139 2HG1 VAL 15 2HG1 VAL 15 5.002 3.521 -3.678
140 3HG1 VAL 15 3HG1 VAL 15 4.634 1.838 -4.125
141 1HG2 VAL 15 1HG2 VAL 15 8.689 3.145 -3.796
142 2HG2 VAL 15 2HG2 VAL 15 7.353 4.281 -3.496
143 3HG2 VAL 15 3HG2 VAL 15 7.684 2.971 -2.337
144 HA PRO 16 HA PRO 16 4.410 -0.780 -6.601
145 1HB PRO 16 1HB PRO 16 5.553 -1.112 -9.030
146 2HB PRO 16 2HB PRO 16 4.732 0.424 -8.488
147 1HG PRO 16 1HG PRO 16 7.651 -0.270 -8.678
148 2HG PRO 16 2HG PRO 16 6.821 1.285 -9.070
149 1HD PRO 16 1HD PRO 16 8.190 0.861 -6.675
150 2HD PRO 16 2HD PRO 16 6.836 1.979 -6.830
151 H VAL 17 H VAL 17 7.857 -1.691 -6.918
152 HA VAL 17 HA VAL 17 7.281 -4.440 -7.651
153 HB VAL 17 HB VAL 17 9.611 -3.365 -5.957
154 1HG1 VAL 17 1HG1 VAL 17 9.448 -5.546 -8.084
155 2HG1 VAL 17 2HG1 VAL 17 10.915 -5.064 -7.198
156 3HG1 VAL 17 3HG1 VAL 17 9.556 -5.815 -6.328
157 1HG2 VAL 17 1HG2 VAL 17 9.188 -1.841 -7.872
158 2HG2 VAL 17 2HG2 VAL 17 10.700 -2.751 -8.098
159 3HG2 VAL 17 3HG2 VAL 17 9.232 -3.229 -8.984
160 H VAL 18 H VAL 18 7.787 -2.824 -4.492
161 HA VAL 18 HA VAL 18 7.568 -5.210 -2.880
162 HB VAL 18 HB VAL 18 6.697 -2.294 -2.394
163 1HG1 VAL 18 1HG1 VAL 18 7.461 -4.484 -0.418
164 2HG1 VAL 18 2HG1 VAL 18 7.086 -2.793 -0.010
165 3HG1 VAL 18 3HG1 VAL 18 5.819 -3.848 -0.680
166 1HG2 VAL 18 1HG2 VAL 18 9.053 -2.528 -3.148
167 2HG2 VAL 18 2HG2 VAL 18 8.969 -2.031 -1.442
168 3HG2 VAL 18 3HG2 VAL 18 9.344 -3.720 -1.860
169 H SER 19 H SER 19 5.023 -2.854 -3.882
170 HA SER 19 HA SER 19 2.835 -4.276 -2.596
171 1HB SER 19 1HB SER 19 2.771 -2.774 -5.253
172 2HB SER 19 2HB SER 19 1.518 -2.808 -3.984
173 HG SER 19 HG SER 19 4.103 -1.476 -3.988
174 H THR 20 H THR 20 4.560 -4.952 -5.618
175 HA THR 20 HA THR 20 2.391 -6.943 -6.342
176 HB THR 20 HB THR 20 5.008 -6.372 -7.796
177 HG1 THR 20 HG1 THR 20 4.446 -4.302 -7.848
178 1HG2 THR 20 1HG2 THR 20 3.586 -6.763 -9.784
179 2HG2 THR 20 2HG2 THR 20 3.500 -8.139 -8.659
180 3HG2 THR 20 3HG2 THR 20 2.165 -6.965 -8.731
181 H LEU 21 H LEU 21 5.649 -6.824 -4.964
182 HA LEU 21 HA LEU 21 5.917 -9.800 -5.398
183 1HB LEU 21 1HB LEU 21 7.612 -7.455 -4.561
184 2HB LEU 21 2HB LEU 21 8.060 -9.027 -3.864
185 HG LEU 21 HG LEU 21 9.271 -8.625 -5.989
186 1HD1 LEU 21 1HD1 LEU 21 7.093 -10.748 -6.226
187 2HD1 LEU 21 2HD1 LEU 21 8.620 -10.719 -7.139
188 3HD1 LEU 21 3HD1 LEU 21 8.643 -10.943 -5.374
189 1HD2 LEU 21 1HD2 LEU 21 7.581 -7.150 -7.049
190 2HD2 LEU 21 2HD2 LEU 21 8.004 -8.512 -8.114
191 3HD2 LEU 21 3HD2 LEU 21 6.473 -8.534 -7.206
192 H PHE 22 H PHE 22 5.164 -7.453 -2.859
193 HA PHE 22 HA PHE 22 5.239 -9.676 -0.848
194 1HB PHE 22 1HB PHE 22 4.741 -6.648 -0.811
195 2HB PHE 22 2HB PHE 22 4.527 -7.639 0.649
196 HD1 PHE 22 HD1 PHE 22 6.364 -8.086 2.028
197 HD2 PHE 22 HD2 PHE 22 7.028 -6.910 -2.069
198 HE1 PHE 22 HE1 PHE 22 8.815 -7.996 2.450
199 HE2 PHE 22 HE2 PHE 22 9.478 -6.822 -1.646
200 HZ PHE 22 HZ PHE 22 10.372 -7.361 0.615
201 HA PRO 23 HA PRO 23 0.923 -10.351 -1.990
202 1HB PRO 23 1HB PRO 23 0.590 -12.343 -0.240
203 2HB PRO 23 2HB PRO 23 1.341 -12.518 -1.895
204 1HG PRO 23 1HG PRO 23 2.605 -12.311 0.820
205 2HG PRO 23 2HG PRO 23 3.007 -13.439 -0.550
206 1HD PRO 23 1HD PRO 23 4.521 -11.158 -0.119
207 2HD PRO 23 2HD PRO 23 4.173 -11.731 -1.748
208 HA PRO 24 HA PRO 24 -0.575 -9.309 2.290
209 1HB PRO 24 1HB PRO 24 1.132 -8.241 4.097
210 2HB PRO 24 2HB PRO 24 0.804 -10.023 3.959
211 1HG PRO 24 1HG PRO 24 3.203 -8.433 3.165
212 2HG PRO 24 2HG PRO 24 3.085 -10.161 3.637
213 1HD PRO 24 1HD PRO 24 3.181 -9.098 0.921
214 2HD PRO 24 2HD PRO 24 2.804 -10.819 1.399
215 H ALA 25 H ALA 25 2.084 -7.379 0.963
216 HA ALA 25 HA ALA 25 0.759 -4.831 1.827
217 1HB ALA 25 1HB ALA 25 3.070 -5.484 -0.093
218 2HB ALA 25 2HB ALA 25 2.686 -3.862 0.529
219 3HB ALA 25 3HB ALA 25 3.254 -5.130 1.641
220 H ALA 26 H ALA 26 -1.274 -5.883 0.613
221 HA ALA 26 HA ALA 26 -1.637 -4.176 -1.757
222 1HB ALA 26 1HB ALA 26 -1.329 -7.204 -2.144
223 2HB ALA 26 2HB ALA 26 -1.820 -6.052 -3.409
224 3HB ALA 26 3HB ALA 26 -0.181 -5.972 -2.719
225 HA PRO 27 HA PRO 27 -5.553 -6.794 -1.204
226 1HB PRO 27 1HB PRO 27 -5.525 -8.781 0.625
227 2HB PRO 27 2HB PRO 27 -5.139 -9.007 -1.145
228 1HG PRO 27 1HG PRO 27 -3.325 -8.763 1.240
229 2HG PRO 27 2HG PRO 27 -3.206 -9.892 -0.173
230 1HD PRO 27 1HD PRO 27 -1.683 -7.575 -0.026
231 2HD PRO 27 2HD PRO 27 -2.259 -8.227 -1.559
232 H LEU 28 H LEU 28 -3.428 -6.289 1.590
233 HA LEU 28 HA LEU 28 -5.614 -5.915 3.469
234 1HB LEU 28 1HB LEU 28 -2.792 -4.705 3.299
235 2HB LEU 28 2HB LEU 28 -3.807 -4.661 4.757
236 HG LEU 28 HG LEU 28 -2.631 -7.102 3.368
237 1HD1 LEU 28 1HD1 LEU 28 -2.503 -6.040 6.226
238 2HD1 LEU 28 2HD1 LEU 28 -1.702 -7.512 5.627
239 3HD1 LEU 28 3HD1 LEU 28 -1.205 -5.917 5.014
240 1HD2 LEU 28 1HD2 LEU 28 -5.007 -7.552 3.922
241 2HD2 LEU 28 2HD2 LEU 28 -3.915 -8.465 4.991
242 3HD2 LEU 28 3HD2 LEU 28 -4.723 -6.996 5.589
243 H ALA 29 H ALA 29 -3.787 -3.673 1.330
244 HA ALA 29 HA ALA 29 -5.125 -1.293 2.138
245 1HB ALA 29 1HB ALA 29 -4.269 -2.245 -0.670
246 2HB ALA 29 2HB ALA 29 -4.530 -0.541 -0.228
247 3HB ALA 29 3HB ALA 29 -3.197 -1.459 0.513
248 H HIS 30 H HIS 30 -6.053 -3.927 -0.026
249 HA HIS 30 HA HIS 30 -8.418 -2.811 -1.179
250 1HB HIS 30 1HB HIS 30 -7.057 -5.265 -1.040
251 2HB HIS 30 2HB HIS 30 -8.544 -5.641 -0.146
252 HD1 HIS 30 HD1 HIS 30 -7.186 -4.994 -3.571
253 HD2 HIS 30 HD2 HIS 30 -10.970 -5.340 -1.716
254 HE1 HIS 30 HE1 HIS 30 -8.929 -5.288 -5.433
255 H ALA 31 H ALA 31 -8.038 -4.640 1.891
256 HA ALA 31 HA ALA 31 -10.818 -4.416 2.687
257 1HB ALA 31 1HB ALA 31 -8.226 -4.466 4.334
258 2HB ALA 31 2HB ALA 31 -9.840 -4.888 4.953
259 3HB ALA 31 3HB ALA 31 -9.071 -5.903 3.711
260 H ILE 32 H ILE 32 -8.142 -2.104 2.844
261 HA ILE 32 HA ILE 32 -9.787 -0.328 4.635
262 HB ILE 32 HB ILE 32 -7.209 0.394 3.179
263 1HG1 ILE 32 1HG1 ILE 32 -7.637 -1.840 5.066
264 2HG1 ILE 32 2HG1 ILE 32 -6.256 -1.503 3.991
265 1HG2 ILE 32 1HG2 ILE 32 -8.262 0.932 5.991
266 2HG2 ILE 32 2HG2 ILE 32 -6.745 1.566 5.308
267 3HG2 ILE 32 3HG2 ILE 32 -8.309 2.076 4.628
268 1HD1 ILE 32 1HD1 ILE 32 -6.821 -0.118 6.653
269 2HD1 ILE 32 2HD1 ILE 32 -5.581 -1.365 6.378
270 3HD1 ILE 32 3HD1 ILE 32 -5.442 0.220 5.579
271 H GLY 33 H GLY 33 -8.923 -0.659 1.211
272 1HA GLY 33 1HA GLY 33 -10.061 2.049 0.635
273 2HA GLY 33 2HA GLY 33 -9.435 0.895 -0.561
274 H GLU 34 H GLU 34 -11.015 -1.381 0.371
275 HA GLU 34 HA GLU 34 -13.728 -0.374 -0.627
276 1HB GLU 34 1HB GLU 34 -12.772 -3.247 -0.748
277 2HB GLU 34 2HB GLU 34 -13.806 -2.363 -1.896
278 1HG GLU 34 1HG GLU 34 -11.548 -0.904 -2.141
279 2HG GLU 34 2HG GLU 34 -10.828 -2.475 -1.689
280 HE2 GLU 34 HE2 GLU 34 -12.744 -3.715 -4.669
281 H GLY 35 H GLY 35 -12.048 -2.346 1.802
282 1HA GLY 35 1HA GLY 35 -14.348 -3.661 2.873
283 2HA GLY 35 2HA GLY 35 -12.923 -3.163 3.834
284 H VAL 36 H VAL 36 -13.020 -0.385 3.579
285 HA VAL 36 HA VAL 36 -14.968 0.316 5.573
286 HB VAL 36 HB VAL 36 -14.403 2.679 4.759
287 1HG1 VAL 36 1HG1 VAL 36 -12.067 0.727 5.003
288 2HG1 VAL 36 2HG1 VAL 36 -11.978 2.486 5.258
289 3HG1 VAL 36 3HG1 VAL 36 -12.941 1.474 6.361
290 1HG2 VAL 36 1HG2 VAL 36 -14.253 2.153 2.342
291 2HG2 VAL 36 2HG2 VAL 36 -12.746 2.893 2.932
292 3HG2 VAL 36 3HG2 VAL 36 -12.824 1.137 2.651
293 H ASP 37 H ASP 37 -15.096 0.604 1.995
294 HA ASP 37 HA ASP 37 -17.720 1.847 1.966
295 1HB ASP 37 1HB ASP 37 -16.361 1.838 -0.050
296 2HB ASP 37 2HB ASP 37 -16.090 0.079 0.065
297 HD2 ASP 37 HD2 ASP 37 -19.180 -0.534 -1.528
298 H TYR 38 H TYR 38 -16.616 -1.540 1.813
299 HA TYR 38 HA TYR 38 -19.201 -2.753 1.460
300 1HB TYR 38 1HB TYR 38 -16.697 -3.662 1.584
301 2HB TYR 38 2HB TYR 38 -17.041 -3.840 3.322
302 HD1 TYR 38 HD1 TYR 38 -19.168 -5.146 3.990
303 HD2 TYR 38 HD2 TYR 38 -17.417 -5.292 0.053
304 HE1 TYR 38 HE1 TYR 38 -20.378 -7.270 3.533
305 HE2 TYR 38 HE2 TYR 38 -18.626 -7.418 -0.406
306 HH TYR 38 HH TYR 38 -21.247 -8.451 1.112
307 H LEU 39 H LEU 39 -17.553 -1.601 4.407
308 HA LEU 39 HA LEU 39 -19.812 -2.594 6.099
309 1HB LEU 39 1HB LEU 39 -17.139 -1.229 6.372
310 2HB LEU 39 2HB LEU 39 -18.311 -0.917 7.674
311 HG LEU 39 HG LEU 39 -18.578 -3.341 8.047
312 1HD1 LEU 39 1HD1 LEU 39 -16.517 -3.627 5.818
313 2HD1 LEU 39 2HD1 LEU 39 -17.165 -4.951 6.814
314 3HD1 LEU 39 3HD1 LEU 39 -18.238 -4.068 5.703
315 1HD2 LEU 39 1HD2 LEU 39 -16.748 -2.155 9.229
316 2HD2 LEU 39 2HD2 LEU 39 -16.294 -3.837 8.864
317 3HD2 LEU 39 3HD2 LEU 39 -15.648 -2.506 7.875
318 H LEU 40 H LEU 40 -18.800 0.419 4.540
319 HA LEU 40 HA LEU 40 -20.768 2.024 6.104
320 1HB LEU 40 1HB LEU 40 -18.480 2.634 4.847
321 2HB LEU 40 2HB LEU 40 -19.541 2.792 3.427
322 HG LEU 40 HG LEU 40 -21.008 4.213 5.195
323 1HD1 LEU 40 1HD1 LEU 40 -18.111 4.581 6.082
324 2HD1 LEU 40 2HD1 LEU 40 -19.495 5.562 6.619
325 3HD1 LEU 40 3HD1 LEU 40 -19.406 3.838 7.051
326 1HD2 LEU 40 1HD2 LEU 40 -20.165 4.998 3.001
327 2HD2 LEU 40 2HD2 LEU 40 -19.937 6.239 4.256
328 3HD2 LEU 40 3HD2 LEU 40 -18.555 5.258 3.712
329 H GLY 41 H GLY 41 -20.611 0.467 2.911
330 1HA GLY 41 1HA GLY 41 -23.077 -0.269 2.385
331 2HA GLY 41 2HA GLY 41 -23.390 1.502 2.427
332 H ASP 42 H ASP 42 -22.659 -1.058 0.360
333 HA ASP 42 HA ASP 42 -20.784 0.443 -1.439
334 1HB ASP 42 1HB ASP 42 -20.840 -1.610 -2.673
335 2HB ASP 42 2HB ASP 42 -21.064 -2.134 -0.985
336 HD2 ASP 42 HD2 ASP 42 -24.024 -2.827 -3.453
337 H GLU 43 H GLU 43 -23.588 1.517 -0.781
338 HA GLU 43 HA GLU 43 -24.724 1.443 -3.574
339 1HB GLU 43 1HB GLU 43 -25.637 2.706 -0.923
340 2HB GLU 43 2HB GLU 43 -26.623 2.629 -2.403
341 1HG GLU 43 1HG GLU 43 -27.401 0.724 -1.326
342 2HG GLU 43 2HG GLU 43 -26.032 0.017 -2.214
343 HE2 GLU 43 HE2 GLU 43 -25.145 -0.996 1.066
344 H ALA 44 H ALA 44 -22.221 3.008 -2.271
345 HA ALA 44 HA ALA 44 -21.223 5.108 -2.721
346 1HB ALA 44 1HB ALA 44 -23.363 5.068 -4.927
347 2HB ALA 44 2HB ALA 44 -21.926 6.117 -4.924
348 3HB ALA 44 3HB ALA 44 -21.739 4.352 -5.058
349 H GLN 45 H GLN 45 -22.892 7.358 -4.017
350 HA GLN 45 HA GLN 45 -24.547 7.957 -1.535
351 1HB GLN 45 1HB GLN 45 -23.105 10.093 -3.164
352 2HB GLN 45 2HB GLN 45 -23.495 10.105 -1.432
353 1HG GLN 45 1HG GLN 45 -21.835 8.136 -1.231
354 2HG GLN 45 2HG GLN 45 -21.286 8.607 -2.863
355 1HE2 GLN 45 2HE2 GLN 45 -22.180 10.334 0.230
356 2HE2 GLN 45 1HE2 GLN 45 -20.765 11.419 0.183
357 H ALA 46 H ALA 46 -26.623 7.896 -2.225
358 HA ALA 46 HA ALA 46 -27.282 9.696 -4.479
359 1HB ALA 46 1HB ALA 46 -28.536 7.814 -5.670
360 2HB ALA 46 2HB ALA 46 -26.790 7.491 -5.547
361 3HB ALA 46 3HB ALA 46 -27.925 6.686 -4.437
Start of MODEL 2
1 1H PHE 1 1H PHE 1 27.063 12.612 1.862
2 2H PHE 1 2H PHE 1 28.120 11.697 2.795
3 3H PHE 1 3H PHE 1 28.518 12.081 1.207
4 HA PHE 1 HA PHE 1 26.643 10.693 0.386
5 1HB PHE 1 2HB PHE 1 27.901 8.722 0.689
6 2HB PHE 1 1HB PHE 1 29.122 9.948 1.093
7 HD1 PHE 1 HD1 PHE 1 27.328 7.072 2.243
8 HD2 PHE 1 HD2 PHE 1 29.286 10.670 3.598
9 HE1 PHE 1 HE1 PHE 1 27.529 6.104 4.527
10 HE2 PHE 1 HE2 PHE 1 29.487 9.698 5.880
11 HZ PHE 1 HZ PHE 1 28.606 7.418 6.346
12 H GLY 2 H GLY 2 25.405 8.643 1.279
13 1HA GLY 2 1HA GLY 2 24.580 8.708 4.051
14 2HA GLY 2 2HA GLY 2 23.423 9.667 3.083
15 H PHE 3 H PHE 3 24.951 6.443 3.412
16 HA PHE 3 HA PHE 3 23.533 5.093 1.328
17 1HB PHE 3 1HB PHE 3 24.247 4.211 4.186
18 2HB PHE 3 2HB PHE 3 23.838 3.088 2.868
19 HD1 PHE 3 HD1 PHE 3 26.537 3.742 4.593
20 HD2 PHE 3 HD2 PHE 3 25.171 4.460 0.564
21 HE1 PHE 3 HE1 PHE 3 28.896 3.815 3.803
22 HE2 PHE 3 HE2 PHE 3 27.530 4.526 -0.223
23 HZ PHE 3 HZ PHE 3 29.392 4.207 1.397
24 H LYS 4 H LYS 4 22.475 5.873 4.657
25 HA LYS 4 HA LYS 4 20.009 4.450 4.706
26 1HB LYS 4 1HB LYS 4 20.964 7.173 5.700
27 2HB LYS 4 2HB LYS 4 19.292 6.660 6.015
28 1HG LYS 4 1HG LYS 4 20.338 4.467 6.927
29 2HG LYS 4 2HG LYS 4 21.874 5.368 6.950
30 1HD LYS 4 1HD LYS 4 20.750 7.151 8.335
31 2HD LYS 4 2HD LYS 4 19.291 6.143 8.392
32 1HE LYS 4 1HE LYS 4 22.014 5.626 9.537
33 2HE LYS 4 2HE LYS 4 20.397 5.679 10.366
34 1HZ LYS 4 1HZ LYS 4 21.238 3.673 8.298
35 2HZ LYS 4 2HZ LYS 4 21.122 3.327 9.939
36 3HZ LYS 4 3HZ LYS 4 19.741 3.723 9.064
37 H ASP 5 H ASP 5 20.651 7.658 3.182
38 HA ASP 5 HA ASP 5 17.861 7.917 2.313
39 1HB ASP 5 1HB ASP 5 20.025 9.542 2.466
40 2HB ASP 5 2HB ASP 5 20.102 9.115 0.726
41 HD2 ASP 5 HD2 ASP 5 16.820 10.625 0.323
42 H ILE 6 H ILE 6 20.833 6.579 0.863
43 HA ILE 6 HA ILE 6 19.712 6.140 -1.737
44 HB ILE 6 HB ILE 6 21.631 4.309 -0.165
45 1HG1 ILE 6 1HG1 ILE 6 21.891 7.123 -1.045
46 2HG1 ILE 6 2HG1 ILE 6 22.865 6.204 0.127
47 1HG2 ILE 6 1HG2 ILE 6 21.460 5.016 -3.128
48 2HG2 ILE 6 2HG2 ILE 6 22.668 3.943 -2.382
49 3HG2 ILE 6 3HG2 ILE 6 20.950 3.476 -2.398
50 1HD1 ILE 6 1HD1 ILE 6 23.084 6.008 -2.912
51 2HD1 ILE 6 2HD1 ILE 6 24.224 6.857 -1.842
52 3HD1 ILE 6 3HD1 ILE 6 24.058 5.089 -1.739
53 H ILE 7 H ILE 7 19.644 4.214 1.286
54 HA ILE 7 HA ILE 7 18.216 1.970 0.181
55 HB ILE 7 HB ILE 7 17.905 3.201 2.990
56 1HG1 ILE 7 1HG1 ILE 7 20.298 2.185 1.613
57 2HG1 ILE 7 2HG1 ILE 7 20.164 3.072 3.151
58 1HG2 ILE 7 1HG2 ILE 7 17.942 0.311 2.017
59 2HG2 ILE 7 2HG2 ILE 7 17.747 0.840 3.705
60 3HG2 ILE 7 3HG2 ILE 7 16.493 1.225 2.502
61 1HD1 ILE 7 1HD1 ILE 7 19.636 0.091 2.763
62 2HD1 ILE 7 2HD1 ILE 7 21.088 0.798 3.511
63 3HD1 ILE 7 3HD1 ILE 7 19.502 0.977 4.300
64 H ARG 8 H ARG 8 17.133 5.076 1.623
65 HA ARG 8 HA ARG 8 14.311 4.531 1.480
66 1HB ARG 8 1HB ARG 8 16.050 7.053 1.188
67 2HB ARG 8 2HB ARG 8 14.278 7.158 1.238
68 1HG ARG 8 1HG ARG 8 14.167 6.481 3.477
69 2HG ARG 8 2HG ARG 8 15.703 5.601 3.399
70 1HD ARG 8 1HD ARG 8 15.425 7.965 4.590
71 2HD ARG 8 2HD ARG 8 16.953 7.430 3.775
72 HE ARG 8 HE ARG 8 16.185 8.725 1.701
73 1HH1 ARG 8 1HH2 ARG 8 13.334 8.855 3.237
74 2HH1 ARG 8 2HH2 ARG 8 13.237 10.620 3.479
75 1HH2 ARG 8 2HH1 ARG 8 16.660 11.147 2.716
76 2HH2 ARG 8 1HH1 ARG 8 15.121 11.919 3.184
77 H ALA 9 H ALA 9 16.607 5.870 -0.921
78 HA ALA 9 HA ALA 9 14.644 6.402 -2.970
79 1HB ALA 9 1HB ALA 9 17.548 5.400 -3.160
80 2HB ALA 9 2HB ALA 9 16.664 6.211 -4.475
81 3HB ALA 9 3HB ALA 9 17.064 7.105 -2.988
82 H ILE 10 H ILE 10 16.569 3.466 -2.246
83 HA ILE 10 HA ILE 10 15.430 1.948 -4.454
84 HB ILE 10 HB ILE 10 16.447 0.960 -1.726
85 1HG1 ILE 10 1HG1 ILE 10 17.793 2.556 -3.708
86 2HG1 ILE 10 2HG1 ILE 10 18.463 1.845 -2.220
87 1HG2 ILE 10 1HG2 ILE 10 16.550 -0.269 -4.516
88 2HG2 ILE 10 2HG2 ILE 10 17.226 -0.990 -3.035
89 3HG2 ILE 10 3HG2 ILE 10 15.466 -0.776 -3.198
90 1HD1 ILE 10 1HD1 ILE 10 18.176 0.418 -4.903
91 2HD1 ILE 10 2HD1 ILE 10 19.694 1.047 -4.220
92 3HD1 ILE 10 3HD1 ILE 10 18.845 -0.294 -3.416
93 H ARG 11 H ARG 11 14.513 2.359 -1.011
94 HA ARG 11 HA ARG 11 12.364 0.431 -1.122
95 1HB ARG 11 1HB ARG 11 13.528 2.139 0.753
96 2HB ARG 11 2HB ARG 11 11.950 2.920 0.509
97 1HG ARG 11 1HG ARG 11 12.462 0.030 1.357
98 2HG ARG 11 2HG ARG 11 11.713 1.313 2.325
99 1HD ARG 11 1HD ARG 11 10.644 0.228 -0.275
100 2HD ARG 11 2HD ARG 11 10.096 -0.258 1.389
101 HE ARG 11 HE ARG 11 10.032 2.691 0.547
102 1HH1 ARG 11 2HH1 ARG 11 7.650 1.044 -0.473
103 2HH1 ARG 11 1HH1 ARG 11 6.474 1.242 0.855
104 1HH2 ARG 11 1HH2 ARG 11 8.930 2.326 3.176
105 2HH2 ARG 11 2HH2 ARG 11 7.200 1.970 2.924
106 H ARG 12 H ARG 12 12.624 3.865 -1.991
107 HA ARG 12 HA ARG 12 9.743 4.182 -2.514
108 1HB ARG 12 1HB ARG 12 12.350 5.615 -3.208
109 2HB ARG 12 2HB ARG 12 10.803 6.191 -3.877
110 1HG ARG 12 1HG ARG 12 10.179 5.830 -1.204
111 2HG ARG 12 2HG ARG 12 11.865 6.393 -1.119
112 1HD ARG 12 1HD ARG 12 9.585 7.687 -2.601
113 2HD ARG 12 2HD ARG 12 10.347 8.245 -1.042
114 HE ARG 12 HE ARG 12 12.498 8.665 -2.315
115 1HH1 ARG 12 1HH2 ARG 12 10.031 10.069 -3.790
116 2HH1 ARG 12 2HH2 ARG 12 10.479 9.744 -5.486
117 1HH2 ARG 12 2HH1 ARG 12 12.872 7.270 -4.626
118 2HH2 ARG 12 1HH1 ARG 12 12.089 8.159 -5.960
119 H ILE 13 H ILE 13 12.610 3.610 -4.632
120 HA ILE 13 HA ILE 13 10.993 3.515 -7.056
121 HB ILE 13 HB ILE 13 13.527 3.814 -6.835
122 1HG1 ILE 13 1HG1 ILE 13 12.055 2.509 -8.825
123 2HG1 ILE 13 2HG1 ILE 13 13.706 3.161 -8.979
124 1HG2 ILE 13 1HG2 ILE 13 13.438 0.824 -6.298
125 2HG2 ILE 13 2HG2 ILE 13 14.902 1.802 -6.549
126 3HG2 ILE 13 3HG2 ILE 13 13.884 2.079 -5.117
127 1HD1 ILE 13 1HD1 ILE 13 12.985 0.345 -8.045
128 2HD1 ILE 13 2HD1 ILE 13 13.627 0.771 -9.649
129 3HD1 ILE 13 3HD1 ILE 13 14.633 0.995 -8.200
130 H ALA 14 H ALA 14 11.745 1.129 -4.539
131 HA ALA 14 HA ALA 14 10.575 -1.077 -6.229
132 1HB ALA 14 1HB ALA 14 11.539 -0.911 -3.319
133 2HB ALA 14 2HB ALA 14 11.159 -2.416 -4.190
134 3HB ALA 14 3HB ALA 14 12.541 -1.417 -4.701
135 H VAL 15 H VAL 15 9.267 1.439 -4.414
136 HA VAL 15 HA VAL 15 7.298 0.245 -2.734
137 HB VAL 15 HB VAL 15 7.294 2.603 -4.672
138 1HG1 VAL 15 1HG1 VAL 15 5.099 1.835 -2.699
139 2HG1 VAL 15 2HG1 VAL 15 5.180 3.352 -3.627
140 3HG1 VAL 15 3HG1 VAL 15 4.958 1.802 -4.472
141 1HG2 VAL 15 1HG2 VAL 15 8.702 2.734 -2.630
142 2HG2 VAL 15 2HG2 VAL 15 7.354 3.893 -2.558
143 3HG2 VAL 15 3HG2 VAL 15 7.276 2.377 -1.628
144 HA PRO 16 HA PRO 16 4.368 -0.509 -6.420
145 1HB PRO 16 1HB PRO 16 5.494 -0.764 -8.856
146 2HB PRO 16 2HB PRO 16 4.794 0.788 -8.198
147 1HG PRO 16 1HG PRO 16 7.646 -0.136 -8.415
148 2HG PRO 16 2HG PRO 16 6.947 1.503 -8.742
149 1HD PRO 16 1HD PRO 16 8.241 0.913 -6.353
150 2HD PRO 16 2HD PRO 16 6.908 2.063 -6.446
151 H VAL 17 H VAL 17 7.674 -1.753 -7.166
152 HA VAL 17 HA VAL 17 6.734 -4.403 -7.886
153 HB VAL 17 HB VAL 17 9.352 -3.715 -6.446
154 1HG1 VAL 17 1HG1 VAL 17 8.672 -5.611 -8.739
155 2HG1 VAL 17 2HG1 VAL 17 10.283 -5.392 -8.014
156 3HG1 VAL 17 3HG1 VAL 17 8.959 -6.089 -7.049
157 1HG2 VAL 17 1HG2 VAL 17 8.891 -1.949 -8.133
158 2HG2 VAL 17 2HG2 VAL 17 10.244 -2.986 -8.642
159 3HG2 VAL 17 3HG2 VAL 17 8.635 -3.201 -9.371
160 H VAL 18 H VAL 18 7.687 -3.001 -4.720
161 HA VAL 18 HA VAL 18 7.472 -5.472 -3.271
162 HB VAL 18 HB VAL 18 6.871 -2.538 -2.544
163 1HG1 VAL 18 1HG1 VAL 18 7.399 -4.904 -0.699
164 2HG1 VAL 18 2HG1 VAL 18 7.227 -3.206 -0.194
165 3HG1 VAL 18 3HG1 VAL 18 5.840 -4.071 -0.897
166 1HG2 VAL 18 1HG2 VAL 18 9.172 -2.997 -3.353
167 2HG2 VAL 18 2HG2 VAL 18 9.169 -2.586 -1.621
168 3HG2 VAL 18 3HG2 VAL 18 9.342 -4.282 -2.133
169 H SER 19 H SER 19 5.047 -2.996 -4.150
170 HA SER 19 HA SER 19 2.826 -4.290 -2.752
171 1HB SER 19 1HB SER 19 2.858 -2.613 -5.315
172 2HB SER 19 2HB SER 19 1.529 -2.728 -4.130
173 HG SER 19 HG SER 19 4.205 -1.632 -3.681
174 H THR 20 H THR 20 4.434 -4.992 -5.823
175 HA THR 20 HA THR 20 2.099 -6.712 -6.651
176 HB THR 20 HB THR 20 4.416 -7.074 -8.296
177 HG1 THR 20 HG1 THR 20 5.508 -5.230 -8.305
178 1HG2 THR 20 1HG2 THR 20 3.156 -5.668 -9.900
179 2HG2 THR 20 2HG2 THR 20 2.075 -6.816 -9.074
180 3HG2 THR 20 3HG2 THR 20 2.101 -5.105 -8.581
181 H LEU 21 H LEU 21 5.381 -7.037 -5.300
182 HA LEU 21 HA LEU 21 5.030 -10.067 -5.451
183 1HB LEU 21 1HB LEU 21 7.300 -8.067 -5.178
184 2HB LEU 21 2HB LEU 21 7.540 -9.723 -4.578
185 HG LEU 21 HG LEU 21 6.697 -10.514 -6.886
186 1HD1 LEU 21 1HD1 LEU 21 7.300 -7.594 -7.531
187 2HD1 LEU 21 2HD1 LEU 21 6.946 -8.871 -8.719
188 3HD1 LEU 21 3HD1 LEU 21 5.691 -8.353 -7.568
189 1HD2 LEU 21 1HD2 LEU 21 9.077 -10.582 -6.197
190 2HD2 LEU 21 2HD2 LEU 21 8.919 -10.166 -7.920
191 3HD2 LEU 21 3HD2 LEU 21 9.279 -8.896 -6.727
192 H PHE 22 H PHE 22 4.592 -7.476 -3.252
193 HA PHE 22 HA PHE 22 4.760 -9.531 -1.019
194 1HB PHE 22 1HB PHE 22 6.214 -7.046 -1.443
195 2HB PHE 22 2HB PHE 22 5.138 -6.826 -0.047
196 HD1 PHE 22 HD1 PHE 22 6.587 -6.933 1.806
197 HD2 PHE 22 HD2 PHE 22 6.797 -9.966 -1.254
198 HE1 PHE 22 HE1 PHE 22 8.152 -8.257 3.221
199 HE2 PHE 22 HE2 PHE 22 8.361 -11.286 0.161
200 HZ PHE 22 HZ PHE 22 9.038 -10.432 2.399
201 HA PRO 23 HA PRO 23 0.484 -8.432 -0.583
202 1HB PRO 23 1HB PRO 23 0.180 -9.637 1.781
203 2HB PRO 23 2HB PRO 23 0.212 -10.502 0.173
204 1HG PRO 23 1HG PRO 23 2.338 -10.187 2.271
205 2HG PRO 23 2HG PRO 23 1.873 -11.667 1.325
206 1HD PRO 23 1HD PRO 23 4.067 -10.135 0.594
207 2HD PRO 23 2HD PRO 23 3.050 -10.931 -0.604
208 HA PRO 24 HA PRO 24 1.096 -6.033 3.426
209 1HB PRO 24 1HB PRO 24 3.570 -5.033 3.894
210 2HB PRO 24 2HB PRO 24 2.931 -6.577 4.623
211 1HG PRO 24 1HG PRO 24 4.835 -6.136 2.345
212 2HG PRO 24 2HG PRO 24 4.854 -7.415 3.618
213 1HD PRO 24 1HD PRO 24 3.796 -7.783 0.980
214 2HD PRO 24 2HD PRO 24 3.246 -8.746 2.435
215 H ALA 25 H ALA 25 3.021 -5.547 0.516
216 HA ALA 25 HA ALA 25 2.434 -2.587 0.664
217 1HB ALA 25 1HB ALA 25 3.995 -4.342 -1.320
218 2HB ALA 25 2HB ALA 25 3.966 -2.563 -1.340
219 3HB ALA 25 3HB ALA 25 4.716 -3.424 0.024
220 H ALA 26 H ALA 26 1.229 -5.530 -0.680
221 HA ALA 26 HA ALA 26 0.098 -4.766 -3.179
222 1HB ALA 26 1HB ALA 26 -1.182 -6.288 -0.848
223 2HB ALA 26 2HB ALA 26 -1.672 -6.413 -2.555
224 3HB ALA 26 3HB ALA 26 -0.069 -6.992 -2.044
225 HA PRO 27 HA PRO 27 -3.622 -2.703 -0.940
226 1HB PRO 27 1HB PRO 27 -3.044 -1.509 1.402
227 2HB PRO 27 2HB PRO 27 -3.765 -3.179 1.235
228 1HG PRO 27 1HG PRO 27 -0.936 -2.310 1.757
229 2HG PRO 27 2HG PRO 27 -1.889 -3.635 2.553
230 1HD PRO 27 1HD PRO 27 -0.077 -4.204 0.540
231 2HD PRO 27 2HD PRO 27 -1.579 -5.107 0.710
232 H LEU 28 H LEU 28 -0.261 -1.617 -0.749
233 HA LEU 28 HA LEU 28 -0.953 1.211 -0.825
234 1HB LEU 28 1HB LEU 28 1.432 -0.526 -1.558
235 2HB LEU 28 2HB LEU 28 1.454 1.185 -2.041
236 HG LEU 28 HG LEU 28 0.565 0.853 0.735
237 1HD1 LEU 28 1HD1 LEU 28 3.357 -0.119 -0.016
238 2HD1 LEU 28 2HD1 LEU 28 2.762 0.157 1.638
239 3HD1 LEU 28 3HD1 LEU 28 2.047 -1.131 0.639
240 1HD2 LEU 28 1HD2 LEU 28 1.312 2.978 -0.302
241 2HD2 LEU 28 2HD2 LEU 28 2.334 2.550 1.090
242 3HD2 LEU 28 3HD2 LEU 28 2.927 2.281 -0.567
243 H ALA 29 H ALA 29 -0.275 -1.262 -3.350
244 HA ALA 29 HA ALA 29 -0.540 0.439 -5.605
245 1HB ALA 29 1HB ALA 29 -1.623 -2.414 -5.140
246 2HB ALA 29 2HB ALA 29 -1.309 -1.713 -6.746
247 3HB ALA 29 3HB ALA 29 0.042 -2.020 -5.629
248 H HIS 30 H HIS 30 -2.950 -1.028 -3.472
249 HA HIS 30 HA HIS 30 -5.312 -0.402 -4.944
250 1HB HIS 30 1HB HIS 30 -4.644 -1.451 -2.482
251 2HB HIS 30 2HB HIS 30 -5.218 0.158 -1.971
252 HD1 HIS 30 HD1 HIS 30 -6.357 -3.120 -3.480
253 HD2 HIS 30 HD2 HIS 30 -8.005 0.638 -2.451
254 HE1 HIS 30 HE1 HIS 30 -8.911 -3.341 -3.609
255 H ALA 31 H ALA 31 -3.572 1.570 -2.491
256 HA ALA 31 HA ALA 31 -5.231 3.933 -2.855
257 1HB ALA 31 1HB ALA 31 -2.273 3.598 -2.080
258 2HB ALA 31 2HB ALA 31 -3.259 5.037 -1.732
259 3HB ALA 31 3HB ALA 31 -3.643 3.486 -0.951
260 H ILE 32 H ILE 32 -2.407 2.678 -4.599
261 HA ILE 32 HA ILE 32 -1.891 5.154 -6.078
262 HB ILE 32 HB ILE 32 -1.435 2.211 -6.851
263 1HG1 ILE 32 1HG1 ILE 32 -0.425 3.752 -4.626
264 2HG1 ILE 32 2HG1 ILE 32 -0.040 2.075 -5.086
265 1HG2 ILE 32 1HG2 ILE 32 0.069 4.758 -7.589
266 2HG2 ILE 32 2HG2 ILE 32 0.506 3.106 -8.086
267 3HG2 ILE 32 3HG2 ILE 32 -1.007 3.838 -8.667
268 1HD1 ILE 32 1HD1 ILE 32 1.262 4.583 -6.244
269 2HD1 ILE 32 2HD1 ILE 32 2.006 3.483 -5.059
270 3HD1 ILE 32 3HD1 ILE 32 1.647 2.908 -6.705
271 H GLY 33 H GLY 33 -4.508 2.919 -6.203
272 1HA GLY 33 1HA GLY 33 -6.381 3.751 -7.673
273 2HA GLY 33 2HA GLY 33 -5.157 4.036 -8.948
274 H GLU 34 H GLU 34 -3.743 1.481 -7.982
275 HA GLU 34 HA GLU 34 -4.862 -0.306 -9.947
276 1HB GLU 34 1HB GLU 34 -3.430 -1.086 -7.345
277 2HB GLU 34 2HB GLU 34 -3.336 -1.921 -8.909
278 1HG GLU 34 1HG GLU 34 -2.421 0.374 -9.790
279 2HG GLU 34 2HG GLU 34 -2.094 0.698 -8.066
280 HE2 GLU 34 HE2 GLU 34 -0.190 -2.564 -9.314
281 H GLY 35 H GLY 35 -5.843 0.370 -6.634
282 1HA GLY 35 1HA GLY 35 -7.313 -2.113 -6.250
283 2HA GLY 35 2HA GLY 35 -7.625 -0.574 -5.400
284 H VAL 36 H VAL 36 -8.319 1.147 -7.449
285 HA VAL 36 HA VAL 36 -11.031 0.223 -7.992
286 HB VAL 36 HB VAL 36 -9.867 2.660 -7.791
287 1HG1 VAL 36 1HG1 VAL 36 -9.834 2.159 -10.787
288 2HG1 VAL 36 2HG1 VAL 36 -9.531 3.711 -9.969
289 3HG1 VAL 36 3HG1 VAL 36 -8.400 2.354 -9.752
290 1HG2 VAL 36 1HG2 VAL 36 -12.293 2.228 -7.996
291 2HG2 VAL 36 2HG2 VAL 36 -11.788 3.623 -8.978
292 3HG2 VAL 36 3HG2 VAL 36 -12.107 2.056 -9.757
293 H ASP 37 H ASP 37 -8.037 0.522 -9.910
294 HA ASP 37 HA ASP 37 -9.162 -0.285 -12.436
295 1HB ASP 37 1HB ASP 37 -6.929 0.416 -12.600
296 2HB ASP 37 2HB ASP 37 -6.495 -0.318 -11.032
297 HD2 ASP 37 HD2 ASP 37 -6.410 -2.772 -14.190
298 H TYR 38 H TYR 38 -7.892 -2.173 -9.678
299 HA TYR 38 HA TYR 38 -8.175 -4.737 -10.991
300 1HB TYR 38 1HB TYR 38 -6.967 -4.217 -8.816
301 2HB TYR 38 2HB TYR 38 -8.548 -3.952 -8.039
302 HD1 TYR 38 HD1 TYR 38 -6.360 -6.483 -9.678
303 HD2 TYR 38 HD2 TYR 38 -9.945 -5.790 -7.385
304 HE1 TYR 38 HE1 TYR 38 -6.566 -8.928 -9.263
305 HE2 TYR 38 HE2 TYR 38 -10.150 -8.234 -6.966
306 HH TYR 38 HH TYR 38 -8.503 -10.590 -8.758
307 H LEU 39 H LEU 39 -10.377 -2.843 -8.888
308 HA LEU 39 HA LEU 39 -12.569 -4.749 -8.992
309 1HB LEU 39 1HB LEU 39 -12.058 -1.863 -8.335
310 2HB LEU 39 2HB LEU 39 -13.741 -2.234 -8.768
311 HG LEU 39 HG LEU 39 -13.916 -3.882 -7.012
312 1HD1 LEU 39 1HD1 LEU 39 -10.934 -3.435 -6.563
313 2HD1 LEU 39 2HD1 LEU 39 -11.989 -4.486 -5.588
314 3HD1 LEU 39 3HD1 LEU 39 -11.668 -4.883 -7.293
315 1HD2 LEU 39 1HD2 LEU 39 -14.114 -1.517 -6.293
316 2HD2 LEU 39 2HD2 LEU 39 -13.409 -2.524 -5.005
317 3HD2 LEU 39 3HD2 LEU 39 -12.363 -1.466 -5.982
318 H LEU 40 H LEU 40 -11.566 -2.120 -11.181
319 HA LEU 40 HA LEU 40 -13.973 -2.749 -12.909
320 1HB LEU 40 1HB LEU 40 -12.060 -0.510 -12.423
321 2HB LEU 40 2HB LEU 40 -12.437 -0.764 -14.142
322 HG LEU 40 HG LEU 40 -14.817 -0.527 -13.727
323 1HD1 LEU 40 1HD1 LEU 40 -14.066 -0.357 -10.777
324 2HD1 LEU 40 2HD1 LEU 40 -15.702 -0.155 -11.448
325 3HD1 LEU 40 3HD1 LEU 40 -14.881 -1.729 -11.562
326 1HD2 LEU 40 1HD2 LEU 40 -13.522 1.576 -13.915
327 2HD2 LEU 40 2HD2 LEU 40 -14.907 1.771 -12.816
328 3HD2 LEU 40 3HD2 LEU 40 -13.267 1.576 -12.153
329 H GLY 41 H GLY 41 -11.260 -4.353 -12.473
330 1HA GLY 41 1HA GLY 41 -10.299 -4.300 -15.310
331 2HA GLY 41 2HA GLY 41 -9.629 -5.284 -13.985
332 H ASP 42 H ASP 42 -12.435 -6.172 -13.214
333 HA ASP 42 HA ASP 42 -12.555 -8.388 -15.284
334 1HB ASP 42 1HB ASP 42 -13.954 -9.458 -13.513
335 2HB ASP 42 2HB ASP 42 -12.437 -8.856 -12.806
336 HD2 ASP 42 HD2 ASP 42 -14.220 -6.354 -11.036
337 H GLU 43 H GLU 43 -13.702 -5.469 -15.499
338 HA GLU 43 HA GLU 43 -16.596 -6.213 -15.818
339 1HB GLU 43 1HB GLU 43 -15.222 -3.620 -16.659
340 2HB GLU 43 2HB GLU 43 -16.879 -3.836 -16.047
341 1HG GLU 43 1HG GLU 43 -15.228 -4.843 -14.007
342 2HG GLU 43 2HG GLU 43 -14.400 -3.369 -14.572
343 HE2 GLU 43 HE2 GLU 43 -17.415 -2.702 -12.311
344 H ALA 44 H ALA 44 -16.247 -7.843 -17.486
345 HA ALA 44 HA ALA 44 -16.109 -6.507 -20.179
346 1HB ALA 44 1HB ALA 44 -14.429 -8.921 -19.266
347 2HB ALA 44 2HB ALA 44 -14.453 -8.274 -20.923
348 3HB ALA 44 3HB ALA 44 -13.786 -7.294 -19.595
349 H GLN 45 H GLN 45 -17.076 -7.834 -21.866
350 HA GLN 45 HA GLN 45 -18.737 -9.342 -22.619
351 1HB GLN 45 1HB GLN 45 -17.968 -10.962 -20.125
352 2HB GLN 45 2HB GLN 45 -18.646 -11.597 -21.638
353 1HG GLN 45 1HG GLN 45 -16.515 -10.475 -22.718
354 2HG GLN 45 2HG GLN 45 -15.870 -10.592 -21.057
355 1HE2 GLN 45 2HE2 GLN 45 -17.143 -13.016 -20.202
356 2HE2 GLN 45 1HE2 GLN 45 -16.503 -14.354 -21.193
357 H ALA 46 H ALA 46 -20.057 -7.432 -21.799
358 HA ALA 46 HA ALA 46 -22.194 -6.905 -20.980
359 1HB ALA 46 1HB ALA 46 -23.439 -8.620 -19.602
360 2HB ALA 46 2HB ALA 46 -22.757 -9.331 -21.084
361 3HB ALA 46 3HB ALA 46 -21.951 -9.595 -19.520
Start of MODEL 3
1 1H PHE 1 1H PHE 1 29.087 6.320 6.153
2 2H PHE 1 2H PHE 1 28.288 7.407 7.157
3 3H PHE 1 3H PHE 1 28.811 5.929 7.765
4 HA PHE 1 HA PHE 1 27.206 4.744 6.303
5 1HB PHE 1 2HB PHE 1 26.829 5.987 8.692
6 2HB PHE 1 1HB PHE 1 25.685 6.926 7.703
7 HD1 PHE 1 HD1 PHE 1 23.505 6.143 7.750
8 HD2 PHE 1 HD2 PHE 1 26.750 3.306 7.970
9 HE1 PHE 1 HE1 PHE 1 21.867 4.274 7.858
10 HE2 PHE 1 HE2 PHE 1 25.107 1.440 8.081
11 HZ PHE 1 HZ PHE 1 22.667 1.923 8.026
12 H GLY 2 H GLY 2 24.810 5.544 5.453
13 1HA GLY 2 1HA GLY 2 24.275 7.877 4.146
14 2HA GLY 2 2HA GLY 2 25.592 7.257 3.115
15 H PHE 3 H PHE 3 25.044 4.480 3.307
16 HA PHE 3 HA PHE 3 23.253 3.993 1.180
17 1HB PHE 3 1HB PHE 3 24.124 2.498 3.673
18 2HB PHE 3 2HB PHE 3 22.891 1.752 2.624
19 HD1 PHE 3 HD1 PHE 3 24.715 -0.057 2.301
20 HD2 PHE 3 HD2 PHE 3 25.118 4.005 0.904
21 HE1 PHE 3 HE1 PHE 3 26.490 -0.778 0.711
22 HE2 PHE 3 HE2 PHE 3 26.893 3.283 -0.681
23 HZ PHE 3 HZ PHE 3 27.579 0.892 -0.780
24 H LYS 4 H LYS 4 22.418 4.528 4.594
25 HA LYS 4 HA LYS 4 19.703 3.662 4.598
26 1HB LYS 4 1HB LYS 4 20.840 4.571 6.559
27 2HB LYS 4 2HB LYS 4 21.123 6.123 5.740
28 1HG LYS 4 1HG LYS 4 18.346 5.712 5.575
29 2HG LYS 4 2HG LYS 4 18.794 5.215 7.230
30 1HD LYS 4 1HD LYS 4 18.385 7.589 7.345
31 2HD LYS 4 2HD LYS 4 20.150 7.396 7.361
32 1HE LYS 4 1HE LYS 4 19.636 9.137 5.853
33 2HE LYS 4 2HE LYS 4 20.121 7.681 4.883
34 1HZ LYS 4 1HZ LYS 4 17.310 8.492 5.532
35 2HZ LYS 4 2HZ LYS 4 18.013 8.688 4.017
36 3HZ LYS 4 3HZ LYS 4 17.759 7.144 4.633
37 H ASP 5 H ASP 5 21.045 6.616 3.045
38 HA ASP 5 HA ASP 5 18.264 7.500 2.459
39 1HB ASP 5 1HB ASP 5 20.786 8.672 2.574
40 2HB ASP 5 2HB ASP 5 20.449 8.617 0.818
41 HD2 ASP 5 HD2 ASP 5 18.411 11.424 1.416
42 H ILE 6 H ILE 6 20.911 5.764 0.848
43 HA ILE 6 HA ILE 6 19.691 5.769 -1.762
44 HB ILE 6 HB ILE 6 21.320 3.515 -0.415
45 1HG1 ILE 6 1HG1 ILE 6 22.070 6.297 -1.212
46 2HG1 ILE 6 2HG1 ILE 6 22.760 5.243 0.049
47 1HG2 ILE 6 1HG2 ILE 6 21.223 4.507 -3.298
48 2HG2 ILE 6 2HG2 ILE 6 22.244 3.186 -2.685
49 3HG2 ILE 6 3HG2 ILE 6 20.473 3.013 -2.689
50 1HD1 ILE 6 1HD1 ILE 6 23.176 4.926 -2.960
51 2HD1 ILE 6 2HD1 ILE 6 24.372 5.575 -1.814
52 3HD1 ILE 6 3HD1 ILE 6 23.865 3.874 -1.701
53 H ILE 7 H ILE 7 19.431 3.604 1.088
54 HA ILE 7 HA ILE 7 17.638 1.715 -0.133
55 HB ILE 7 HB ILE 7 17.609 2.705 2.783
56 1HG1 ILE 7 1HG1 ILE 7 19.806 1.571 1.219
57 2HG1 ILE 7 2HG1 ILE 7 19.817 2.206 2.880
58 1HG2 ILE 7 1HG2 ILE 7 17.200 -0.053 1.550
59 2HG2 ILE 7 2HG2 ILE 7 17.141 0.330 3.286
60 3HG2 ILE 7 3HG2 ILE 7 15.913 1.000 2.185
61 1HD1 ILE 7 1HD1 ILE 7 18.892 -0.581 2.046
62 2HD1 ILE 7 2HD1 ILE 7 20.436 -0.193 2.840
63 3HD1 ILE 7 3HD1 ILE 7 18.903 0.055 3.709
64 H ARG 8 H ARG 8 17.145 4.882 1.447
65 HA ARG 8 HA ARG 8 14.266 4.772 1.510
66 1HB ARG 8 1HB ARG 8 16.401 6.621 1.987
67 2HB ARG 8 2HB ARG 8 15.383 7.414 0.766
68 1HG ARG 8 1HG ARG 8 13.419 6.600 2.393
69 2HG ARG 8 2HG ARG 8 14.726 6.641 3.597
70 1HD ARG 8 1HD ARG 8 13.313 8.745 3.219
71 2HD ARG 8 2HD ARG 8 15.123 8.890 3.306
72 HE ARG 8 HE ARG 8 13.684 8.614 0.603
73 1HH1 ARG 8 2HH1 ARG 8 13.765 11.483 1.494
74 2HH1 ARG 8 1HH1 ARG 8 15.336 12.056 0.871
75 1HH2 ARG 8 1HH2 ARG 8 16.624 8.777 0.433
76 2HH2 ARG 8 2HH2 ARG 8 16.956 10.523 0.269
77 H ALA 9 H ALA 9 16.574 5.868 -1.015
78 HA ALA 9 HA ALA 9 14.491 6.616 -2.893
79 1HB ALA 9 1HB ALA 9 17.346 5.538 -3.317
80 2HB ALA 9 2HB ALA 9 16.409 6.423 -4.544
81 3HB ALA 9 3HB ALA 9 16.929 7.247 -3.055
82 H ILE 10 H ILE 10 16.342 3.607 -2.326
83 HA ILE 10 HA ILE 10 15.162 2.135 -4.501
84 HB ILE 10 HB ILE 10 16.048 1.217 -1.697
85 1HG1 ILE 10 1HG1 ILE 10 17.527 2.500 -3.735
86 2HG1 ILE 10 2HG1 ILE 10 18.183 1.613 -2.334
87 1HG2 ILE 10 1HG2 ILE 10 15.899 -0.301 -4.338
88 2HG2 ILE 10 2HG2 ILE 10 16.534 -0.943 -2.804
89 3HG2 ILE 10 3HG2 ILE 10 14.809 -0.526 -2.949
90 1HD1 ILE 10 1HD1 ILE 10 17.443 0.386 -5.031
91 2HD1 ILE 10 2HD1 ILE 10 19.097 0.718 -4.464
92 3HD1 ILE 10 3HD1 ILE 10 18.098 -0.498 -3.634
93 H ARG 11 H ARG 11 14.083 2.759 -1.151
94 HA ARG 11 HA ARG 11 11.783 0.989 -1.328
95 1HB ARG 11 1HB ARG 11 12.509 1.786 0.855
96 2HB ARG 11 2HB ARG 11 12.572 3.469 0.300
97 1HG ARG 11 1HG ARG 11 10.601 3.071 1.758
98 2HG ARG 11 2HG ARG 11 10.097 3.509 0.115
99 1HD ARG 11 1HD ARG 11 8.895 1.596 1.209
100 2HD ARG 11 2HD ARG 11 9.587 1.307 -0.448
101 HE ARG 11 HE ARG 11 11.472 0.019 0.611
102 1HH1 ARG 11 2HH1 ARG 11 11.523 1.409 3.288
103 2HH1 ARG 11 1HH1 ARG 11 10.795 0.195 4.374
104 1HH2 ARG 11 1HH2 ARG 11 9.338 -1.649 1.716
105 2HH2 ARG 11 2HH2 ARG 11 9.557 -1.538 3.483
106 H ARG 12 H ARG 12 12.371 4.405 -2.167
107 HA ARG 12 HA ARG 12 9.539 4.923 -2.850
108 1HB ARG 12 1HB ARG 12 12.113 6.283 -2.700
109 2HB ARG 12 2HB ARG 12 11.350 6.651 -4.265
110 1HG ARG 12 1HG ARG 12 9.189 6.922 -2.608
111 2HG ARG 12 2HG ARG 12 10.485 7.399 -1.498
112 1HD ARG 12 1HD ARG 12 9.384 9.199 -2.905
113 2HD ARG 12 2HD ARG 12 11.199 9.132 -2.856
114 HE ARG 12 HE ARG 12 11.211 8.275 -5.173
115 1HH1 ARG 12 1HH2 ARG 12 8.907 10.355 -5.357
116 2HH1 ARG 12 2HH2 ARG 12 7.647 9.397 -6.182
117 1HH2 ARG 12 2HH1 ARG 12 9.217 6.296 -5.485
118 2HH2 ARG 12 1HH1 ARG 12 7.824 7.100 -6.255
119 H ILE 13 H ILE 13 12.344 3.616 -4.586
120 HA ILE 13 HA ILE 13 10.839 3.903 -7.145
121 HB ILE 13 HB ILE 13 13.400 4.124 -6.841
122 1HG1 ILE 13 1HG1 ILE 13 11.930 3.045 -8.951
123 2HG1 ILE 13 2HG1 ILE 13 13.620 3.610 -9.014
124 1HG2 ILE 13 1HG2 ILE 13 13.197 1.110 -6.525
125 2HG2 ILE 13 2HG2 ILE 13 14.698 2.052 -6.682
126 3HG2 ILE 13 3HG2 ILE 13 13.662 2.260 -5.249
127 1HD1 ILE 13 1HD1 ILE 13 12.715 0.778 -8.309
128 2HD1 ILE 13 2HD1 ILE 13 13.428 1.279 -9.861
129 3HD1 ILE 13 3HD1 ILE 13 14.402 1.343 -8.372
130 H ALA 14 H ALA 14 11.470 1.574 -4.594
131 HA ALA 14 HA ALA 14 10.442 -0.730 -6.195
132 1HB ALA 14 1HB ALA 14 10.966 -0.297 -3.195
133 2HB ALA 14 2HB ALA 14 10.697 -1.877 -3.971
134 3HB ALA 14 3HB ALA 14 12.156 -0.934 -4.355
135 H VAL 15 H VAL 15 8.960 1.944 -4.699
136 HA VAL 15 HA VAL 15 6.767 1.049 -3.222
137 HB VAL 15 HB VAL 15 6.842 2.902 -5.657
138 1HG1 VAL 15 1HG1 VAL 15 4.714 2.641 -3.490
139 2HG1 VAL 15 2HG1 VAL 15 4.758 3.885 -4.762
140 3HG1 VAL 15 3HG1 VAL 15 4.519 2.175 -5.196
141 1HG2 VAL 15 1HG2 VAL 15 8.317 3.519 -3.755
142 2HG2 VAL 15 2HG2 VAL 15 6.966 4.666 -3.919
143 3HG2 VAL 15 3HG2 VAL 15 6.927 3.420 -2.649
144 HA PRO 16 HA PRO 16 4.348 -0.698 -6.910
145 1HB PRO 16 1HB PRO 16 5.685 -1.205 -9.209
146 2HB PRO 16 2HB PRO 16 4.810 0.358 -8.866
147 1HG PRO 16 1HG PRO 16 7.740 -0.309 -8.752
148 2HG PRO 16 2HG PRO 16 6.933 1.191 -9.362
149 1HD PRO 16 1HD PRO 16 8.096 1.031 -6.834
150 2HD PRO 16 2HD PRO 16 6.732 2.087 -7.202
151 H VAL 17 H VAL 17 7.827 -1.566 -6.996
152 HA VAL 17 HA VAL 17 7.350 -4.399 -7.468
153 HB VAL 17 HB VAL 17 9.610 -3.153 -5.820
154 1HG1 VAL 17 1HG1 VAL 17 9.522 -5.414 -7.869
155 2HG1 VAL 17 2HG1 VAL 17 10.967 -4.873 -6.982
156 3HG1 VAL 17 3HG1 VAL 17 9.610 -5.617 -6.103
157 1HG2 VAL 17 1HG2 VAL 17 9.190 -1.710 -7.800
158 2HG2 VAL 17 2HG2 VAL 17 10.724 -2.597 -7.968
159 3HG2 VAL 17 3HG2 VAL 17 9.280 -3.138 -8.858
160 H VAL 18 H VAL 18 7.278 -2.384 -4.546
161 HA VAL 18 HA VAL 18 7.390 -4.552 -2.667
162 HB VAL 18 HB VAL 18 5.821 -1.891 -2.639
163 1HG1 VAL 18 1HG1 VAL 18 6.839 -3.602 -0.331
164 2HG1 VAL 18 2HG1 VAL 18 6.037 -2.021 -0.179
165 3HG1 VAL 18 3HG1 VAL 18 5.136 -3.418 -0.814
166 1HG2 VAL 18 1HG2 VAL 18 8.235 -1.617 -3.145
167 2HG2 VAL 18 2HG2 VAL 18 7.840 -0.972 -1.533
168 3HG2 VAL 18 3HG2 VAL 18 8.645 -2.552 -1.687
169 H SER 19 H SER 19 4.646 -2.910 -4.273
170 HA SER 19 HA SER 19 2.550 -4.560 -3.180
171 1HB SER 19 1HB SER 19 2.646 -3.600 -6.059
172 2HB SER 19 2HB SER 19 1.317 -3.438 -4.873
173 HG SER 19 HG SER 19 3.571 -2.174 -3.912
174 H THR 20 H THR 20 4.837 -5.176 -5.849
175 HA THR 20 HA THR 20 3.304 -7.641 -6.624
176 HB THR 20 HB THR 20 5.902 -7.572 -7.770
177 HG1 THR 20 HG1 THR 20 6.385 -5.550 -6.885
178 1HG2 THR 20 1HG2 THR 20 3.327 -6.269 -8.759
179 2HG2 THR 20 2HG2 THR 20 4.722 -6.715 -9.770
180 3HG2 THR 20 3HG2 THR 20 3.768 -7.981 -8.962
181 H LEU 21 H LEU 21 6.105 -6.798 -4.612
182 HA LEU 21 HA LEU 21 6.839 -9.719 -4.383
183 1HB LEU 21 1HB LEU 21 8.229 -7.332 -4.340
184 2HB LEU 21 2HB LEU 21 8.007 -7.617 -2.597
185 HG LEU 21 HG LEU 21 8.987 -9.881 -2.832
186 1HD1 LEU 21 1HD1 LEU 21 9.377 -9.074 -5.748
187 2HD1 LEU 21 2HD1 LEU 21 9.997 -10.559 -4.986
188 3HD1 LEU 21 3HD1 LEU 21 8.243 -10.311 -5.156
189 1HD2 LEU 21 1HD2 LEU 21 10.486 -7.963 -2.367
190 2HD2 LEU 21 2HD2 LEU 21 11.304 -9.190 -3.363
191 3HD2 LEU 21 3HD2 LEU 21 10.690 -7.699 -4.116
192 H PHE 22 H PHE 22 5.054 -7.258 -2.591
193 HA PHE 22 HA PHE 22 4.979 -9.162 -0.238
194 1HB PHE 22 1HB PHE 22 4.809 -6.260 -0.732
195 2HB PHE 22 2HB PHE 22 3.451 -6.822 0.271
196 HD1 PHE 22 HD1 PHE 22 6.964 -8.119 0.041
197 HD2 PHE 22 HD2 PHE 22 3.983 -6.160 2.465
198 HE1 PHE 22 HE1 PHE 22 8.476 -8.261 2.013
199 HE2 PHE 22 HE2 PHE 22 5.496 -6.300 4.436
200 HZ PHE 22 HZ PHE 22 7.741 -7.351 4.212
201 HA PRO 23 HA PRO 23 1.093 -10.500 -2.080
202 1HB PRO 23 1HB PRO 23 0.722 -12.425 -0.258
203 2HB PRO 23 2HB PRO 23 1.766 -12.589 -1.748
204 1HG PRO 23 1HG PRO 23 2.501 -12.054 1.115
205 2HG PRO 23 2HG PRO 23 3.278 -13.189 -0.076
206 1HD PRO 23 1HD PRO 23 4.376 -10.693 0.423
207 2HD PRO 23 2HD PRO 23 4.415 -11.411 -1.185
208 HA PRO 24 HA PRO 24 -1.151 -9.400 1.827
209 1HB PRO 24 1HB PRO 24 0.090 -7.892 3.718
210 2HB PRO 24 2HB PRO 24 0.044 -9.708 3.742
211 1HG PRO 24 1HG PRO 24 2.290 -7.849 3.134
212 2HG PRO 24 2HG PRO 24 2.338 -9.546 3.712
213 1HD PRO 24 1HD PRO 24 2.647 -8.605 0.952
214 2HD PRO 24 2HD PRO 24 2.542 -10.338 1.516
215 H ALA 25 H ALA 25 1.372 -7.201 0.670
216 HA ALA 25 HA ALA 25 -0.467 -4.849 0.949
217 1HB ALA 25 1HB ALA 25 2.268 -5.273 -0.405
218 2HB ALA 25 2HB ALA 25 1.521 -3.687 -0.098
219 3HB ALA 25 3HB ALA 25 2.034 -4.708 1.266
220 H ALA 26 H ALA 26 0.679 -7.111 -1.510
221 HA ALA 26 HA ALA 26 -0.053 -5.771 -3.934
222 1HB ALA 26 1HB ALA 26 -0.539 -8.669 -3.074
223 2HB ALA 26 2HB ALA 26 -0.422 -8.090 -4.752
224 3HB ALA 26 3HB ALA 26 1.003 -8.028 -3.689
225 HA PRO 27 HA PRO 27 -4.583 -7.148 -3.544
226 1HB PRO 27 1HB PRO 27 -5.545 -7.612 -1.072
227 2HB PRO 27 2HB PRO 27 -4.879 -8.906 -2.173
228 1HG PRO 27 1HG PRO 27 -3.648 -7.525 0.193
229 2HG PRO 27 2HG PRO 27 -3.549 -9.264 -0.296
230 1HD PRO 27 1HD PRO 27 -1.520 -7.338 -0.892
231 2HD PRO 27 2HD PRO 27 -1.853 -8.793 -1.954
232 H LEU 28 H LEU 28 -3.603 -5.631 -0.410
233 HA LEU 28 HA LEU 28 -5.834 -3.734 -0.623
234 1HB LEU 28 1HB LEU 28 -4.604 -2.576 1.246
235 2HB LEU 28 2HB LEU 28 -4.751 -4.311 1.534
236 HG LEU 28 HG LEU 28 -2.397 -4.365 0.268
237 1HD1 LEU 28 1HD1 LEU 28 -2.523 -1.594 1.536
238 2HD1 LEU 28 2HD1 LEU 28 -1.063 -2.374 0.882
239 3HD1 LEU 28 3HD1 LEU 28 -2.399 -1.933 -0.207
240 1HD2 LEU 28 1HD2 LEU 28 -2.879 -5.138 2.585
241 2HD2 LEU 28 2HD2 LEU 28 -1.345 -4.238 2.516
242 3HD2 LEU 28 3HD2 LEU 28 -2.808 -3.454 3.157
243 H ALA 29 H ALA 29 -2.430 -3.713 -1.746
244 HA ALA 29 HA ALA 29 -2.314 -0.936 -2.360
245 1HB ALA 29 1HB ALA 29 -1.311 -3.365 -3.981
246 2HB ALA 29 2HB ALA 29 -0.671 -1.715 -4.156
247 3HB ALA 29 3HB ALA 29 -0.433 -2.605 -2.633
248 H HIS 30 H HIS 30 -3.791 -3.690 -4.014
249 HA HIS 30 HA HIS 30 -4.592 -2.320 -6.422
250 1HB HIS 30 1HB HIS 30 -4.693 -4.853 -5.567
251 2HB HIS 30 2HB HIS 30 -6.271 -4.382 -4.890
252 HD1 HIS 30 HD1 HIS 30 -4.480 -3.879 -8.285
253 HD2 HIS 30 HD2 HIS 30 -8.261 -4.927 -6.707
254 HE1 HIS 30 HE1 HIS 30 -6.047 -4.305 -10.270
255 H ALA 31 H ALA 31 -6.297 -2.834 -3.307
256 HA ALA 31 HA ALA 31 -8.654 -1.294 -4.083
257 1HB ALA 31 1HB ALA 31 -7.322 -1.810 -1.360
258 2HB ALA 31 2HB ALA 31 -9.015 -1.309 -1.590
259 3HB ALA 31 3HB ALA 31 -8.475 -2.907 -2.157
260 H ILE 32 H ILE 32 -5.663 -0.394 -2.324
261 HA ILE 32 HA ILE 32 -6.536 2.381 -1.934
262 HB ILE 32 HB ILE 32 -3.712 1.186 -2.144
263 1HG1 ILE 32 1HG1 ILE 32 -5.846 0.468 -0.374
264 2HG1 ILE 32 2HG1 ILE 32 -4.144 -0.052 -0.308
265 1HG2 ILE 32 1HG2 ILE 32 -4.829 3.521 -0.531
266 2HG2 ILE 32 2HG2 ILE 32 -3.145 2.946 -0.501
267 3HG2 ILE 32 3HG2 ILE 32 -3.815 3.656 -1.989
268 1HD1 ILE 32 1HD1 ILE 32 -5.271 2.513 0.906
269 2HD1 ILE 32 2HD1 ILE 32 -4.822 1.048 1.811
270 3HD1 ILE 32 3HD1 ILE 32 -3.570 1.994 0.971
271 H GLY 33 H GLY 33 -4.918 0.648 -4.576
272 1HA GLY 33 1HA GLY 33 -4.435 3.307 -5.932
273 2HA GLY 33 2HA GLY 33 -3.812 1.732 -6.473
274 H GLU 34 H GLU 34 -7.169 2.211 -5.454
275 HA GLU 34 HA GLU 34 -9.135 1.678 -6.741
276 1HB GLU 34 1HB GLU 34 -7.873 3.440 -8.863
277 2HB GLU 34 2HB GLU 34 -9.521 3.509 -8.192
278 1HG GLU 34 1HG GLU 34 -8.470 4.228 -5.989
279 2HG GLU 34 2HG GLU 34 -6.930 4.406 -6.877
280 HE2 GLU 34 HE2 GLU 34 -9.098 6.861 -8.838
281 H GLY 35 H GLY 35 -7.052 -0.278 -7.149
282 1HA GLY 35 1HA GLY 35 -6.583 -0.740 -9.958
283 2HA GLY 35 2HA GLY 35 -6.597 -2.002 -8.694
284 H VAL 36 H VAL 36 -9.101 -2.175 -7.790
285 HA VAL 36 HA VAL 36 -10.501 -3.454 -9.966
286 HB VAL 36 HB VAL 36 -10.697 -3.675 -7.340
287 1HG1 VAL 36 1HG1 VAL 36 -12.643 -1.386 -7.811
288 2HG1 VAL 36 2HG1 VAL 36 -12.438 -2.302 -6.298
289 3HG1 VAL 36 3HG1 VAL 36 -11.114 -1.279 -6.904
290 1HG2 VAL 36 1HG2 VAL 36 -12.139 -4.915 -8.911
291 2HG2 VAL 36 2HG2 VAL 36 -13.041 -4.395 -7.468
292 3HG2 VAL 36 3HG2 VAL 36 -13.237 -3.518 -9.004
293 H ASP 37 H ASP 37 -10.723 -0.204 -8.536
294 HA ASP 37 HA ASP 37 -13.056 0.631 -10.031
295 1HB ASP 37 1HB ASP 37 -11.426 1.695 -8.123
296 2HB ASP 37 2HB ASP 37 -10.740 2.516 -9.552
297 HD2 ASP 37 HD2 ASP 37 -14.428 3.540 -8.467
298 H TYR 38 H TYR 38 -9.584 0.623 -10.801
299 HA TYR 38 HA TYR 38 -9.867 2.034 -13.362
300 1HB TYR 38 1HB TYR 38 -7.602 1.918 -12.925
301 2HB TYR 38 2HB TYR 38 -7.864 0.654 -11.709
302 HD1 TYR 38 HD1 TYR 38 -7.745 1.163 -15.432
303 HD2 TYR 38 HD2 TYR 38 -7.127 -1.531 -12.121
304 HE1 TYR 38 HE1 TYR 38 -6.774 -0.519 -16.983
305 HE2 TYR 38 HE2 TYR 38 -6.160 -3.217 -13.675
306 HH TYR 38 HH TYR 38 -6.228 -3.845 -16.041
307 H LEU 39 H LEU 39 -9.874 -1.453 -12.502
308 HA LEU 39 HA LEU 39 -10.144 -2.142 -15.401
309 1HB LEU 39 1HB LEU 39 -9.232 -4.102 -14.577
310 2HB LEU 39 2HB LEU 39 -9.235 -3.421 -12.985
311 HG LEU 39 HG LEU 39 -10.330 -5.497 -12.936
312 1HD1 LEU 39 1HD1 LEU 39 -12.364 -3.234 -12.849
313 2HD1 LEU 39 2HD1 LEU 39 -12.541 -4.820 -12.061
314 3HD1 LEU 39 3HD1 LEU 39 -11.266 -3.698 -11.529
315 1HD2 LEU 39 1HD2 LEU 39 -10.948 -5.682 -15.299
316 2HD2 LEU 39 2HD2 LEU 39 -12.351 -5.990 -14.248
317 3HD2 LEU 39 3HD2 LEU 39 -12.191 -4.427 -15.084
318 H LEU 40 H LEU 40 -12.317 -1.275 -12.801
319 HA LEU 40 HA LEU 40 -14.588 -2.660 -14.220
320 1HB LEU 40 1HB LEU 40 -13.969 -1.941 -11.546
321 2HB LEU 40 2HB LEU 40 -15.233 -0.785 -12.016
322 HG LEU 40 HG LEU 40 -16.331 -2.735 -11.086
323 1HD1 LEU 40 1HD1 LEU 40 -16.438 -2.831 -14.135
324 2HD1 LEU 40 2HD1 LEU 40 -17.666 -3.493 -13.030
325 3HD1 LEU 40 3HD1 LEU 40 -17.385 -1.738 -13.098
326 1HD2 LEU 40 1HD2 LEU 40 -14.443 -4.317 -11.362
327 2HD2 LEU 40 2HD2 LEU 40 -15.951 -4.997 -12.019
328 3HD2 LEU 40 3HD2 LEU 40 -14.717 -4.338 -13.120
329 H GLY 41 H GLY 41 -14.059 0.658 -12.929
330 1HA GLY 41 1HA GLY 41 -14.561 2.718 -13.965
331 2HA GLY 41 2HA GLY 41 -14.598 1.867 -15.536
332 H ASP 42 H ASP 42 -16.564 0.873 -12.771
333 HA ASP 42 HA ASP 42 -18.986 1.762 -14.371
334 1HB ASP 42 1HB ASP 42 -18.567 -0.726 -13.869
335 2HB ASP 42 2HB ASP 42 -18.713 -0.336 -12.137
336 HD2 ASP 42 HD2 ASP 42 -22.200 -0.339 -12.443
337 H GLU 43 H GLU 43 -17.536 3.584 -12.755
338 HA GLU 43 HA GLU 43 -19.435 3.861 -10.395
339 1HB GLU 43 1HB GLU 43 -16.615 4.993 -10.856
340 2HB GLU 43 2HB GLU 43 -17.518 5.009 -9.320
341 1HG GLU 43 1HG GLU 43 -16.320 3.089 -8.903
342 2HG GLU 43 2HG GLU 43 -17.577 2.333 -9.906
343 HE2 GLU 43 HE2 GLU 43 -14.451 3.143 -12.179
344 H ALA 44 H ALA 44 -20.155 6.028 -9.888
345 HA ALA 44 HA ALA 44 -20.601 7.577 -12.387
346 1HB ALA 44 1HB ALA 44 -21.275 8.093 -9.426
347 2HB ALA 44 2HB ALA 44 -21.974 8.989 -10.796
348 3HB ALA 44 3HB ALA 44 -22.337 7.260 -10.586
349 H GLN 45 H GLN 45 -20.241 10.032 -12.311
350 HA GLN 45 HA GLN 45 -17.576 10.532 -10.922
351 1HB GLN 45 1HB GLN 45 -18.391 12.115 -13.351
352 2HB GLN 45 2HB GLN 45 -16.807 11.410 -12.960
353 1HG GLN 45 1HG GLN 45 -17.834 9.130 -13.433
354 2HG GLN 45 2HG GLN 45 -19.250 10.000 -14.085
355 1HE2 GLN 45 2HE2 GLN 45 -15.611 10.115 -14.364
356 2HE2 GLN 45 1HE2 GLN 45 -15.628 10.416 -16.123
357 H ALA 46 H ALA 46 -20.387 10.996 -10.002
358 HA ALA 46 HA ALA 46 -19.934 13.659 -8.983
359 1HB ALA 46 1HB ALA 46 -21.891 14.763 -10.182
360 2HB ALA 46 2HB ALA 46 -20.615 14.251 -11.312
361 3HB ALA 46 3HB ALA 46 -22.094 13.277 -11.139
Start of MODEL 4
1 1H PHE 1 1H PHE 1 25.807 12.773 -1.032
2 2H PHE 1 2H PHE 1 27.321 12.058 -0.871
3 3H PHE 1 3H PHE 1 26.690 12.358 -2.401
4 HA PHE 1 HA PHE 1 24.893 10.714 -2.001
5 1HB PHE 1 2HB PHE 1 27.831 9.981 -1.597
6 2HB PHE 1 1HB PHE 1 26.557 8.762 -1.857
7 HD1 PHE 1 HD1 PHE 1 24.972 9.204 -3.924
8 HD2 PHE 1 HD2 PHE 1 28.908 10.907 -3.460
9 HE1 PHE 1 HE1 PHE 1 25.089 9.607 -6.377
10 HE2 PHE 1 HE2 PHE 1 29.025 11.304 -5.914
11 HZ PHE 1 HZ PHE 1 27.113 10.656 -7.373
12 H GLY 2 H GLY 2 24.743 8.577 -0.571
13 1HA GLY 2 1HA GLY 2 25.589 8.625 2.125
14 2HA GLY 2 2HA GLY 2 24.074 9.589 2.067
15 H PHE 3 H PHE 3 25.376 6.433 2.284
16 HA PHE 3 HA PHE 3 23.585 4.783 0.826
17 1HB PHE 3 1HB PHE 3 24.465 4.446 3.752
18 2HB PHE 3 2HB PHE 3 24.045 3.134 2.629
19 HD1 PHE 3 HD1 PHE 3 25.358 3.886 0.139
20 HD2 PHE 3 HD2 PHE 3 26.752 4.288 4.201
21 HE1 PHE 3 HE1 PHE 3 27.714 3.831 -0.663
22 HE2 PHE 3 HE2 PHE 3 29.108 4.231 3.399
23 HZ PHE 3 HZ PHE 3 29.590 4.006 0.966
24 H LYS 4 H LYS 4 23.016 6.301 4.030
25 HA LYS 4 HA LYS 4 20.470 5.169 4.614
26 1HB LYS 4 1HB LYS 4 21.846 7.832 5.020
27 2HB LYS 4 2HB LYS 4 20.125 7.715 5.457
28 1HG LYS 4 1HG LYS 4 22.224 5.726 6.420
29 2HG LYS 4 2HG LYS 4 21.768 7.179 7.341
30 1HD LYS 4 1HD LYS 4 19.445 6.425 7.483
31 2HD LYS 4 2HD LYS 4 19.780 5.055 6.407
32 1HE LYS 4 1HE LYS 4 19.678 4.592 8.883
33 2HE LYS 4 2HE LYS 4 21.132 3.991 7.971
34 1HZ LYS 4 1HZ LYS 4 20.970 6.569 9.501
35 2HZ LYS 4 2HZ LYS 4 21.803 5.215 10.046
36 3HZ LYS 4 3HZ LYS 4 22.314 6.014 8.657
37 H ASP 5 H ASP 5 21.207 7.809 2.286
38 HA ASP 5 HA ASP 5 18.334 8.214 1.768
39 1HB ASP 5 1HB ASP 5 20.612 9.627 1.299
40 2HB ASP 5 2HB ASP 5 20.411 8.859 -0.306
41 HD2 ASP 5 HD2 ASP 5 18.144 11.905 0.261
42 H ILE 6 H ILE 6 21.012 6.365 0.308
43 HA ILE 6 HA ILE 6 19.573 5.458 -1.995
44 HB ILE 6 HB ILE 6 21.545 3.883 -0.225
45 1HG1 ILE 6 1HG1 ILE 6 21.855 6.373 -1.746
46 2HG1 ILE 6 2HG1 ILE 6 22.984 5.590 -0.611
47 1HG2 ILE 6 1HG2 ILE 6 21.031 3.830 -3.231
48 2HG2 ILE 6 2HG2 ILE 6 22.257 2.872 -2.367
49 3HG2 ILE 6 3HG2 ILE 6 20.526 2.580 -2.070
50 1HD1 ILE 6 1HD1 ILE 6 22.568 4.805 -3.533
51 2HD1 ILE 6 2HD1 ILE 6 23.958 5.712 -2.894
52 3HD1 ILE 6 3HD1 ILE 6 23.695 4.023 -2.400
53 H ILE 7 H ILE 7 19.664 4.260 1.394
54 HA ILE 7 HA ILE 7 18.058 1.926 0.951
55 HB ILE 7 HB ILE 7 17.936 3.870 3.341
56 1HG1 ILE 7 1HG1 ILE 7 20.282 3.495 2.950
57 2HG1 ILE 7 2HG1 ILE 7 19.819 2.401 4.270
58 1HG2 ILE 7 1HG2 ILE 7 17.632 0.838 3.157
59 2HG2 ILE 7 2HG2 ILE 7 17.551 1.799 4.653
60 3HG2 ILE 7 3HG2 ILE 7 16.307 2.002 3.398
61 1HD1 ILE 7 1HD1 ILE 7 20.032 1.643 1.325
62 2HD1 ILE 7 2HD1 ILE 7 21.209 1.233 2.596
63 3HD1 ILE 7 3HD1 ILE 7 19.568 0.548 2.649
64 H ARG 8 H ARG 8 17.141 5.303 1.763
65 HA ARG 8 HA ARG 8 14.295 4.850 1.696
66 1HB ARG 8 1HB ARG 8 15.151 6.947 2.584
67 2HB ARG 8 2HB ARG 8 16.189 7.209 1.170
68 1HG ARG 8 1HG ARG 8 13.944 7.332 -0.166
69 2HG ARG 8 2HG ARG 8 13.199 7.593 1.430
70 1HD ARG 8 1HD ARG 8 15.308 9.213 0.029
71 2HD ARG 8 2HD ARG 8 13.653 9.719 0.588
72 HE ARG 8 HE ARG 8 14.600 9.119 3.010
73 1HH1 ARG 8 2HH1 ARG 8 15.550 11.694 1.201
74 2HH1 ARG 8 1HH1 ARG 8 17.224 11.819 1.805
75 1HH2 ARG 8 1HH2 ARG 8 17.154 8.635 3.354
76 2HH2 ARG 8 2HH2 ARG 8 18.131 10.091 3.020
77 H ALA 9 H ALA 9 16.642 5.791 -0.845
78 HA ALA 9 HA ALA 9 14.736 6.113 -2.972
79 1HB ALA 9 1HB ALA 9 17.578 4.930 -2.973
80 2HB ALA 9 2HB ALA 9 16.758 5.602 -4.403
81 3HB ALA 9 3HB ALA 9 17.193 6.667 -3.044
82 H ILE 10 H ILE 10 16.480 3.191 -1.831
83 HA ILE 10 HA ILE 10 15.289 1.454 -3.819
84 HB ILE 10 HB ILE 10 16.193 0.908 -0.926
85 1HG1 ILE 10 1HG1 ILE 10 17.647 1.862 -3.190
86 2HG1 ILE 10 2HG1 ILE 10 18.302 1.304 -1.631
87 1HG2 ILE 10 1HG2 ILE 10 16.023 -0.940 -3.346
88 2HG2 ILE 10 2HG2 ILE 10 16.664 -1.377 -1.744
89 3HG2 ILE 10 3HG2 ILE 10 14.940 -0.976 -1.934
90 1HD1 ILE 10 1HD1 ILE 10 17.637 -0.475 -4.021
91 2HD1 ILE 10 2HD1 ILE 10 19.273 0.015 -3.517
92 3HD1 ILE 10 3HD1 ILE 10 18.292 -1.033 -2.463
93 H ARG 11 H ARG 11 14.247 2.504 -0.559
94 HA ARG 11 HA ARG 11 11.942 0.739 -0.471
95 1HB ARG 11 1HB ARG 11 13.185 2.511 1.224
96 2HB ARG 11 2HB ARG 11 11.805 3.509 0.723
97 1HG ARG 11 1HG ARG 11 11.488 0.653 1.734
98 2HG ARG 11 2HG ARG 11 11.434 2.068 2.809
99 1HD ARG 11 1HD ARG 11 9.394 2.638 2.159
100 2HD ARG 11 2HD ARG 11 9.801 2.376 0.411
101 HE ARG 11 HE ARG 11 8.330 0.453 2.081
102 1HH1 ARG 11 1HH2 ARG 11 9.425 0.681 -1.023
103 2HH1 ARG 11 2HH2 ARG 11 10.049 -0.982 -1.179
104 1HH2 ARG 11 2HH1 ARG 11 9.874 -1.632 2.299
105 2HH2 ARG 11 1HH1 ARG 11 10.303 -2.290 0.697
106 H ARG 12 H ARG 12 12.494 3.985 -1.856
107 HA ARG 12 HA ARG 12 9.633 4.322 -2.552
108 1HB ARG 12 1HB ARG 12 12.175 5.635 -3.674
109 2HB ARG 12 2HB ARG 12 10.531 6.299 -3.768
110 1HG ARG 12 1HG ARG 12 11.034 5.705 -1.019
111 2HG ARG 12 2HG ARG 12 12.465 6.560 -1.640
112 1HD ARG 12 1HD ARG 12 11.209 8.344 -1.117
113 2HD ARG 12 2HD ARG 12 10.590 8.030 -2.799
114 HE ARG 12 HE ARG 12 9.160 6.488 -0.657
115 1HH1 ARG 12 2HH1 ARG 12 8.797 9.428 0.084
116 2HH1 ARG 12 1HH1 ARG 12 7.334 9.869 -0.836
117 1HH2 ARG 12 1HH2 ARG 12 7.573 7.066 -3.004
118 2HH2 ARG 12 2HH2 ARG 12 6.640 8.529 -2.587
119 H ILE 13 H ILE 13 12.602 3.471 -4.421
120 HA ILE 13 HA ILE 13 11.173 3.120 -6.923
121 HB ILE 13 HB ILE 13 13.720 3.286 -6.406
122 1HG1 ILE 13 1HG1 ILE 13 12.330 2.097 -8.519
123 2HG1 ILE 13 2HG1 ILE 13 14.045 2.578 -8.515
124 1HG2 ILE 13 1HG2 ILE 13 13.308 0.323 -5.853
125 2HG2 ILE 13 2HG2 ILE 13 14.874 1.161 -5.975
126 3HG2 ILE 13 3HG2 ILE 13 13.758 1.553 -4.646
127 1HD1 ILE 13 1HD1 ILE 13 12.956 -0.136 -7.640
128 2HD1 ILE 13 2HD1 ILE 13 13.789 0.199 -9.176
129 3HD1 ILE 13 3HD1 ILE 13 14.669 0.344 -7.637
130 H ALA 14 H ALA 14 11.646 0.979 -4.110
131 HA ALA 14 HA ALA 14 10.447 -1.324 -5.627
132 1HB ALA 14 1HB ALA 14 11.146 -0.882 -2.673
133 2HB ALA 14 2HB ALA 14 10.739 -2.450 -3.410
134 3HB ALA 14 3HB ALA 14 12.233 -1.606 -3.882
135 H VAL 15 H VAL 15 9.075 1.463 -4.452
136 HA VAL 15 HA VAL 15 6.947 0.522 -2.767
137 HB VAL 15 HB VAL 15 7.223 2.700 -4.886
138 1HG1 VAL 15 1HG1 VAL 15 4.825 2.209 -3.070
139 2HG1 VAL 15 2HG1 VAL 15 5.075 3.634 -4.108
140 3HG1 VAL 15 3HG1 VAL 15 4.840 2.029 -4.841
141 1HG2 VAL 15 1HG2 VAL 15 8.457 2.930 -2.743
142 2HG2 VAL 15 2HG2 VAL 15 7.174 4.154 -2.884
143 3HG2 VAL 15 3HG2 VAL 15 6.933 2.727 -1.847
144 HA PRO 16 HA PRO 16 4.354 -0.604 -6.588
145 1HB PRO 16 1HB PRO 16 5.561 -0.713 -9.006
146 2HB PRO 16 2HB PRO 16 4.747 0.779 -8.347
147 1HG PRO 16 1HG PRO 16 7.661 0.061 -8.527
148 2HG PRO 16 2HG PRO 16 6.862 1.661 -8.784
149 1HD PRO 16 1HD PRO 16 8.121 0.870 -6.335
150 2HD PRO 16 2HD PRO 16 6.756 2.089 -6.419
151 H VAL 17 H VAL 17 7.799 -1.512 -6.761
152 HA VAL 17 HA VAL 17 7.261 -4.143 -7.862
153 HB VAL 17 HB VAL 17 9.471 -3.326 -5.882
154 1HG1 VAL 17 1HG1 VAL 17 9.452 -5.223 -8.271
155 2HG1 VAL 17 2HG1 VAL 17 10.851 -4.880 -7.226
156 3HG1 VAL 17 3HG1 VAL 17 9.425 -5.710 -6.560
157 1HG2 VAL 17 1HG2 VAL 17 9.207 -1.569 -7.619
158 2HG2 VAL 17 2HG2 VAL 17 10.725 -2.472 -7.844
159 3HG2 VAL 17 3HG2 VAL 17 9.324 -2.812 -8.889
160 H VAL 18 H VAL 18 7.378 -2.814 -4.560
161 HA VAL 18 HA VAL 18 7.073 -5.359 -3.201
162 HB VAL 18 HB VAL 18 6.391 -2.421 -2.608
163 1HG1 VAL 18 1HG1 VAL 18 6.272 -4.768 -0.677
164 2HG1 VAL 18 2HG1 VAL 18 6.093 -3.049 -0.252
165 3HG1 VAL 18 3HG1 VAL 18 4.874 -3.844 -1.276
166 1HG2 VAL 18 1HG2 VAL 18 8.786 -3.048 -2.804
167 2HG2 VAL 18 2HG2 VAL 18 8.368 -2.601 -1.132
168 3HG2 VAL 18 3HG2 VAL 18 8.550 -4.315 -1.577
169 H SER 19 H SER 19 4.693 -3.028 -4.566
170 HA SER 19 HA SER 19 2.362 -4.344 -3.460
171 1HB SER 19 1HB SER 19 2.169 -3.326 -6.245
172 2HB SER 19 2HB SER 19 1.364 -2.722 -4.770
173 HG SER 19 HG SER 19 4.209 -2.339 -5.191
174 H THR 20 H THR 20 4.237 -4.961 -6.440
175 HA THR 20 HA THR 20 2.398 -7.200 -7.187
176 HB THR 20 HB THR 20 5.157 -6.786 -8.335
177 HG1 THR 20 HG1 THR 20 4.931 -4.670 -8.560
178 1HG2 THR 20 1HG2 THR 20 2.362 -6.917 -9.552
179 2HG2 THR 20 2HG2 THR 20 3.893 -6.913 -10.460
180 3HG2 THR 20 3HG2 THR 20 3.492 -8.284 -9.397
181 H LEU 21 H LEU 21 5.292 -6.825 -5.225
182 HA LEU 21 HA LEU 21 5.517 -9.882 -5.248
183 1HB LEU 21 1HB LEU 21 7.479 -7.565 -5.151
184 2HB LEU 21 2HB LEU 21 7.913 -9.052 -4.289
185 HG LEU 21 HG LEU 21 8.825 -9.231 -6.517
186 1HD1 LEU 21 1HD1 LEU 21 6.216 -10.805 -6.365
187 2HD1 LEU 21 2HD1 LEU 21 7.612 -11.198 -7.397
188 3HD1 LEU 21 3HD1 LEU 21 7.762 -11.285 -5.626
189 1HD2 LEU 21 1HD2 LEU 21 7.421 -7.490 -7.573
190 2HD2 LEU 21 2HD2 LEU 21 7.412 -8.990 -8.530
191 3HD2 LEU 21 3HD2 LEU 21 6.016 -8.580 -7.506
192 H PHE 22 H PHE 22 3.832 -7.916 -3.517
193 HA PHE 22 HA PHE 22 4.514 -9.366 -1.005
194 1HB PHE 22 1HB PHE 22 5.718 -6.869 -1.556
195 2HB PHE 22 2HB PHE 22 4.331 -6.437 -0.536
196 HD1 PHE 22 HD1 PHE 22 6.231 -9.652 -0.433
197 HD2 PHE 22 HD2 PHE 22 5.448 -5.872 1.491
198 HE1 PHE 22 HE1 PHE 22 7.465 -10.422 1.587
199 HE2 PHE 22 HE2 PHE 22 6.683 -6.644 3.510
200 HZ PHE 22 HZ PHE 22 7.692 -8.919 3.557
201 HA PRO 23 HA PRO 23 0.163 -9.070 -0.955
202 1HB PRO 23 1HB PRO 23 -0.200 -9.899 1.616
203 2HB PRO 23 2HB PRO 23 0.150 -10.993 0.198
204 1HG PRO 23 1HG PRO 23 1.967 -9.904 2.327
205 2HG PRO 23 2HG PRO 23 1.884 -11.583 1.639
206 1HD PRO 23 1HD PRO 23 3.805 -9.774 0.779
207 2HD PRO 23 2HD PRO 23 3.084 -10.955 -0.313
208 HA PRO 24 HA PRO 24 -0.236 -5.954 2.588
209 1HB PRO 24 1HB PRO 24 1.946 -4.490 3.209
210 2HB PRO 24 2HB PRO 24 1.466 -6.016 4.081
211 1HG PRO 24 1HG PRO 24 3.628 -5.524 2.062
212 2HG PRO 24 2HG PRO 24 3.611 -6.653 3.463
213 1HD PRO 24 1HD PRO 24 3.055 -7.387 0.735
214 2HD PRO 24 2HD PRO 24 2.542 -8.353 2.197
215 H ALA 25 H ALA 25 2.070 -5.465 -0.052
216 HA ALA 25 HA ALA 25 0.943 -2.674 -0.424
217 1HB ALA 25 1HB ALA 25 3.176 -4.264 -1.807
218 2HB ALA 25 2HB ALA 25 2.829 -2.540 -2.081
219 3HB ALA 25 3HB ALA 25 3.418 -3.088 -0.493
220 H ALA 26 H ALA 26 0.695 -5.925 -1.649
221 HA ALA 26 HA ALA 26 -0.107 -5.463 -4.371
222 1HB ALA 26 1HB ALA 26 -1.259 -7.355 -2.251
223 2HB ALA 26 2HB ALA 26 -1.391 -7.577 -4.012
224 3HB ALA 26 3HB ALA 26 0.201 -7.670 -3.221
225 HA PRO 27 HA PRO 27 -4.589 -4.674 -2.869
226 1HB PRO 27 1HB PRO 27 -4.835 -3.511 -0.450
227 2HB PRO 27 2HB PRO 27 -4.972 -5.307 -0.758
228 1HG PRO 27 1HG PRO 27 -2.683 -3.668 0.298
229 2HG PRO 27 2HG PRO 27 -3.310 -5.267 0.889
230 1HD PRO 27 1HD PRO 27 -1.084 -5.123 -0.751
231 2HD PRO 27 2HD PRO 27 -2.235 -6.453 -0.863
232 H LEU 28 H LEU 28 -1.790 -2.702 -2.039
233 HA LEU 28 HA LEU 28 -3.278 -0.190 -2.242
234 1HB LEU 28 1HB LEU 28 -0.347 -1.027 -2.531
235 2HB LEU 28 2HB LEU 28 -0.846 0.676 -2.670
236 HG LEU 28 HG LEU 28 -1.587 -1.059 -0.275
237 1HD1 LEU 28 1HD1 LEU 28 0.784 0.834 -0.593
238 2HD1 LEU 28 2HD1 LEU 28 0.287 0.030 0.914
239 3HD1 LEU 28 3HD1 LEU 28 0.882 -0.938 -0.456
240 1HD2 LEU 28 1HD2 LEU 28 -2.937 0.982 -0.677
241 2HD2 LEU 28 2HD2 LEU 28 -1.934 1.153 0.783
242 3HD2 LEU 28 3HD2 LEU 28 -1.447 1.956 -0.728
243 H ALA 29 H ALA 29 -1.233 -2.108 -4.513
244 HA ALA 29 HA ALA 29 -1.651 -0.377 -6.747
245 1HB ALA 29 1HB ALA 29 -1.469 -3.459 -6.597
246 2HB ALA 29 2HB ALA 29 -1.149 -2.512 -8.070
247 3HB ALA 29 3HB ALA 29 -0.073 -2.357 -6.660
248 H HIS 30 H HIS 30 -3.562 -2.921 -5.244
249 HA HIS 30 HA HIS 30 -5.619 -3.282 -7.188
250 1HB HIS 30 1HB HIS 30 -5.029 -4.007 -4.547
251 2HB HIS 30 2HB HIS 30 -6.438 -2.950 -4.309
252 HD1 HIS 30 HD1 HIS 30 -5.378 -6.297 -5.646
253 HD2 HIS 30 HD2 HIS 30 -8.863 -3.904 -5.570
254 HE1 HIS 30 HE1 HIS 30 -7.347 -7.789 -6.338
255 H ALA 31 H ALA 31 -5.518 -0.919 -4.474
256 HA ALA 31 HA ALA 31 -7.964 0.427 -5.103
257 1HB ALA 31 1HB ALA 31 -5.264 1.549 -4.145
258 2HB ALA 31 2HB ALA 31 -6.840 2.343 -3.909
259 3HB ALA 31 3HB ALA 31 -6.490 0.801 -3.094
260 H ILE 32 H ILE 32 -4.701 0.875 -6.473
261 HA ILE 32 HA ILE 32 -5.487 3.172 -8.105
262 HB ILE 32 HB ILE 32 -3.356 1.050 -8.725
263 1HG1 ILE 32 1HG1 ILE 32 -3.672 2.729 -6.332
264 2HG1 ILE 32 2HG1 ILE 32 -2.538 1.389 -6.637
265 1HG2 ILE 32 1HG2 ILE 32 -3.414 4.082 -9.049
266 2HG2 ILE 32 2HG2 ILE 32 -2.071 3.010 -9.513
267 3HG2 ILE 32 3HG2 ILE 32 -3.635 2.895 -10.356
268 1HD1 ILE 32 1HD1 ILE 32 -2.216 4.257 -7.635
269 2HD1 ILE 32 2HD1 ILE 32 -1.322 3.523 -6.282
270 3HD1 ILE 32 3HD1 ILE 32 -1.083 2.917 -7.939
271 H GLY 33 H GLY 33 -5.764 -0.332 -8.483
272 1HA GLY 33 1HA GLY 33 -6.657 0.077 -11.344
273 2HA GLY 33 2HA GLY 33 -6.330 -1.485 -10.571
274 H GLU 34 H GLU 34 -8.134 0.607 -8.512
275 HA GLU 34 HA GLU 34 -10.412 -1.142 -8.405
276 1HB GLU 34 1HB GLU 34 -9.822 1.775 -7.826
277 2HB GLU 34 2HB GLU 34 -11.502 1.201 -7.689
278 1HG GLU 34 1HG GLU 34 -10.945 -0.377 -6.006
279 2HG GLU 34 2HG GLU 34 -9.200 -0.261 -6.362
280 HE2 GLU 34 HE2 GLU 34 -9.823 3.207 -4.890
281 H GLY 35 H GLY 35 -9.618 1.320 -10.802
282 1HA GLY 35 1HA GLY 35 -12.279 1.747 -11.791
283 2HA GLY 35 2HA GLY 35 -10.790 1.836 -12.779
284 H VAL 36 H VAL 36 -9.842 -0.791 -12.621
285 HA VAL 36 HA VAL 36 -11.630 -2.089 -14.516
286 HB VAL 36 HB VAL 36 -8.990 -2.291 -13.953
287 1HG1 VAL 36 1HG1 VAL 36 -10.182 -4.562 -12.325
288 2HG1 VAL 36 2HG1 VAL 36 -8.457 -4.313 -12.688
289 3HG1 VAL 36 3HG1 VAL 36 -9.329 -3.149 -11.663
290 1HG2 VAL 36 1HG2 VAL 36 -10.152 -3.383 -15.848
291 2HG2 VAL 36 2HG2 VAL 36 -8.955 -4.466 -15.100
292 3HG2 VAL 36 3HG2 VAL 36 -10.689 -4.685 -14.760
293 H ASP 37 H ASP 37 -10.981 -2.433 -11.038
294 HA ASP 37 HA ASP 37 -12.600 -4.757 -10.555
295 1HB ASP 37 1HB ASP 37 -11.450 -4.078 -8.626
296 2HB ASP 37 2HB ASP 37 -11.554 -2.359 -9.074
297 HD2 ASP 37 HD2 ASP 37 -14.454 -2.004 -7.131
298 H TYR 38 H TYR 38 -13.454 -1.285 -10.731
299 HA TYR 38 HA TYR 38 -16.231 -1.689 -10.001
300 1HB TYR 38 1HB TYR 38 -15.035 0.511 -10.136
301 2HB TYR 38 2HB TYR 38 -14.877 0.311 -11.902
302 HD1 TYR 38 HD1 TYR 38 -17.304 0.767 -9.108
303 HD2 TYR 38 HD2 TYR 38 -16.713 0.762 -13.378
304 HE1 TYR 38 HE1 TYR 38 -19.568 1.752 -9.421
305 HE2 TYR 38 HE2 TYR 38 -18.974 1.751 -13.693
306 HH TYR 38 HH TYR 38 -20.664 3.337 -11.436
307 H LEU 39 H LEU 39 -14.553 -1.655 -13.165
308 HA LEU 39 HA LEU 39 -16.981 -2.150 -14.718
309 1HB LEU 39 1HB LEU 39 -13.980 -2.305 -15.019
310 2HB LEU 39 2HB LEU 39 -14.947 -3.183 -16.227
311 HG LEU 39 HG LEU 39 -16.199 -0.648 -15.892
312 1HD1 LEU 39 1HD1 LEU 39 -13.179 -0.438 -16.266
313 2HD1 LEU 39 2HD1 LEU 39 -14.344 0.895 -16.444
314 3HD1 LEU 39 3HD1 LEU 39 -14.093 0.140 -14.852
315 1HD2 LEU 39 1HD2 LEU 39 -16.098 -2.019 -17.956
316 2HD2 LEU 39 2HD2 LEU 39 -15.512 -0.365 -18.256
317 3HD2 LEU 39 3HD2 LEU 39 -14.351 -1.704 -18.079
318 H LEU 40 H LEU 40 -14.615 -4.301 -13.133
319 HA LEU 40 HA LEU 40 -16.297 -6.636 -14.125
320 1HB LEU 40 1HB LEU 40 -13.446 -6.154 -13.211
321 2HB LEU 40 2HB LEU 40 -14.129 -7.780 -12.980
322 HG LEU 40 HG LEU 40 -14.768 -7.787 -15.428
323 1HD1 LEU 40 1HD1 LEU 40 -13.070 -5.253 -15.464
324 2HD1 LEU 40 2HD1 LEU 40 -13.713 -6.097 -16.893
325 3HD1 LEU 40 3HD1 LEU 40 -14.827 -5.329 -15.737
326 1HD2 LEU 40 1HD2 LEU 40 -12.679 -8.860 -14.631
327 2HD2 LEU 40 2HD2 LEU 40 -12.461 -8.150 -16.248
328 3HD2 LEU 40 3HD2 LEU 40 -11.816 -7.314 -14.815
329 H GLY 41 H GLY 41 -16.962 -4.706 -11.867
330 1HA GLY 41 1HA GLY 41 -16.764 -6.646 -9.559
331 2HA GLY 41 2HA GLY 41 -17.229 -4.932 -9.443
332 H ASP 42 H ASP 42 -19.078 -5.068 -11.757
333 HA ASP 42 HA ASP 42 -21.333 -6.429 -10.246
334 1HB ASP 42 1HB ASP 42 -21.293 -3.960 -11.083
335 2HB ASP 42 2HB ASP 42 -21.452 -4.647 -12.724
336 HD2 ASP 42 HD2 ASP 42 -24.570 -5.669 -10.484
337 H GLU 43 H GLU 43 -19.371 -8.017 -11.745
338 HA GLU 43 HA GLU 43 -21.074 -8.858 -14.101
339 1HB GLU 43 1HB GLU 43 -18.341 -9.919 -13.240
340 2HB GLU 43 2HB GLU 43 -19.022 -9.860 -14.885
341 1HG GLU 43 1HG GLU 43 -19.080 -7.206 -14.084
342 2HG GLU 43 2HG GLU 43 -17.555 -7.810 -13.377
343 HE2 GLU 43 HE2 GLU 43 -17.365 -7.109 -17.140
344 H ALA 44 H ALA 44 -19.958 -11.577 -14.075
345 HA ALA 44 HA ALA 44 -20.684 -13.677 -13.227
346 1HB ALA 44 1HB ALA 44 -20.484 -12.072 -10.615
347 2HB ALA 44 2HB ALA 44 -20.487 -13.848 -10.724
348 3HB ALA 44 3HB ALA 44 -19.132 -12.917 -11.404
349 H GLN 45 H GLN 45 -22.740 -11.855 -14.104
350 HA GLN 45 HA GLN 45 -24.979 -13.135 -12.608
351 1HB GLN 45 1HB GLN 45 -26.030 -10.785 -12.275
352 2HB GLN 45 2HB GLN 45 -24.589 -11.083 -11.283
353 1HG GLN 45 1HG GLN 45 -23.374 -9.515 -12.367
354 2HG GLN 45 2HG GLN 45 -23.992 -10.010 -13.966
355 1HE2 GLN 45 2HE2 GLN 45 -23.740 -7.212 -13.085
356 2HE2 GLN 45 1HE2 GLN 45 -25.397 -6.555 -13.003
357 H ALA 46 H ALA 46 -27.140 -12.077 -13.689
358 HA ALA 46 HA ALA 46 -28.342 -11.748 -15.650
359 1HB ALA 46 1HB ALA 46 -27.100 -10.789 -17.647
360 2HB ALA 46 2HB ALA 46 -26.687 -9.944 -16.137
361 3HB ALA 46 3HB ALA 46 -25.564 -11.144 -16.820
Start of MODEL 5
1 1H PHE 1 1H PHE 1 29.834 4.661 5.110
2 2H PHE 1 2H PHE 1 28.915 3.900 6.295
3 3H PHE 1 3H PHE 1 30.135 3.055 5.505
4 HA PHE 1 HA PHE 1 28.885 3.184 3.381
5 1HB PHE 1 2HB PHE 1 27.286 2.196 5.788
6 2HB PHE 1 1HB PHE 1 27.181 1.593 4.118
7 HD1 PHE 1 HD1 PHE 1 28.830 1.259 7.300
8 HD2 PHE 1 HD2 PHE 1 29.336 0.633 3.063
9 HE1 PHE 1 HE1 PHE 1 30.687 -0.334 7.758
10 HE2 PHE 1 HE2 PHE 1 31.188 -0.965 3.522
11 HZ PHE 1 HZ PHE 1 31.867 -1.445 5.869
12 H GLY 2 H GLY 2 26.799 3.697 2.405
13 1HA GLY 2 1HA GLY 2 25.355 5.873 3.946
14 2HA GLY 2 2HA GLY 2 25.818 6.102 2.231
15 H PHE 3 H PHE 3 24.708 3.088 3.761
16 HA PHE 3 HA PHE 3 22.880 2.415 1.637
17 1HB PHE 3 1HB PHE 3 22.841 1.781 4.646
18 2HB PHE 3 2HB PHE 3 21.987 0.840 3.402
19 HD1 PHE 3 HD1 PHE 3 24.487 0.293 5.448
20 HD2 PHE 3 HD2 PHE 3 24.001 0.859 1.199
21 HE1 PHE 3 HE1 PHE 3 26.556 -1.027 5.035
22 HE2 PHE 3 HE2 PHE 3 26.071 -0.461 0.788
23 HZ PHE 3 HZ PHE 3 27.349 -1.403 2.705
24 H LYS 4 H LYS 4 22.302 4.200 4.682
25 HA LYS 4 HA LYS 4 19.459 4.350 4.630
26 1HB LYS 4 1HB LYS 4 19.844 6.575 5.734
27 2HB LYS 4 2HB LYS 4 20.980 5.350 6.345
28 1HG LYS 4 1HG LYS 4 22.589 6.188 4.500
29 2HG LYS 4 2HG LYS 4 21.501 7.591 4.367
30 1HD LYS 4 1HD LYS 4 21.750 7.717 6.971
31 2HD LYS 4 2HD LYS 4 23.193 6.707 6.712
32 1HE LYS 4 1HE LYS 4 23.663 9.123 6.756
33 2HE LYS 4 2HE LYS 4 24.121 8.300 5.200
34 1HZ LYS 4 1HZ LYS 4 21.558 9.779 5.711
35 2HZ LYS 4 2HZ LYS 4 22.814 10.390 4.773
36 3HZ LYS 4 3HZ LYS 4 21.981 9.017 4.272
37 H ASP 5 H ASP 5 21.759 6.224 2.618
38 HA ASP 5 HA ASP 5 19.618 7.890 1.489
39 1HB ASP 5 1HB ASP 5 22.507 7.204 0.977
40 2HB ASP 5 2HB ASP 5 21.605 7.950 -0.371
41 HD2 ASP 5 HD2 ASP 5 21.638 11.029 1.296
42 H ILE 6 H ILE 6 21.217 4.850 0.533
43 HA ILE 6 HA ILE 6 19.790 4.682 -2.003
44 HB ILE 6 HB ILE 6 20.784 2.379 -0.223
45 1HG1 ILE 6 1HG1 ILE 6 22.267 4.655 -1.322
46 2HG1 ILE 6 2HG1 ILE 6 22.811 3.388 -0.195
47 1HG2 ILE 6 1HG2 ILE 6 20.777 2.793 -3.246
48 2HG2 ILE 6 2HG2 ILE 6 21.386 1.354 -2.395
49 3HG2 ILE 6 3HG2 ILE 6 19.654 1.754 -2.338
50 1HD1 ILE 6 1HD1 ILE 6 22.601 3.103 -3.228
51 2HD1 ILE 6 2HD1 ILE 6 24.109 3.316 -2.310
52 3HD1 ILE 6 3HD1 ILE 6 23.143 1.836 -2.103
53 H ILE 7 H ILE 7 19.173 3.496 1.317
54 HA ILE 7 HA ILE 7 16.846 1.926 0.731
55 HB ILE 7 HB ILE 7 17.453 3.781 3.115
56 1HG1 ILE 7 1HG1 ILE 7 18.874 1.528 2.098
57 2HG1 ILE 7 2HG1 ILE 7 19.128 2.367 3.650
58 1HG2 ILE 7 1HG2 ILE 7 15.753 1.255 2.934
59 2HG2 ILE 7 2HG2 ILE 7 16.092 2.180 4.417
60 3HG2 ILE 7 3HG2 ILE 7 15.132 2.914 3.110
61 1HD1 ILE 7 1HD1 ILE 7 17.129 0.113 3.151
62 2HD1 ILE 7 2HD1 ILE 7 18.681 -0.050 4.008
63 3HD1 ILE 7 3HD1 ILE 7 17.383 0.951 4.700
64 H ARG 8 H ARG 8 17.190 5.452 1.317
65 HA ARG 8 HA ARG 8 14.358 6.008 1.243
66 1HB ARG 8 1HB ARG 8 15.679 7.855 1.922
67 2HB ARG 8 2HB ARG 8 16.982 7.454 0.792
68 1HG ARG 8 1HG ARG 8 14.493 8.206 -0.577
69 2HG ARG 8 2HG ARG 8 15.126 9.494 0.478
70 1HD ARG 8 1HD ARG 8 17.124 8.032 -1.105
71 2HD ARG 8 2HD ARG 8 15.933 9.036 -2.049
72 HE ARG 8 HE ARG 8 16.625 11.041 -0.656
73 1HH1 ARG 8 1HH2 ARG 8 19.196 9.780 -1.969
74 2HH1 ARG 8 2HH2 ARG 8 20.322 9.842 -0.586
75 1HH2 ARG 8 2HH1 ARG 8 17.755 10.345 1.793
76 2HH2 ARG 8 1HH1 ARG 8 19.511 10.161 1.533
77 H ALA 9 H ALA 9 16.837 5.914 -1.361
78 HA ALA 9 HA ALA 9 14.955 6.591 -3.473
79 1HB ALA 9 1HB ALA 9 17.504 4.863 -3.464
80 2HB ALA 9 2HB ALA 9 16.782 5.597 -4.916
81 3HB ALA 9 3HB ALA 9 17.469 6.635 -3.644
82 H ILE 10 H ILE 10 16.068 3.494 -2.091
83 HA ILE 10 HA ILE 10 14.542 1.850 -3.944
84 HB ILE 10 HB ILE 10 15.438 1.406 -1.036
85 1HG1 ILE 10 1HG1 ILE 10 17.002 1.932 -3.274
86 2HG1 ILE 10 2HG1 ILE 10 17.545 1.059 -1.818
87 1HG2 ILE 10 1HG2 ILE 10 14.762 -0.592 -3.240
88 2HG2 ILE 10 2HG2 ILE 10 15.383 -0.998 -1.623
89 3HG2 ILE 10 3HG2 ILE 10 13.772 -0.263 -1.799
90 1HD1 ILE 10 1HD1 ILE 10 16.293 -0.214 -4.296
91 2HD1 ILE 10 2HD1 ILE 10 18.021 -0.251 -3.874
92 3HD1 ILE 10 3HD1 ILE 10 16.836 -1.086 -2.842
93 H ARG 11 H ARG 11 13.758 3.400 -0.818
94 HA ARG 11 HA ARG 11 11.245 2.047 -0.425
95 1HB ARG 11 1HB ARG 11 12.756 4.127 0.734
96 2HB ARG 11 2HB ARG 11 11.260 4.945 0.219
97 1HG ARG 11 1HG ARG 11 11.405 2.420 1.928
98 2HG ARG 11 2HG ARG 11 11.046 4.056 2.528
99 1HD ARG 11 1HD ARG 11 9.347 3.716 0.371
100 2HD ARG 11 2HD ARG 11 9.348 2.112 1.232
101 HE ARG 11 HE ARG 11 8.742 3.353 3.375
102 1HH1 ARG 11 1HH2 ARG 11 6.442 3.903 1.445
103 2HH1 ARG 11 2HH2 ARG 11 6.284 5.678 1.550
104 1HH2 ARG 11 2HH1 ARG 11 9.505 6.109 2.975
105 2HH2 ARG 11 1HH1 ARG 11 8.022 6.929 2.418
106 H ARG 12 H ARG 12 12.178 4.758 -2.524
107 HA ARG 12 HA ARG 12 9.315 5.226 -3.273
108 1HB ARG 12 1HB ARG 12 10.620 7.205 -3.358
109 2HB ARG 12 2HB ARG 12 12.072 6.336 -3.900
110 1HG ARG 12 1HG ARG 12 11.496 6.494 -6.114
111 2HG ARG 12 2HG ARG 12 9.765 6.261 -5.788
112 1HD ARG 12 1HD ARG 12 11.415 8.745 -5.391
113 2HD ARG 12 2HD ARG 12 10.086 8.453 -6.603
114 HE ARG 12 HE ARG 12 8.797 7.886 -4.188
115 1HH1 ARG 12 2HH1 ARG 12 10.869 9.617 -2.771
116 2HH1 ARG 12 1HH1 ARG 12 10.092 11.224 -2.792
117 1HH2 ARG 12 1HH2 ARG 12 7.800 10.342 -5.352
118 2HH2 ARG 12 2HH2 ARG 12 8.353 11.634 -4.254
119 H ILE 13 H ILE 13 12.283 3.912 -4.848
120 HA ILE 13 HA ILE 13 10.834 3.268 -7.320
121 HB ILE 13 HB ILE 13 13.391 3.522 -6.812
122 1HG1 ILE 13 1HG1 ILE 13 13.976 1.662 -8.450
123 2HG1 ILE 13 2HG1 ILE 13 12.273 1.160 -8.373
124 1HG2 ILE 13 1HG2 ILE 13 12.962 0.643 -5.923
125 2HG2 ILE 13 2HG2 ILE 13 14.534 1.449 -6.137
126 3HG2 ILE 13 3HG2 ILE 13 13.418 1.999 -4.866
127 1HD1 ILE 13 1HD1 ILE 13 13.279 3.921 -9.190
128 2HD1 ILE 13 2HD1 ILE 13 12.669 2.666 -10.296
129 3HD1 ILE 13 3HD1 ILE 13 11.573 3.418 -9.113
130 H ALA 14 H ALA 14 11.163 1.662 -4.203
131 HA ALA 14 HA ALA 14 10.237 -0.969 -5.325
132 1HB ALA 14 1HB ALA 14 10.550 0.112 -2.475
133 2HB ALA 14 2HB ALA 14 10.311 -1.596 -2.914
134 3HB ALA 14 3HB ALA 14 11.811 -0.760 -3.380
135 H VAL 15 H VAL 15 8.644 1.963 -4.374
136 HA VAL 15 HA VAL 15 6.348 1.034 -3.007
137 HB VAL 15 HB VAL 15 6.546 2.910 -5.415
138 1HG1 VAL 15 1HG1 VAL 15 4.398 2.668 -3.264
139 2HG1 VAL 15 2HG1 VAL 15 4.468 3.917 -4.530
140 3HG1 VAL 15 3HG1 VAL 15 4.210 2.212 -4.974
141 1HG2 VAL 15 1HG2 VAL 15 8.010 3.491 -3.489
142 2HG2 VAL 15 2HG2 VAL 15 6.679 4.659 -3.659
143 3HG2 VAL 15 3HG2 VAL 15 6.606 3.404 -2.400
144 HA PRO 16 HA PRO 16 4.348 -0.723 -6.919
145 1HB PRO 16 1HB PRO 16 5.892 -1.132 -9.112
146 2HB PRO 16 2HB PRO 16 4.931 0.388 -8.816
147 1HG PRO 16 1HG PRO 16 7.867 -0.165 -8.486
148 2HG PRO 16 2HG PRO 16 7.047 1.324 -9.098
149 1HD PRO 16 1HD PRO 16 7.976 0.998 -6.406
150 2HD PRO 16 2HD PRO 16 6.585 2.097 -6.867
151 H VAL 17 H VAL 17 7.864 -1.442 -6.829
152 HA VAL 17 HA VAL 17 7.636 -4.267 -7.376
153 HB VAL 17 HB VAL 17 9.558 -2.871 -5.428
154 1HG1 VAL 17 1HG1 VAL 17 9.926 -5.186 -7.378
155 2HG1 VAL 17 2HG1 VAL 17 11.184 -4.510 -6.318
156 3HG1 VAL 17 3HG1 VAL 17 9.772 -5.333 -5.612
157 1HG2 VAL 17 1HG2 VAL 17 9.321 -1.518 -7.498
158 2HG2 VAL 17 2HG2 VAL 17 10.921 -2.292 -7.417
159 3HG2 VAL 17 3HG2 VAL 17 9.662 -2.963 -8.479
160 H VAL 18 H VAL 18 7.124 -2.413 -4.387
161 HA VAL 18 HA VAL 18 7.094 -4.700 -2.645
162 HB VAL 18 HB VAL 18 5.628 -1.980 -2.656
163 1HG1 VAL 18 1HG1 VAL 18 6.020 -3.908 -0.334
164 2HG1 VAL 18 2HG1 VAL 18 5.323 -2.273 -0.234
165 3HG1 VAL 18 3HG1 VAL 18 4.473 -3.549 -1.137
166 1HG2 VAL 18 1HG2 VAL 18 8.111 -1.895 -2.649
167 2HG2 VAL 18 2HG2 VAL 18 7.439 -1.322 -1.104
168 3HG2 VAL 18 3HG2 VAL 18 8.139 -2.955 -1.219
169 H SER 19 H SER 19 4.518 -3.024 -4.501
170 HA SER 19 HA SER 19 2.362 -4.782 -3.683
171 1HB SER 19 1HB SER 19 2.858 -3.470 -6.406
172 2HB SER 19 2HB SER 19 1.280 -3.770 -5.630
173 HG SER 19 HG SER 19 2.844 -1.556 -5.439
174 H THR 20 H THR 20 5.048 -5.285 -5.916
175 HA THR 20 HA THR 20 3.625 -7.722 -7.044
176 HB THR 20 HB THR 20 6.282 -7.422 -8.015
177 HG1 THR 20 HG1 THR 20 6.083 -5.031 -8.616
178 1HG2 THR 20 1HG2 THR 20 5.158 -6.578 -10.054
179 2HG2 THR 20 2HG2 THR 20 4.262 -7.946 -9.353
180 3HG2 THR 20 3HG2 THR 20 3.674 -6.284 -9.116
181 H LEU 21 H LEU 21 6.216 -6.862 -4.779
182 HA LEU 21 HA LEU 21 6.924 -9.842 -4.634
183 1HB LEU 21 1HB LEU 21 8.313 -7.301 -3.624
184 2HB LEU 21 2HB LEU 21 8.981 -8.945 -3.538
185 HG LEU 21 HG LEU 21 8.386 -7.305 -6.033
186 1HD1 LEU 21 1HD1 LEU 21 10.909 -8.636 -4.945
187 2HD1 LEU 21 2HD1 LEU 21 10.795 -7.710 -6.460
188 3HD1 LEU 21 3HD1 LEU 21 10.552 -6.894 -4.897
189 1HD2 LEU 21 1HD2 LEU 21 7.620 -9.643 -6.362
190 2HD2 LEU 21 2HD2 LEU 21 9.085 -9.311 -7.315
191 3HD2 LEU 21 3HD2 LEU 21 9.199 -10.239 -5.801
192 H PHE 22 H PHE 22 5.730 -7.102 -2.688
193 HA PHE 22 HA PHE 22 5.994 -8.686 -0.195
194 1HB PHE 22 1HB PHE 22 4.719 -6.078 -1.093
195 2HB PHE 22 2HB PHE 22 4.289 -6.741 0.500
196 HD1 PHE 22 HD1 PHE 22 7.504 -6.643 -1.472
197 HD2 PHE 22 HD2 PHE 22 5.443 -5.614 2.174
198 HE1 PHE 22 HE1 PHE 22 9.625 -5.754 -0.523
199 HE2 PHE 22 HE2 PHE 22 7.566 -4.724 3.122
200 HZ PHE 22 HZ PHE 22 9.656 -4.795 1.773
201 HA PRO 23 HA PRO 23 2.383 -11.147 -1.208
202 1HB PRO 23 1HB PRO 23 2.505 -12.557 1.062
203 2HB PRO 23 2HB PRO 23 3.501 -12.896 -0.429
204 1HG PRO 23 1HG PRO 23 4.216 -11.501 2.130
205 2HG PRO 23 2HG PRO 23 5.174 -12.721 1.182
206 1HD PRO 23 1HD PRO 23 5.712 -10.008 0.960
207 2HD PRO 23 2HD PRO 23 5.853 -11.093 -0.421
208 HA PRO 24 HA PRO 24 0.042 -9.531 2.464
209 1HB PRO 24 1HB PRO 24 1.056 -7.496 3.936
210 2HB PRO 24 2HB PRO 24 1.338 -9.248 4.328
211 1HG PRO 24 1HG PRO 24 3.196 -7.200 3.223
212 2HG PRO 24 2HG PRO 24 3.564 -8.701 4.134
213 1HD PRO 24 1HD PRO 24 3.635 -8.332 1.225
214 2HD PRO 24 2HD PRO 24 3.859 -9.895 2.140
215 H ALA 25 H ALA 25 1.621 -7.801 0.060
216 HA ALA 25 HA ALA 25 -0.461 -5.569 0.315
217 1HB ALA 25 1HB ALA 25 2.337 -5.609 -0.955
218 2HB ALA 25 2HB ALA 25 1.258 -4.194 -0.899
219 3HB ALA 25 3HB ALA 25 1.935 -4.857 0.608
220 H ALA 26 H ALA 26 1.346 -7.700 -1.901
221 HA ALA 26 HA ALA 26 0.129 -6.862 -4.384
222 1HB ALA 26 1HB ALA 26 0.846 -9.655 -3.363
223 2HB ALA 26 2HB ALA 26 0.684 -9.183 -5.071
224 3HB ALA 26 3HB ALA 26 1.993 -8.500 -4.080
225 HA PRO 27 HA PRO 27 -3.471 -9.932 -3.633
226 1HB PRO 27 1HB PRO 27 -4.211 -10.292 -1.080
227 2HB PRO 27 2HB PRO 27 -3.085 -11.400 -1.998
228 1HG PRO 27 1HG PRO 27 -2.502 -9.245 0.015
229 2HG PRO 27 2HG PRO 27 -1.767 -10.895 -0.135
230 1HD PRO 27 1HD PRO 27 -0.471 -8.645 -1.106
231 2HD PRO 27 2HD PRO 27 -0.336 -10.215 -1.896
232 H LEU 28 H LEU 28 -3.150 -7.519 -0.942
233 HA LEU 28 HA LEU 28 -5.962 -6.775 -1.300
234 1HB LEU 28 1HB LEU 28 -5.299 -4.782 0.126
235 2HB LEU 28 2HB LEU 28 -4.752 -6.309 0.810
236 HG LEU 28 HG LEU 28 -2.559 -5.773 -0.614
237 1HD1 LEU 28 1HD1 LEU 28 -3.775 -3.035 -0.042
238 2HD1 LEU 28 2HD1 LEU 28 -2.120 -3.341 -0.618
239 3HD1 LEU 28 3HD1 LEU 28 -3.510 -3.735 -1.656
240 1HD2 LEU 28 1HD2 LEU 28 -2.726 -6.054 1.853
241 2HD2 LEU 28 2HD2 LEU 28 -1.670 -4.684 1.431
242 3HD2 LEU 28 3HD2 LEU 28 -3.331 -4.386 1.997
243 H ALA 29 H ALA 29 -2.852 -5.626 -2.668
244 HA ALA 29 HA ALA 29 -3.948 -3.336 -3.977
245 1HB ALA 29 1HB ALA 29 -1.821 -5.368 -4.919
246 2HB ALA 29 2HB ALA 29 -1.975 -3.718 -5.566
247 3HB ALA 29 3HB ALA 29 -1.503 -3.968 -3.868
248 H HIS 30 H HIS 30 -3.881 -6.779 -4.735
249 HA HIS 30 HA HIS 30 -4.977 -6.690 -7.387
250 1HB HIS 30 1HB HIS 30 -4.164 -8.585 -5.549
251 2HB HIS 30 2HB HIS 30 -5.926 -8.755 -5.374
252 HD1 HIS 30 HD1 HIS 30 -3.170 -8.905 -8.034
253 HD2 HIS 30 HD2 HIS 30 -7.163 -10.154 -7.442
254 HE1 HIS 30 HE1 HIS 30 -3.803 -10.408 -10.016
255 H ALA 31 H ALA 31 -6.577 -6.814 -4.180
256 HA ALA 31 HA ALA 31 -9.277 -6.819 -5.266
257 1HB ALA 31 1HB ALA 31 -8.117 -5.701 -2.647
258 2HB ALA 31 2HB ALA 31 -9.833 -6.089 -2.916
259 3HB ALA 31 3HB ALA 31 -8.618 -7.389 -2.906
260 H ILE 32 H ILE 32 -6.993 -4.213 -4.415
261 HA ILE 32 HA ILE 32 -8.849 -2.022 -4.644
262 HB ILE 32 HB ILE 32 -5.905 -2.228 -5.513
263 1HG1 ILE 32 1HG1 ILE 32 -7.106 -2.668 -2.971
264 2HG1 ILE 32 2HG1 ILE 32 -5.373 -2.470 -3.331
265 1HG2 ILE 32 1HG2 ILE 32 -7.555 0.149 -4.547
266 2HG2 ILE 32 2HG2 ILE 32 -5.818 0.175 -4.935
267 3HG2 ILE 32 3HG2 ILE 32 -7.013 -0.126 -6.219
268 1HD1 ILE 32 1HD1 ILE 32 -7.348 -0.207 -2.781
269 2HD1 ILE 32 2HD1 ILE 32 -6.126 -0.816 -1.639
270 3HD1 ILE 32 3HD1 ILE 32 -5.616 -0.009 -3.141
271 H GLY 33 H GLY 33 -7.249 -3.996 -7.133
272 1HA GLY 33 1HA GLY 33 -8.493 -2.175 -9.204
273 2HA GLY 33 2HA GLY 33 -7.224 -3.394 -9.515
274 H GLU 34 H GLU 34 -10.065 -3.972 -7.474
275 HA GLU 34 HA GLU 34 -11.734 -5.675 -7.700
276 1HB GLU 34 1HB GLU 34 -11.487 -4.469 -10.500
277 2HB GLU 34 2HB GLU 34 -12.791 -5.595 -10.044
278 1HG GLU 34 1HG GLU 34 -12.267 -3.240 -8.263
279 2HG GLU 34 2HG GLU 34 -13.087 -2.950 -9.826
280 HE2 GLU 34 HE2 GLU 34 -15.848 -4.960 -8.720
281 H GLY 35 H GLY 35 -8.818 -6.438 -8.227
282 1HA GLY 35 1HA GLY 35 -8.957 -8.422 -10.361
283 2HA GLY 35 2HA GLY 35 -7.731 -8.352 -9.054
284 H VAL 36 H VAL 36 -9.082 -8.666 -6.762
285 HA VAL 36 HA VAL 36 -9.775 -11.473 -6.785
286 HB VAL 36 HB VAL 36 -10.649 -9.314 -4.773
287 1HG1 VAL 36 1HG1 VAL 36 -9.821 -12.230 -4.426
288 2HG1 VAL 36 2HG1 VAL 36 -10.300 -11.123 -3.117
289 3HG1 VAL 36 3HG1 VAL 36 -11.487 -11.608 -4.352
290 1HG2 VAL 36 1HG2 VAL 36 -8.262 -8.991 -5.380
291 2HG2 VAL 36 2HG2 VAL 36 -8.423 -9.599 -3.715
292 3HG2 VAL 36 3HG2 VAL 36 -7.940 -10.705 -5.024
293 H ASP 37 H ASP 37 -11.701 -8.471 -6.888
294 HA ASP 37 HA ASP 37 -14.294 -9.746 -6.677
295 1HB ASP 37 1HB ASP 37 -13.272 -7.193 -6.905
296 2HB ASP 37 2HB ASP 37 -13.945 -7.424 -8.545
297 HD2 ASP 37 HD2 ASP 37 -16.559 -6.569 -5.866
298 H TYR 38 H TYR 38 -12.220 -8.970 -9.490
299 HA TYR 38 HA TYR 38 -14.028 -9.832 -11.527
300 1HB TYR 38 1HB TYR 38 -11.549 -8.838 -11.521
301 2HB TYR 38 2HB TYR 38 -11.054 -10.547 -11.508
302 HD1 TYR 38 HD1 TYR 38 -12.466 -12.060 -13.265
303 HD2 TYR 38 HD2 TYR 38 -11.751 -7.820 -13.587
304 HE1 TYR 38 HE1 TYR 38 -12.862 -12.181 -15.719
305 HE2 TYR 38 HE2 TYR 38 -12.143 -7.939 -16.040
306 HH TYR 38 HH TYR 38 -13.678 -10.526 -17.574
307 H LEU 39 H LEU 39 -11.699 -11.716 -9.577
308 HA LEU 39 HA LEU 39 -12.368 -14.251 -10.846
309 1HB LEU 39 1HB LEU 39 -10.978 -13.191 -8.394
310 2HB LEU 39 2HB LEU 39 -11.508 -14.885 -8.295
311 HG LEU 39 HG LEU 39 -10.304 -15.383 -10.412
312 1HD1 LEU 39 1HD1 LEU 39 -9.397 -12.478 -10.204
313 2HD1 LEU 39 2HD1 LEU 39 -8.809 -13.671 -11.387
314 3HD1 LEU 39 3HD1 LEU 39 -10.505 -13.134 -11.433
315 1HD2 LEU 39 1HD2 LEU 39 -9.127 -15.633 -8.244
316 2HD2 LEU 39 2HD2 LEU 39 -8.006 -15.123 -9.528
317 3HD2 LEU 39 3HD2 LEU 39 -8.594 -13.938 -8.338
318 H LEU 40 H LEU 40 -13.676 -12.452 -8.060
319 HA LEU 40 HA LEU 40 -15.428 -14.612 -7.172
320 1HB LEU 40 1HB LEU 40 -14.947 -11.709 -6.729
321 2HB LEU 40 2HB LEU 40 -16.660 -12.143 -6.544
322 HG LEU 40 HG LEU 40 -15.265 -12.310 -4.417
323 1HD1 LEU 40 1HD1 LEU 40 -16.548 -14.872 -5.467
324 2HD1 LEU 40 2HD1 LEU 40 -16.256 -14.481 -3.755
325 3HD1 LEU 40 3HD1 LEU 40 -17.412 -13.516 -4.704
326 1HD2 LEU 40 1HD2 LEU 40 -13.213 -13.209 -5.475
327 2HD2 LEU 40 2HD2 LEU 40 -13.811 -14.301 -4.203
328 3HD2 LEU 40 3HD2 LEU 40 -14.091 -14.692 -5.917
329 H GLY 41 H GLY 41 -15.741 -11.992 -9.560
330 1HA GLY 41 1HA GLY 41 -17.286 -11.932 -11.389
331 2HA GLY 41 2HA GLY 41 -17.943 -13.495 -10.871
332 H ASP 42 H ASP 42 -17.806 -11.371 -8.225
333 HA ASP 42 HA ASP 42 -19.688 -10.509 -6.969
334 1HB ASP 42 1HB ASP 42 -19.011 -9.041 -9.309
335 2HB ASP 42 2HB ASP 42 -20.793 -9.085 -9.277
336 HD2 ASP 42 HD2 ASP 42 -19.261 -7.511 -5.947
337 H GLU 43 H GLU 43 -20.249 -13.096 -8.197
338 HA GLU 43 HA GLU 43 -22.153 -14.401 -8.855
339 1HB GLU 43 1HB GLU 43 -23.785 -12.406 -7.255
340 2HB GLU 43 2HB GLU 43 -23.806 -14.185 -7.175
341 1HG GLU 43 1HG GLU 43 -21.283 -13.812 -6.365
342 2HG GLU 43 2HG GLU 43 -21.936 -12.225 -5.874
343 HE2 GLU 43 HE2 GLU 43 -23.021 -15.348 -3.740
344 H ALA 44 H ALA 44 -21.505 -12.125 -10.654
345 HA ALA 44 HA ALA 44 -24.127 -10.965 -11.416
346 1HB ALA 44 1HB ALA 44 -21.424 -11.200 -12.861
347 2HB ALA 44 2HB ALA 44 -22.744 -10.106 -13.340
348 3HB ALA 44 3HB ALA 44 -21.900 -9.859 -11.793
349 H GLN 45 H GLN 45 -22.274 -13.841 -12.205
350 HA GLN 45 HA GLN 45 -24.485 -14.516 -14.177
351 1HB GLN 45 1HB GLN 45 -21.702 -15.689 -14.418
352 2HB GLN 45 2HB GLN 45 -22.830 -15.222 -15.714
353 1HG GLN 45 1HG GLN 45 -22.418 -12.794 -15.033
354 2HG GLN 45 2HG GLN 45 -21.097 -13.396 -14.001
355 1HE2 GLN 45 2HE2 GLN 45 -22.233 -14.269 -17.359
356 2HE2 GLN 45 1HE2 GLN 45 -20.622 -14.058 -18.094
357 H ALA 46 H ALA 46 -24.823 -15.113 -11.564
358 HA ALA 46 HA ALA 46 -25.420 -16.968 -10.282
359 1HB ALA 46 1HB ALA 46 -25.111 -19.275 -11.287
360 2HB ALA 46 2HB ALA 46 -25.861 -18.144 -12.438
361 3HB ALA 46 3HB ALA 46 -24.134 -18.546 -12.583
Start of MODEL 6
1 1H PHE 1 1H PHE 1 25.179 9.386 -1.771
2 2H PHE 1 2H PHE 1 25.614 10.829 -1.025
3 3H PHE 1 3H PHE 1 26.643 10.119 -2.151
4 HA PHE 1 HA PHE 1 27.009 8.203 -0.635
5 1HB PHE 1 2HB PHE 1 28.069 10.750 -0.605
6 2HB PHE 1 1HB PHE 1 27.456 10.614 1.062
7 HD1 PHE 1 HD1 PHE 1 28.657 9.394 2.679
8 HD2 PHE 1 HD2 PHE 1 29.505 8.796 -1.509
9 HE1 PHE 1 HE1 PHE 1 30.595 7.953 3.275
10 HE2 PHE 1 HE2 PHE 1 31.444 7.356 -0.909
11 HZ PHE 1 HZ PHE 1 31.991 6.936 1.484
12 H GLY 2 H GLY 2 26.874 7.706 1.793
13 1HA GLY 2 1HA GLY 2 25.536 7.613 3.765
14 2HA GLY 2 2HA GLY 2 24.431 8.837 3.063
15 H PHE 3 H PHE 3 24.909 5.478 3.693
16 HA PHE 3 HA PHE 3 23.380 4.328 1.511
17 1HB PHE 3 1HB PHE 3 24.127 3.647 4.359
18 2HB PHE 3 2HB PHE 3 22.840 2.676 3.605
19 HD1 PHE 3 HD1 PHE 3 26.231 4.088 2.727
20 HD2 PHE 3 HD2 PHE 3 23.477 0.781 2.427
21 HE1 PHE 3 HE1 PHE 3 27.938 2.779 1.476
22 HE2 PHE 3 HE2 PHE 3 25.187 -0.528 1.179
23 HZ PHE 3 HZ PHE 3 27.418 0.471 0.704
24 H LYS 4 H LYS 4 22.366 5.898 4.551
25 HA LYS 4 HA LYS 4 19.627 5.059 4.595
26 1HB LYS 4 1HB LYS 4 21.122 7.630 5.267
27 2HB LYS 4 2HB LYS 4 19.364 7.534 5.505
28 1HG LYS 4 1HG LYS 4 21.430 5.638 6.713
29 2HG LYS 4 2HG LYS 4 20.576 6.935 7.581
30 1HD LYS 4 1HD LYS 4 18.437 5.634 6.523
31 2HD LYS 4 2HD LYS 4 19.566 4.270 6.646
32 1HE LYS 4 1HE LYS 4 18.521 6.088 8.792
33 2HE LYS 4 2HE LYS 4 18.452 4.276 8.669
34 1HZ LYS 4 1HZ LYS 4 20.949 5.916 8.955
35 2HZ LYS 4 2HZ LYS 4 20.280 5.014 10.205
36 3HZ LYS 4 3HZ LYS 4 20.886 4.240 8.842
37 H ASP 5 H ASP 5 21.175 7.519 2.501
38 HA ASP 5 HA ASP 5 18.562 8.373 1.442
39 1HB ASP 5 1HB ASP 5 21.465 8.841 1.019
40 2HB ASP 5 2HB ASP 5 20.494 8.988 -0.475
41 HD2 ASP 5 HD2 ASP 5 19.447 12.121 0.699
42 H ILE 6 H ILE 6 21.126 6.096 0.468
43 HA ILE 6 HA ILE 6 19.897 5.383 -2.049
44 HB ILE 6 HB ILE 6 21.479 3.569 -0.130
45 1HG1 ILE 6 1HG1 ILE 6 22.235 6.109 -1.426
46 2HG1 ILE 6 2HG1 ILE 6 23.058 5.205 -0.129
47 1HG2 ILE 6 1HG2 ILE 6 21.433 3.792 -3.172
48 2HG2 ILE 6 2HG2 ILE 6 22.427 2.658 -2.226
49 3HG2 ILE 6 3HG2 ILE 6 20.653 2.512 -2.213
50 1HD1 ILE 6 1HD1 ILE 6 23.157 4.536 -3.107
51 2HD1 ILE 6 2HD1 ILE 6 24.463 5.306 -2.175
52 3HD1 ILE 6 3HD1 ILE 6 23.978 3.632 -1.812
53 H ILE 7 H ILE 7 19.622 4.007 1.268
54 HA ILE 7 HA ILE 7 17.772 1.924 0.553
55 HB ILE 7 HB ILE 7 17.854 3.629 3.119
56 1HG1 ILE 7 1HG1 ILE 7 19.858 1.847 1.900
57 2HG1 ILE 7 2HG1 ILE 7 20.030 2.991 3.252
58 1HG2 ILE 7 1HG2 ILE 7 17.156 0.697 2.649
59 2HG2 ILE 7 2HG2 ILE 7 17.185 1.521 4.227
60 3HG2 ILE 7 3HG2 ILE 7 15.992 1.999 2.995
61 1HD1 ILE 7 1HD1 ILE 7 18.797 0.206 3.424
62 2HD1 ILE 7 2HD1 ILE 7 20.417 0.663 4.002
63 3HD1 ILE 7 3HD1 ILE 7 18.969 1.350 4.776
64 H ARG 8 H ARG 8 17.300 5.363 1.427
65 HA ARG 8 HA ARG 8 14.418 5.274 1.445
66 1HB ARG 8 1HB ARG 8 16.055 7.151 2.167
67 2HB ARG 8 2HB ARG 8 16.259 7.532 0.443
68 1HG ARG 8 1HG ARG 8 13.727 7.804 0.320
69 2HG ARG 8 2HG ARG 8 13.713 7.703 2.098
70 1HD ARG 8 1HD ARG 8 15.326 9.643 0.448
71 2HD ARG 8 2HD ARG 8 13.748 10.004 1.282
72 HE ARG 8 HE ARG 8 14.924 9.405 3.498
73 1HH1 ARG 8 1HH2 ARG 8 16.280 11.760 1.700
74 2HH1 ARG 8 2HH2 ARG 8 17.989 11.450 2.108
75 1HH2 ARG 8 2HH1 ARG 8 17.332 8.273 3.508
76 2HH2 ARG 8 1HH1 ARG 8 18.580 9.489 3.125
77 H ALA 9 H ALA 9 16.776 5.940 -1.186
78 HA ALA 9 HA ALA 9 14.763 6.336 -3.230
79 1HB ALA 9 1HB ALA 9 17.592 5.125 -3.360
80 2HB ALA 9 2HB ALA 9 16.713 5.795 -4.754
81 3HB ALA 9 3HB ALA 9 17.223 6.865 -3.426
82 H ILE 10 H ILE 10 16.505 3.424 -2.089
83 HA ILE 10 HA ILE 10 15.290 1.639 -4.016
84 HB ILE 10 HB ILE 10 16.229 1.192 -1.119
85 1HG1 ILE 10 1HG1 ILE 10 17.662 2.047 -3.409
86 2HG1 ILE 10 2HG1 ILE 10 18.342 1.448 -1.874
87 1HG2 ILE 10 1HG2 ILE 10 15.964 -0.763 -3.445
88 2HG2 ILE 10 2HG2 ILE 10 16.633 -1.140 -1.839
89 3HG2 ILE 10 3HG2 ILE 10 14.914 -0.711 -2.010
90 1HD1 ILE 10 1HD1 ILE 10 17.528 -0.281 -4.256
91 2HD1 ILE 10 2HD1 ILE 10 19.196 0.135 -3.800
92 3HD1 ILE 10 3HD1 ILE 10 18.207 -0.878 -2.723
93 H ARG 11 H ARG 11 14.277 2.754 -0.766
94 HA ARG 11 HA ARG 11 11.976 1.004 -0.630
95 1HB ARG 11 1HB ARG 11 12.879 2.297 1.307
96 2HB ARG 11 2HB ARG 11 12.539 3.827 0.475
97 1HG ARG 11 1HG ARG 11 10.845 3.026 2.278
98 2HG ARG 11 2HG ARG 11 10.191 3.577 0.723
99 1HD ARG 11 1HD ARG 11 10.063 1.314 -0.074
100 2HD ARG 11 2HD ARG 11 10.793 0.725 1.487
101 HE ARG 11 HE ARG 11 8.729 1.531 2.695
102 1HH1 ARG 11 2HH1 ARG 11 7.775 -0.282 0.310
103 2HH1 ARG 11 1HH1 ARG 11 6.424 0.699 -0.321
104 1HH2 ARG 11 1HH2 ARG 11 7.453 3.636 1.379
105 2HH2 ARG 11 2HH2 ARG 11 6.242 2.917 0.284
106 H ARG 12 H ARG 12 12.484 4.279 -1.972
107 HA ARG 12 HA ARG 12 9.667 4.635 -2.738
108 1HB ARG 12 1HB ARG 12 12.338 5.915 -3.106
109 2HB ARG 12 2HB ARG 12 11.236 6.167 -4.476
110 1HG ARG 12 1HG ARG 12 9.946 6.511 -1.839
111 2HG ARG 12 2HG ARG 12 11.258 7.671 -2.155
112 1HD ARG 12 1HD ARG 12 9.036 8.432 -2.905
113 2HD ARG 12 2HD ARG 12 10.282 8.321 -4.226
114 HE ARG 12 HE ARG 12 8.374 5.975 -3.715
115 1HH1 ARG 12 2HH1 ARG 12 8.138 8.833 -5.468
116 2HH1 ARG 12 1HH1 ARG 12 8.090 8.087 -7.088
117 1HH2 ARG 12 1HH2 ARG 12 9.002 4.874 -5.896
118 2HH2 ARG 12 2HH2 ARG 12 8.578 5.848 -7.331
119 H ILE 13 H ILE 13 12.557 3.372 -4.450
120 HA ILE 13 HA ILE 13 11.011 3.068 -6.949
121 HB ILE 13 HB ILE 13 13.580 3.351 -6.586
122 1HG1 ILE 13 1HG1 ILE 13 12.119 2.103 -8.600
123 2HG1 ILE 13 2HG1 ILE 13 13.826 2.607 -8.694
124 1HG2 ILE 13 1HG2 ILE 13 13.323 0.385 -5.968
125 2HG2 ILE 13 2HG2 ILE 13 14.843 1.282 -6.199
126 3HG2 ILE 13 3HG2 ILE 13 13.794 1.650 -4.809
127 1HD1 ILE 13 1HD1 ILE 13 12.822 -0.110 -7.728
128 2HD1 ILE 13 2HD1 ILE 13 13.568 0.216 -9.311
129 3HD1 ILE 13 3HD1 ILE 13 14.526 0.392 -7.822
130 H ALA 14 H ALA 14 11.645 1.113 -4.072
131 HA ALA 14 HA ALA 14 10.624 -1.378 -5.394
132 1HB ALA 14 1HB ALA 14 11.202 -0.609 -2.479
133 2HB ALA 14 2HB ALA 14 10.934 -2.264 -3.072
134 3HB ALA 14 3HB ALA 14 12.375 -1.357 -3.590
135 H VAL 15 H VAL 15 9.161 1.416 -3.976
136 HA VAL 15 HA VAL 15 6.958 0.350 -2.531
137 HB VAL 15 HB VAL 15 7.100 2.562 -4.640
138 1HG1 VAL 15 1HG1 VAL 15 4.967 2.026 -2.527
139 2HG1 VAL 15 2HG1 VAL 15 5.048 3.453 -3.587
140 3HG1 VAL 15 3HG1 VAL 15 4.756 1.843 -4.285
141 1HG2 VAL 15 1HG2 VAL 15 8.594 2.825 -2.677
142 2HG2 VAL 15 2HG2 VAL 15 7.279 4.023 -2.649
143 3HG2 VAL 15 3HG2 VAL 15 7.204 2.594 -1.591
144 HA PRO 16 HA PRO 16 4.530 -0.663 -6.486
145 1HB PRO 16 1HB PRO 16 5.895 -0.876 -8.808
146 2HB PRO 16 2HB PRO 16 5.077 0.652 -8.240
147 1HG PRO 16 1HG PRO 16 7.971 -0.156 -8.177
148 2HG PRO 16 2HG PRO 16 7.245 1.453 -8.571
149 1HD PRO 16 1HD PRO 16 8.332 0.880 -6.072
150 2HD PRO 16 2HD PRO 16 7.005 2.018 -6.299
151 H VAL 17 H VAL 17 7.964 -1.697 -6.633
152 HA VAL 17 HA VAL 17 7.350 -4.361 -7.586
153 HB VAL 17 HB VAL 17 9.558 -3.530 -5.617
154 1HG1 VAL 17 1HG1 VAL 17 9.500 -5.514 -7.935
155 2HG1 VAL 17 2HG1 VAL 17 10.900 -5.177 -6.888
156 3HG1 VAL 17 3HG1 VAL 17 9.440 -5.935 -6.206
157 1HG2 VAL 17 1HG2 VAL 17 9.367 -1.831 -7.422
158 2HG2 VAL 17 2HG2 VAL 17 10.857 -2.789 -7.596
159 3HG2 VAL 17 3HG2 VAL 17 9.457 -3.124 -8.642
160 H VAL 18 H VAL 18 7.663 -3.023 -4.278
161 HA VAL 18 HA VAL 18 7.182 -5.520 -2.899
162 HB VAL 18 HB VAL 18 6.546 -2.569 -2.269
163 1HG1 VAL 18 1HG1 VAL 18 6.765 -4.941 -0.371
164 2HG1 VAL 18 2HG1 VAL 18 6.550 -3.239 0.102
165 3HG1 VAL 18 3HG1 VAL 18 5.264 -4.084 -0.792
166 1HG2 VAL 18 1HG2 VAL 18 8.929 -3.064 -2.747
167 2HG2 VAL 18 2HG2 VAL 18 8.686 -2.657 -1.032
168 3HG2 VAL 18 3HG2 VAL 18 8.905 -4.354 -1.521
169 H SER 19 H SER 19 4.893 -2.947 -3.952
170 HA SER 19 HA SER 19 2.522 -4.294 -2.905
171 1HB SER 19 1HB SER 19 2.819 -2.557 -5.404
172 2HB SER 19 2HB SER 19 1.403 -2.665 -4.323
173 HG SER 19 HG SER 19 2.849 -0.732 -4.005
174 H THR 20 H THR 20 4.445 -4.904 -5.813
175 HA THR 20 HA THR 20 2.190 -6.685 -6.825
176 HB THR 20 HB THR 20 4.866 -6.142 -8.160
177 HG1 THR 20 HG1 THR 20 2.763 -4.313 -8.699
178 1HG2 THR 20 1HG2 THR 20 2.001 -6.377 -9.184
179 2HG2 THR 20 2HG2 THR 20 3.455 -6.190 -10.194
180 3HG2 THR 20 3HG2 THR 20 3.227 -7.666 -9.227
181 H LEU 21 H LEU 21 5.379 -6.846 -5.312
182 HA LEU 21 HA LEU 21 5.433 -9.815 -5.959
183 1HB LEU 21 1HB LEU 21 7.379 -7.652 -5.136
184 2HB LEU 21 2HB LEU 21 7.749 -9.312 -4.620
185 HG LEU 21 HG LEU 21 7.371 -10.006 -7.070
186 1HD1 LEU 21 1HD1 LEU 21 7.605 -6.986 -7.441
187 2HD1 LEU 21 2HD1 LEU 21 7.613 -8.199 -8.743
188 3HD1 LEU 21 3HD1 LEU 21 6.150 -7.962 -7.759
189 1HD2 LEU 21 1HD2 LEU 21 9.618 -9.792 -6.044
190 2HD2 LEU 21 2HD2 LEU 21 9.635 -9.263 -7.742
191 3HD2 LEU 21 3HD2 LEU 21 9.630 -8.057 -6.434
192 H PHE 22 H PHE 22 5.238 -7.503 -3.262
193 HA PHE 22 HA PHE 22 5.139 -9.847 -1.384
194 1HB PHE 22 1HB PHE 22 5.146 -6.787 -1.057
195 2HB PHE 22 2HB PHE 22 5.108 -7.912 0.315
196 HD1 PHE 22 HD1 PHE 22 6.902 -9.794 -1.853
197 HD2 PHE 22 HD2 PHE 22 7.290 -6.064 0.276
198 HE1 PHE 22 HE1 PHE 22 9.379 -9.997 -1.949
199 HE2 PHE 22 HE2 PHE 22 9.767 -6.266 0.178
200 HZ PHE 22 HZ PHE 22 10.814 -8.232 -0.935
201 HA PRO 23 HA PRO 23 0.691 -9.735 -1.918
202 1HB PRO 23 1HB PRO 23 0.244 -11.628 -0.082
203 2HB PRO 23 2HB PRO 23 0.733 -11.936 -1.813
204 1HG PRO 23 1HG PRO 23 2.353 -11.944 0.712
205 2HG PRO 23 2HG PRO 23 2.377 -13.126 -0.671
206 1HD PRO 23 1HD PRO 23 4.300 -11.134 -0.489
207 2HD PRO 23 2HD PRO 23 3.653 -11.644 -2.047
208 HA PRO 24 HA PRO 24 -0.016 -8.465 2.535
209 1HB PRO 24 1HB PRO 24 2.083 -7.510 3.956
210 2HB PRO 24 2HB PRO 24 1.521 -9.241 4.019
211 1HG PRO 24 1HG PRO 24 3.879 -8.007 2.639
212 2HG PRO 24 2HG PRO 24 3.723 -9.632 3.400
213 1HD PRO 24 1HD PRO 24 3.460 -9.089 0.583
214 2HD PRO 24 2HD PRO 24 2.792 -10.568 1.423
215 H ALA 25 H ALA 25 2.332 -7.044 0.383
216 HA ALA 25 HA ALA 25 1.623 -4.269 1.332
217 1HB ALA 25 1HB ALA 25 3.370 -5.361 -0.953
218 2HB ALA 25 2HB ALA 25 3.326 -3.661 -0.430
219 3HB ALA 25 3HB ALA 25 3.967 -4.912 0.662
220 H ALA 26 H ALA 26 0.957 -6.543 -1.284
221 HA ALA 26 HA ALA 26 -0.153 -4.820 -3.275
222 1HB ALA 26 1HB ALA 26 -1.219 -7.475 -2.179
223 2HB ALA 26 2HB ALA 26 -1.570 -6.809 -3.791
224 3HB ALA 26 3HB ALA 26 0.086 -7.312 -3.378
225 HA PRO 27 HA PRO 27 -4.372 -4.759 -1.009
226 1HB PRO 27 1HB PRO 27 -4.302 -5.060 1.662
227 2HB PRO 27 2HB PRO 27 -4.625 -6.410 0.473
228 1HG PRO 27 1HG PRO 27 -2.120 -5.664 1.959
229 2HG PRO 27 2HG PRO 27 -2.830 -7.308 1.675
230 1HD PRO 27 1HD PRO 27 -0.744 -6.356 0.120
231 2HD PRO 27 2HD PRO 27 -2.000 -7.400 -0.544
232 H LEU 28 H LEU 28 -1.347 -3.587 0.343
233 HA LEU 28 HA LEU 28 -2.714 -1.320 1.615
234 1HB LEU 28 1HB LEU 28 0.104 -2.221 0.995
235 2HB LEU 28 2HB LEU 28 -0.110 -0.480 1.282
236 HG LEU 28 HG LEU 28 -1.289 -1.039 3.440
237 1HD1 LEU 28 1HD1 LEU 28 -0.319 -3.856 2.781
238 2HD1 LEU 28 2HD1 LEU 28 -1.063 -3.343 4.315
239 3HD1 LEU 28 3HD1 LEU 28 -2.018 -3.324 2.813
240 1HD2 LEU 28 1HD2 LEU 28 1.127 -0.478 3.393
241 2HD2 LEU 28 2HD2 LEU 28 0.772 -1.686 4.651
242 3HD2 LEU 28 3HD2 LEU 28 1.519 -2.192 3.117
243 H ALA 29 H ALA 29 -0.812 -1.883 -1.384
244 HA ALA 29 HA ALA 29 -1.209 0.749 -2.433
245 1HB ALA 29 1HB ALA 29 -1.079 -2.000 -3.841
246 2HB ALA 29 2HB ALA 29 -0.762 -0.450 -4.656
247 3HB ALA 29 3HB ALA 29 0.333 -1.022 -3.376
248 H HIS 30 H HIS 30 -3.131 -2.193 -2.376
249 HA HIS 30 HA HIS 30 -5.245 -1.579 -4.169
250 1HB HIS 30 1HB HIS 30 -4.811 -3.649 -2.645
251 2HB HIS 30 2HB HIS 30 -5.423 -2.693 -1.285
252 HD1 HIS 30 HD1 HIS 30 -6.783 -3.074 -4.877
253 HD2 HIS 30 HD2 HIS 30 -7.961 -3.645 -0.858
254 HE1 HIS 30 HE1 HIS 30 -9.250 -3.787 -4.893
255 H ALA 31 H ALA 31 -5.018 -0.686 -0.689
256 HA ALA 31 HA ALA 31 -7.502 0.879 -0.748
257 1HB ALA 31 1HB ALA 31 -4.979 1.072 0.986
258 2HB ALA 31 2HB ALA 31 -6.574 1.742 1.408
259 3HB ALA 31 3HB ALA 31 -6.351 -0.020 1.292
260 H ILE 32 H ILE 32 -4.151 1.673 -1.608
261 HA ILE 32 HA ILE 32 -4.877 4.595 -1.690
262 HB ILE 32 HB ILE 32 -2.377 3.210 -2.765
263 1HG1 ILE 32 1HG1 ILE 32 -3.421 3.181 -0.033
264 2HG1 ILE 32 2HG1 ILE 32 -1.993 2.354 -0.705
265 1HG2 ILE 32 1HG2 ILE 32 -2.865 5.889 -1.393
266 2HG2 ILE 32 2HG2 ILE 32 -1.301 5.304 -2.007
267 3HG2 ILE 32 3HG2 ILE 32 -2.629 5.645 -3.140
268 1HD1 ILE 32 1HD1 ILE 32 -2.113 5.279 0.165
269 2HD1 ILE 32 2HD1 ILE 32 -1.339 3.960 1.074
270 3HD1 ILE 32 3HD1 ILE 32 -0.686 4.454 -0.506
271 H GLY 33 H GLY 33 -4.474 1.880 -3.955
272 1HA GLY 33 1HA GLY 33 -4.818 3.839 -6.219
273 2HA GLY 33 2HA GLY 33 -4.448 2.106 -6.379
274 H GLU 34 H GLU 34 -6.541 1.328 -4.426
275 HA GLU 34 HA GLU 34 -9.006 2.124 -6.004
276 1HB GLU 34 1HB GLU 34 -8.847 -0.724 -5.131
277 2HB GLU 34 2HB GLU 34 -9.255 -0.084 -6.734
278 1HG GLU 34 1HG GLU 34 -6.899 0.240 -7.256
279 2HG GLU 34 2HG GLU 34 -6.438 -0.268 -5.606
280 HE2 GLU 34 HE2 GLU 34 -7.946 -3.221 -7.833
281 H GLY 35 H GLY 35 -8.306 3.185 -3.500
282 1HA GLY 35 1HA GLY 35 -9.209 1.688 -1.242
283 2HA GLY 35 2HA GLY 35 -9.362 3.459 -1.395
284 H VAL 36 H VAL 36 -11.124 3.698 -3.544
285 HA VAL 36 HA VAL 36 -13.644 3.154 -2.214
286 HB VAL 36 HB VAL 36 -13.186 3.564 -5.224
287 1HG1 VAL 36 1HG1 VAL 36 -15.322 4.579 -3.298
288 2HG1 VAL 36 2HG1 VAL 36 -15.257 4.909 -5.045
289 3HG1 VAL 36 3HG1 VAL 36 -15.523 3.249 -4.462
290 1HG2 VAL 36 1HG2 VAL 36 -11.704 5.118 -3.974
291 2HG2 VAL 36 2HG2 VAL 36 -13.037 5.996 -4.762
292 3HG2 VAL 36 3HG2 VAL 36 -13.098 5.670 -3.014
293 H ASP 37 H ASP 37 -11.871 1.547 -4.865
294 HA ASP 37 HA ASP 37 -13.862 -0.455 -5.447
295 1HB ASP 37 1HB ASP 37 -11.778 0.013 -6.773
296 2HB ASP 37 2HB ASP 37 -10.784 -0.560 -5.408
297 HD2 ASP 37 HD2 ASP 37 -11.066 -3.718 -6.901
298 H TYR 38 H TYR 38 -11.168 -0.399 -3.097
299 HA TYR 38 HA TYR 38 -11.631 -3.070 -2.100
300 1HB TYR 38 1HB TYR 38 -9.605 -1.876 -1.518
301 2HB TYR 38 2HB TYR 38 -10.529 -0.457 -0.951
302 HD1 TYR 38 HD1 TYR 38 -10.648 -4.170 -0.288
303 HD2 TYR 38 HD2 TYR 38 -10.428 -0.193 1.365
304 HE1 TYR 38 HE1 TYR 38 -10.723 -5.122 2.009
305 HE2 TYR 38 HE2 TYR 38 -10.496 -1.145 3.663
306 HH TYR 38 HH TYR 38 -9.987 -3.228 4.853
307 H LEU 39 H LEU 39 -12.858 0.130 -1.039
308 HA LEU 39 HA LEU 39 -14.444 -0.902 1.140
309 1HB LEU 39 1HB LEU 39 -14.242 1.527 -0.594
310 2HB LEU 39 2HB LEU 39 -15.862 1.284 0.100
311 HG LEU 39 HG LEU 39 -14.967 1.251 2.357
312 1HD1 LEU 39 1HD1 LEU 39 -12.221 1.417 1.038
313 2HD1 LEU 39 2HD1 LEU 39 -12.540 1.460 2.788
314 3HD1 LEU 39 3HD1 LEU 39 -12.895 -0.014 1.855
315 1HD2 LEU 39 1HD2 LEU 39 -15.301 3.488 1.341
316 2HD2 LEU 39 2HD2 LEU 39 -13.939 3.500 2.486
317 3HD2 LEU 39 3HD2 LEU 39 -13.628 3.462 0.734
318 H LEU 40 H LEU 40 -15.092 -0.562 -2.348
319 HA LEU 40 HA LEU 40 -17.893 -1.366 -2.117
320 1HB LEU 40 1HB LEU 40 -16.944 -0.182 -4.092
321 2HB LEU 40 2HB LEU 40 -15.799 -1.514 -4.370
322 HG LEU 40 HG LEU 40 -17.564 -3.022 -5.001
323 1HD1 LEU 40 1HD1 LEU 40 -19.500 -0.845 -4.093
324 2HD1 LEU 40 2HD1 LEU 40 -19.953 -2.401 -4.829
325 3HD1 LEU 40 3HD1 LEU 40 -19.171 -2.366 -3.230
326 1HD2 LEU 40 1HD2 LEU 40 -16.931 -1.375 -6.739
327 2HD2 LEU 40 2HD2 LEU 40 -18.648 -1.820 -6.871
328 3HD2 LEU 40 3HD2 LEU 40 -18.187 -0.264 -6.143
329 H GLY 41 H GLY 41 -14.952 -3.145 -3.184
330 1HA GLY 41 1HA GLY 41 -16.500 -5.688 -2.687
331 2HA GLY 41 2HA GLY 41 -14.974 -5.553 -3.599
332 H ASP 42 H ASP 42 -16.096 -4.556 -0.316
333 HA ASP 42 HA ASP 42 -13.431 -5.218 0.795
334 1HB ASP 42 1HB ASP 42 -15.708 -3.699 1.486
335 2HB ASP 42 2HB ASP 42 -15.723 -5.033 2.669
336 HD2 ASP 42 HD2 ASP 42 -12.867 -2.328 3.028
337 H GLU 43 H GLU 43 -13.687 -7.457 -0.265
338 HA GLU 43 HA GLU 43 -13.850 -9.805 0.127
339 1HB GLU 43 1HB GLU 43 -14.490 -8.841 2.955
340 2HB GLU 43 2HB GLU 43 -13.990 -10.492 2.505
341 1HG GLU 43 1HG GLU 43 -11.822 -9.884 2.554
342 2HG GLU 43 2HG GLU 43 -12.137 -8.586 1.372
343 HE2 GLU 43 HE2 GLU 43 -11.934 -6.232 3.941
344 H ALA 44 H ALA 44 -16.444 -8.221 2.100
345 HA ALA 44 HA ALA 44 -18.309 -10.352 1.134
346 1HB ALA 44 1HB ALA 44 -18.659 -7.838 2.879
347 2HB ALA 44 2HB ALA 44 -19.876 -9.124 2.703
348 3HB ALA 44 3HB ALA 44 -18.321 -9.472 3.497
349 H GLN 45 H GLN 45 -20.631 -8.489 1.165
350 HA GLN 45 HA GLN 45 -21.815 -7.164 -0.410
351 1HB GLN 45 1HB GLN 45 -19.014 -6.174 -0.360
352 2HB GLN 45 2HB GLN 45 -19.837 -5.824 -1.895
353 1HG GLN 45 1HG GLN 45 -21.017 -4.181 -0.929
354 2HG GLN 45 2HG GLN 45 -21.642 -5.316 0.300
355 1HE2 GLN 45 2HE2 GLN 45 -18.368 -3.882 -0.453
356 2HE2 GLN 45 1HE2 GLN 45 -18.059 -3.380 1.231
357 H ALA 46 H ALA 46 -21.412 -6.487 -3.025
358 HA ALA 46 HA ALA 46 -20.206 -8.644 -4.529
359 1HB ALA 46 1HB ALA 46 -22.405 -9.674 -5.314
360 2HB ALA 46 2HB ALA 46 -22.161 -9.861 -3.562
361 3HB ALA 46 3HB ALA 46 -23.262 -8.607 -4.177
Start of MODEL 7
1 1H PHE 1 1H PHE 1 28.567 2.168 3.186
2 2H PHE 1 2H PHE 1 29.727 3.257 2.642
3 3H PHE 1 3H PHE 1 29.920 2.497 4.130
4 HA PHE 1 HA PHE 1 27.942 3.685 5.012
5 1HB PHE 1 2HB PHE 1 29.985 5.485 3.623
6 2HB PHE 1 1HB PHE 1 29.107 5.817 5.137
7 HD1 PHE 1 HD1 PHE 1 32.184 4.751 3.825
8 HD2 PHE 1 HD2 PHE 1 29.361 3.819 6.954
9 HE1 PHE 1 HE1 PHE 1 33.984 3.613 5.112
10 HE2 PHE 1 HE2 PHE 1 31.166 2.688 8.241
11 HZ PHE 1 HZ PHE 1 33.475 2.581 7.319
12 H GLY 2 H GLY 2 26.778 5.887 4.512
13 1HA GLY 2 1HA GLY 2 25.251 6.968 3.084
14 2HA GLY 2 2HA GLY 2 26.307 6.497 1.714
15 H PHE 3 H PHE 3 24.205 4.798 4.119
16 HA PHE 3 HA PHE 3 23.215 3.119 1.779
17 1HB PHE 3 1HB PHE 3 23.333 2.686 4.829
18 2HB PHE 3 2HB PHE 3 22.594 1.530 3.710
19 HD1 PHE 3 HD1 PHE 3 24.768 2.260 1.463
20 HD2 PHE 3 HD2 PHE 3 24.936 0.980 5.580
21 HE1 PHE 3 HE1 PHE 3 26.989 1.214 1.049
22 HE2 PHE 3 HE2 PHE 3 27.159 -0.056 5.167
23 HZ PHE 3 HZ PHE 3 28.185 0.054 2.900
24 H LYS 4 H LYS 4 22.115 4.698 4.830
25 HA LYS 4 HA LYS 4 19.312 4.281 4.501
26 1HB LYS 4 1HB LYS 4 21.143 6.363 5.691
27 2HB LYS 4 2HB LYS 4 19.439 6.835 5.511
28 1HG LYS 4 1HG LYS 4 18.685 5.160 6.974
29 2HG LYS 4 2HG LYS 4 20.133 4.157 6.735
30 1HD LYS 4 1HD LYS 4 21.316 5.271 8.349
31 2HD LYS 4 2HD LYS 4 20.674 6.853 7.864
32 1HE LYS 4 1HE LYS 4 20.034 5.954 10.151
33 2HE LYS 4 2HE LYS 4 18.713 6.580 9.072
34 1HZ LYS 4 1HZ LYS 4 19.543 3.707 9.332
35 2HZ LYS 4 2HZ LYS 4 18.135 4.336 10.005
36 3HZ LYS 4 3HZ LYS 4 18.321 4.287 8.334
37 H ASP 5 H ASP 5 21.332 6.876 3.065
38 HA ASP 5 HA ASP 5 19.150 8.246 1.772
39 1HB ASP 5 1HB ASP 5 21.101 8.853 0.105
40 2HB ASP 5 2HB ASP 5 21.333 9.285 1.808
41 HD2 ASP 5 HD2 ASP 5 23.787 6.638 0.284
42 H ILE 6 H ILE 6 21.192 5.509 0.658
43 HA ILE 6 HA ILE 6 19.854 5.331 -1.916
44 HB ILE 6 HB ILE 6 21.213 3.188 -0.162
45 1HG1 ILE 6 1HG1 ILE 6 22.243 5.564 -1.445
46 2HG1 ILE 6 2HG1 ILE 6 23.121 4.341 -0.494
47 1HG2 ILE 6 1HG2 ILE 6 20.830 3.337 -3.182
48 2HG2 ILE 6 2HG2 ILE 6 21.721 2.070 -2.305
49 3HG2 ILE 6 3HG2 ILE 6 19.965 2.241 -2.079
50 1HD1 ILE 6 1HD1 ILE 6 22.427 4.128 -3.461
51 2HD1 ILE 6 2HD1 ILE 6 24.036 4.502 -2.798
52 3HD1 ILE 6 3HD1 ILE 6 23.304 2.905 -2.510
53 H ILE 7 H ILE 7 19.325 3.779 1.275
54 HA ILE 7 HA ILE 7 17.202 2.021 0.441
55 HB ILE 7 HB ILE 7 17.486 3.597 3.068
56 1HG1 ILE 7 1HG1 ILE 7 19.277 1.688 1.808
57 2HG1 ILE 7 2HG1 ILE 7 19.473 2.552 3.351
58 1HG2 ILE 7 1HG2 ILE 7 16.331 0.840 2.463
59 2HG2 ILE 7 2HG2 ILE 7 16.454 1.585 4.075
60 3HG2 ILE 7 3HG2 ILE 7 15.387 2.299 2.843
61 1HD1 ILE 7 1HD1 ILE 7 17.868 -0.011 2.938
62 2HD1 ILE 7 2HD1 ILE 7 19.472 0.098 3.700
63 3HD1 ILE 7 3HD1 ILE 7 18.064 0.853 4.481
64 H ARG 8 H ARG 8 17.187 5.495 1.320
65 HA ARG 8 HA ARG 8 14.299 5.745 1.371
66 1HB ARG 8 1HB ARG 8 16.582 7.649 0.581
67 2HB ARG 8 2HB ARG 8 14.909 8.195 0.801
68 1HG ARG 8 1HG ARG 8 14.927 7.720 3.112
69 2HG ARG 8 2HG ARG 8 16.336 6.641 2.973
70 1HD ARG 8 1HD ARG 8 16.469 9.167 3.834
71 2HD ARG 8 2HD ARG 8 17.814 8.316 2.952
72 HE ARG 8 HE ARG 8 15.700 9.904 1.392
73 1HH1 ARG 8 2HH1 ARG 8 17.728 11.826 2.382
74 2HH1 ARG 8 1HH1 ARG 8 19.013 11.761 1.146
75 1HH2 ARG 8 1HH2 ARG 8 17.921 8.657 -0.169
76 2HH2 ARG 8 2HH2 ARG 8 19.122 9.970 -0.296
77 H ALA 9 H ALA 9 16.682 6.116 -1.290
78 HA ALA 9 HA ALA 9 14.589 6.701 -3.260
79 1HB ALA 9 1HB ALA 9 17.420 5.514 -3.518
80 2HB ALA 9 2HB ALA 9 16.497 6.233 -4.859
81 3HB ALA 9 3HB ALA 9 17.041 7.252 -3.504
82 H ILE 10 H ILE 10 16.314 3.774 -2.198
83 HA ILE 10 HA ILE 10 15.137 2.038 -4.196
84 HB ILE 10 HB ILE 10 16.921 1.921 -1.950
85 1HG1 ILE 10 1HG1 ILE 10 16.501 0.632 -4.396
86 2HG1 ILE 10 2HG1 ILE 10 17.837 0.327 -3.256
87 1HG2 ILE 10 1HG2 ILE 10 14.666 -0.109 -1.696
88 2HG2 ILE 10 2HG2 ILE 10 16.182 -0.103 -0.763
89 3HG2 ILE 10 3HG2 ILE 10 15.003 1.214 -0.555
90 1HD1 ILE 10 1HD1 ILE 10 15.122 -1.073 -3.232
91 2HD1 ILE 10 2HD1 ILE 10 16.648 -1.781 -3.816
92 3HD1 ILE 10 3HD1 ILE 10 16.457 -1.376 -2.093
93 H ARG 11 H ARG 11 14.056 3.164 -0.983
94 HA ARG 11 HA ARG 11 11.820 1.336 -0.826
95 1HB ARG 11 1HB ARG 11 12.758 2.826 1.009
96 2HB ARG 11 2HB ARG 11 12.103 4.242 0.150
97 1HG ARG 11 1HG ARG 11 9.965 2.375 0.376
98 2HG ARG 11 2HG ARG 11 10.752 2.435 1.971
99 1HD ARG 11 1HD ARG 11 9.569 4.648 0.335
100 2HD ARG 11 2HD ARG 11 9.168 4.114 2.032
101 HE ARG 11 HE ARG 11 11.812 4.763 2.381
102 1HH1 ARG 11 2HH1 ARG 11 9.789 6.881 3.158
103 2HH1 ARG 11 1HH1 ARG 11 10.311 8.285 2.188
104 1HH2 ARG 11 1HH2 ARG 11 12.261 6.322 -0.034
105 2HH2 ARG 11 2HH2 ARG 11 11.712 7.969 0.379
106 H ARG 12 H ARG 12 12.261 4.554 -2.312
107 HA ARG 12 HA ARG 12 9.455 4.822 -3.115
108 1HB ARG 12 1HB ARG 12 12.136 5.948 -4.093
109 2HB ARG 12 2HB ARG 12 10.577 6.501 -4.748
110 1HG ARG 12 1HG ARG 12 10.582 6.462 -1.813
111 2HG ARG 12 2HG ARG 12 11.865 7.506 -2.466
112 1HD ARG 12 1HD ARG 12 8.925 7.563 -3.132
113 2HD ARG 12 2HD ARG 12 9.874 8.786 -2.176
114 HE ARG 12 HE ARG 12 11.232 8.440 -4.710
115 1HH1 ARG 12 1HH2 ARG 12 8.285 8.292 -5.649
116 2HH1 ARG 12 2HH2 ARG 12 7.949 10.005 -6.017
117 1HH2 ARG 12 2HH1 ARG 12 10.737 11.190 -4.171
118 2HH2 ARG 12 1HH1 ARG 12 9.339 11.647 -5.179
119 H ILE 13 H ILE 13 12.402 3.683 -4.849
120 HA ILE 13 HA ILE 13 10.870 3.055 -7.276
121 HB ILE 13 HB ILE 13 13.407 3.473 -6.976
122 1HG1 ILE 13 1HG1 ILE 13 12.033 1.854 -8.793
123 2HG1 ILE 13 2HG1 ILE 13 13.691 2.476 -8.973
124 1HG2 ILE 13 1HG2 ILE 13 13.300 0.609 -5.958
125 2HG2 ILE 13 2HG2 ILE 13 14.774 1.544 -6.304
126 3HG2 ILE 13 3HG2 ILE 13 13.693 2.045 -4.982
127 1HD1 ILE 13 1HD1 ILE 13 12.914 -0.155 -7.632
128 2HD1 ILE 13 2HD1 ILE 13 13.631 0.010 -9.251
129 3HD1 ILE 13 3HD1 ILE 13 14.571 0.469 -7.810
130 H ALA 14 H ALA 14 11.469 1.373 -4.234
131 HA ALA 14 HA ALA 14 10.614 -1.265 -5.392
132 1HB ALA 14 1HB ALA 14 11.048 -0.248 -2.529
133 2HB ALA 14 2HB ALA 14 10.871 -1.955 -3.000
134 3HB ALA 14 3HB ALA 14 12.292 -1.028 -3.537
135 H VAL 15 H VAL 15 9.024 1.542 -4.033
136 HA VAL 15 HA VAL 15 6.784 0.464 -2.686
137 HB VAL 15 HB VAL 15 6.928 2.606 -4.869
138 1HG1 VAL 15 1HG1 VAL 15 4.790 2.108 -2.756
139 2HG1 VAL 15 2HG1 VAL 15 4.854 3.495 -3.869
140 3HG1 VAL 15 3HG1 VAL 15 4.597 1.853 -4.507
141 1HG2 VAL 15 1HG2 VAL 15 8.399 2.968 -2.899
142 2HG2 VAL 15 2HG2 VAL 15 7.060 4.139 -2.928
143 3HG2 VAL 15 3HG2 VAL 15 7.000 2.748 -1.820
144 HA PRO 16 HA PRO 16 4.527 -0.744 -6.679
145 1HB PRO 16 1HB PRO 16 5.983 -1.017 -8.942
146 2HB PRO 16 2HB PRO 16 5.107 0.510 -8.467
147 1HG PRO 16 1HG PRO 16 8.017 -0.221 -8.268
148 2HG PRO 16 2HG PRO 16 7.266 1.354 -8.749
149 1HD PRO 16 1HD PRO 16 8.274 0.903 -6.192
150 2HD PRO 16 2HD PRO 16 6.930 1.999 -6.511
151 H VAL 17 H VAL 17 7.984 -1.691 -6.647
152 HA VAL 17 HA VAL 17 7.470 -4.426 -7.488
153 HB VAL 17 HB VAL 17 9.617 -3.400 -5.542
154 1HG1 VAL 17 1HG1 VAL 17 9.664 -5.529 -7.725
155 2HG1 VAL 17 2HG1 VAL 17 11.033 -5.077 -6.683
156 3HG1 VAL 17 3HG1 VAL 17 9.590 -5.840 -5.975
157 1HG2 VAL 17 1HG2 VAL 17 9.399 -1.829 -7.454
158 2HG2 VAL 17 2HG2 VAL 17 10.923 -2.744 -7.546
159 3HG2 VAL 17 3HG2 VAL 17 9.552 -3.192 -8.588
160 H VAL 18 H VAL 18 7.525 -2.848 -4.281
161 HA VAL 18 HA VAL 18 7.178 -5.311 -2.780
162 HB VAL 18 HB VAL 18 6.290 -2.401 -2.263
163 1HG1 VAL 18 1HG1 VAL 18 6.845 -4.669 -0.309
164 2HG1 VAL 18 2HG1 VAL 18 6.445 -2.991 0.126
165 3HG1 VAL 18 3HG1 VAL 18 5.241 -4.006 -0.701
166 1HG2 VAL 18 1HG2 VAL 18 8.702 -2.627 -2.801
167 2HG2 VAL 18 2HG2 VAL 18 8.459 -2.195 -1.092
168 3HG2 VAL 18 3HG2 VAL 18 8.864 -3.870 -1.537
169 H SER 19 H SER 19 4.801 -2.878 -3.975
170 HA SER 19 HA SER 19 2.462 -4.274 -2.966
171 1HB SER 19 1HB SER 19 2.807 -2.693 -5.561
172 2HB SER 19 2HB SER 19 1.325 -2.836 -4.580
173 HG SER 19 HG SER 19 2.515 -0.794 -4.229
174 H THR 20 H THR 20 4.544 -5.024 -5.730
175 HA THR 20 HA THR 20 2.412 -7.002 -6.667
176 HB THR 20 HB THR 20 5.048 -6.388 -8.027
177 HG1 THR 20 HG1 THR 20 3.925 -4.496 -9.012
178 1HG2 THR 20 1HG2 THR 20 2.191 -6.786 -9.021
179 2HG2 THR 20 2HG2 THR 20 3.631 -6.598 -10.048
180 3HG2 THR 20 3HG2 THR 20 3.465 -8.028 -9.002
181 H LEU 21 H LEU 21 5.593 -6.855 -5.120
182 HA LEU 21 HA LEU 21 5.733 -9.892 -5.480
183 1HB LEU 21 1HB LEU 21 7.836 -7.779 -4.741
184 2HB LEU 21 2HB LEU 21 8.163 -9.512 -4.970
185 HG LEU 21 HG LEU 21 7.218 -7.507 -7.064
186 1HD1 LEU 21 1HD1 LEU 21 9.653 -9.335 -6.866
187 2HD1 LEU 21 2HD1 LEU 21 9.289 -8.230 -8.212
188 3HD1 LEU 21 3HD1 LEU 21 9.652 -7.576 -6.598
189 1HD2 LEU 21 1HD2 LEU 21 5.969 -9.638 -7.301
190 2HD2 LEU 21 2HD2 LEU 21 7.144 -9.433 -8.622
191 3HD2 LEU 21 3HD2 LEU 21 7.504 -10.539 -7.275
192 H PHE 22 H PHE 22 5.635 -7.256 -3.115
193 HA PHE 22 HA PHE 22 6.144 -9.215 -0.920
194 1HB PHE 22 1HB PHE 22 5.933 -6.278 -1.348
195 2HB PHE 22 2HB PHE 22 5.212 -6.814 0.189
196 HD1 PHE 22 HD1 PHE 22 8.091 -8.298 -1.690
197 HD2 PHE 22 HD2 PHE 22 6.796 -6.146 1.816
198 HE1 PHE 22 HE1 PHE 22 10.366 -8.533 -0.705
199 HE2 PHE 22 HE2 PHE 22 9.070 -6.381 2.801
200 HZ PHE 22 HZ PHE 22 10.855 -7.574 1.538
201 HA PRO 23 HA PRO 23 1.810 -10.329 -0.952
202 1HB PRO 23 1HB PRO 23 2.019 -11.898 1.202
203 2HB PRO 23 2HB PRO 23 2.468 -12.387 -0.499
204 1HG PRO 23 1HG PRO 23 4.181 -11.504 1.803
205 2HG PRO 23 2HG PRO 23 4.447 -12.871 0.634
206 1HD PRO 23 1HD PRO 23 5.747 -10.446 0.291
207 2HD PRO 23 2HD PRO 23 5.187 -11.391 -1.086
208 HA PRO 24 HA PRO 24 1.022 -8.398 3.192
209 1HB PRO 24 1HB PRO 24 2.926 -6.864 4.367
210 2HB PRO 24 2HB PRO 24 2.740 -8.644 4.679
211 1HG PRO 24 1HG PRO 24 4.822 -7.167 3.139
212 2HG PRO 24 2HG PRO 24 4.917 -8.771 3.937
213 1HD PRO 24 1HD PRO 24 4.409 -8.235 1.101
214 2HD PRO 24 2HD PRO 24 4.344 -9.854 1.940
215 H ALA 25 H ALA 25 2.702 -6.966 0.580
216 HA ALA 25 HA ALA 25 1.545 -4.237 1.283
217 1HB ALA 25 1HB ALA 25 3.522 -5.201 -0.863
218 2HB ALA 25 2HB ALA 25 3.102 -3.500 -0.549
219 3HB ALA 25 3HB ALA 25 3.979 -4.441 0.680
220 H ALA 26 H ALA 26 1.581 -6.776 -1.223
221 HA ALA 26 HA ALA 26 0.039 -5.503 -3.252
222 1HB ALA 26 1HB ALA 26 -0.232 -8.330 -2.102
223 2HB ALA 26 2HB ALA 26 -0.743 -7.826 -3.730
224 3HB ALA 26 3HB ALA 26 0.983 -7.822 -3.298
225 HA PRO 27 HA PRO 27 -4.031 -6.581 -1.046
226 1HB PRO 27 1HB PRO 27 -3.929 -6.957 1.632
227 2HB PRO 27 2HB PRO 27 -3.864 -8.301 0.396
228 1HG PRO 27 1HG PRO 27 -1.668 -6.976 1.968
229 2HG PRO 27 2HG PRO 27 -1.904 -8.734 1.597
230 1HD PRO 27 1HD PRO 27 -0.136 -7.164 0.145
231 2HD PRO 27 2HD PRO 27 -1.022 -8.502 -0.584
232 H LEU 28 H LEU 28 -1.457 -4.901 0.723
233 HA LEU 28 HA LEU 28 -3.308 -2.972 1.894
234 1HB LEU 28 1HB LEU 28 -0.880 -3.527 2.577
235 2HB LEU 28 2HB LEU 28 -0.348 -2.619 1.143
236 HG LEU 28 HG LEU 28 -2.286 -1.238 2.961
237 1HD1 LEU 28 1HD1 LEU 28 0.654 -1.652 3.667
238 2HD1 LEU 28 2HD1 LEU 28 -0.471 -0.554 4.502
239 3HD1 LEU 28 3HD1 LEU 28 -0.732 -2.314 4.566
240 1HD2 LEU 28 1HD2 LEU 28 -1.375 -0.178 0.912
241 2HD2 LEU 28 2HD2 LEU 28 -0.845 0.691 2.371
242 3HD2 LEU 28 3HD2 LEU 28 0.278 -0.402 1.529
243 H ALA 29 H ALA 29 -1.195 -3.035 -1.019
244 HA ALA 29 HA ALA 29 -1.934 -0.449 -1.964
245 1HB ALA 29 1HB ALA 29 -1.415 -3.082 -3.500
246 2HB ALA 29 2HB ALA 29 -1.284 -1.463 -4.228
247 3HB ALA 29 3HB ALA 29 -0.152 -1.956 -2.947
248 H HIS 30 H HIS 30 -3.471 -3.614 -2.092
249 HA HIS 30 HA HIS 30 -5.595 -3.076 -3.920
250 1HB HIS 30 1HB HIS 30 -4.763 -5.093 -2.189
251 2HB HIS 30 2HB HIS 30 -6.219 -4.517 -1.341
252 HD1 HIS 30 HD1 HIS 30 -5.053 -6.117 -4.590
253 HD2 HIS 30 HD2 HIS 30 -8.666 -5.088 -2.650
254 HE1 HIS 30 HE1 HIS 30 -6.968 -7.200 -5.912
255 H ALA 31 H ALA 31 -5.491 -2.597 -0.354
256 HA ALA 31 HA ALA 31 -8.117 -1.306 -0.313
257 1HB ALA 31 1HB ALA 31 -5.673 -1.111 1.548
258 2HB ALA 31 2HB ALA 31 -7.330 -0.643 1.999
259 3HB ALA 31 3HB ALA 31 -6.947 -2.349 1.660
260 H ILE 32 H ILE 32 -4.760 -0.147 -0.585
261 HA ILE 32 HA ILE 32 -5.358 2.674 -0.351
262 HB ILE 32 HB ILE 32 -3.180 0.877 -1.048
263 1HG1 ILE 32 1HG1 ILE 32 -3.597 3.124 0.491
264 2HG1 ILE 32 2HG1 ILE 32 -2.005 2.397 0.158
265 1HG2 ILE 32 1HG2 ILE 32 -3.455 3.263 -2.916
266 2HG2 ILE 32 2HG2 ILE 32 -2.038 2.194 -2.782
267 3HG2 ILE 32 3HG2 ILE 32 -3.581 1.553 -3.391
268 1HD1 ILE 32 1HD1 ILE 32 -3.343 4.589 -1.496
269 2HD1 ILE 32 2HD1 ILE 32 -1.999 4.829 -0.355
270 3HD1 ILE 32 3HD1 ILE 32 -1.753 3.862 -1.829
271 H GLY 33 H GLY 33 -5.754 0.394 -3.048
272 1HA GLY 33 1HA GLY 33 -6.627 2.768 -4.731
273 2HA GLY 33 2HA GLY 33 -6.109 1.193 -5.382
274 H GLU 34 H GLU 34 -8.249 1.634 -2.574
275 HA GLU 34 HA GLU 34 -10.424 0.640 -2.260
276 1HB GLU 34 1HB GLU 34 -10.946 1.854 -5.012
277 2HB GLU 34 2HB GLU 34 -12.015 1.852 -3.594
278 1HG GLU 34 1HG GLU 34 -10.013 3.207 -2.496
279 2HG GLU 34 2HG GLU 34 -9.636 3.582 -4.200
280 HE2 GLU 34 HE2 GLU 34 -13.257 4.824 -3.045
281 H GLY 35 H GLY 35 -8.574 -1.228 -3.471
282 1HA GLY 35 1HA GLY 35 -9.775 -2.438 -5.811
283 2HA GLY 35 2HA GLY 35 -8.720 -3.275 -4.634
284 H VAL 36 H VAL 36 -10.077 -3.262 -2.306
285 HA VAL 36 HA VAL 36 -12.101 -5.269 -2.731
286 HB VAL 36 HB VAL 36 -11.901 -3.321 -0.361
287 1HG1 VAL 36 1HG1 VAL 36 -12.564 -6.295 -0.540
288 2HG1 VAL 36 2HG1 VAL 36 -12.518 -5.327 0.953
289 3HG1 VAL 36 3HG1 VAL 36 -13.741 -4.983 -0.293
290 1HG2 VAL 36 1HG2 VAL 36 -9.621 -4.067 -1.001
291 2HG2 VAL 36 2HG2 VAL 36 -10.124 -4.793 0.543
292 3HG2 VAL 36 3HG2 VAL 36 -10.162 -5.760 -0.949
293 H ASP 37 H ASP 37 -12.297 -1.743 -2.171
294 HA ASP 37 HA ASP 37 -15.172 -1.563 -2.090
295 1HB ASP 37 1HB ASP 37 -13.869 0.383 -1.540
296 2HB ASP 37 2HB ASP 37 -12.857 0.208 -2.999
297 HD2 ASP 37 HD2 ASP 37 -15.066 2.335 -4.669
298 H TYR 38 H TYR 38 -12.888 -1.371 -4.845
299 HA TYR 38 HA TYR 38 -14.942 -0.997 -6.848
300 1HB TYR 38 1HB TYR 38 -12.510 -0.666 -7.237
301 2HB TYR 38 2HB TYR 38 -12.198 -2.384 -6.879
302 HD1 TYR 38 HD1 TYR 38 -14.424 -0.308 -9.107
303 HD2 TYR 38 HD2 TYR 38 -11.944 -3.813 -8.699
304 HE1 TYR 38 HE1 TYR 38 -14.834 -0.877 -11.494
305 HE2 TYR 38 HE2 TYR 38 -12.355 -4.381 -11.086
306 HH TYR 38 HH TYR 38 -13.029 -2.711 -13.326
307 H LEU 39 H LEU 39 -13.444 -3.931 -5.454
308 HA LEU 39 HA LEU 39 -14.903 -5.781 -7.167
309 1HB LEU 39 1HB LEU 39 -13.295 -5.763 -4.644
310 2HB LEU 39 2HB LEU 39 -14.463 -7.101 -4.747
311 HG LEU 39 HG LEU 39 -13.457 -7.276 -7.238
312 1HD1 LEU 39 1HD1 LEU 39 -11.177 -6.134 -5.564
313 2HD1 LEU 39 2HD1 LEU 39 -11.026 -6.822 -7.199
314 3HD1 LEU 39 3HD1 LEU 39 -11.956 -5.327 -6.946
315 1HD2 LEU 39 1HD2 LEU 39 -13.474 -9.066 -5.521
316 2HD2 LEU 39 2HD2 LEU 39 -11.908 -9.001 -6.366
317 3HD2 LEU 39 3HD2 LEU 39 -12.066 -8.319 -4.729
318 H LEU 40 H LEU 40 -15.699 -4.096 -4.146
319 HA LEU 40 HA LEU 40 -18.052 -5.692 -3.530
320 1HB LEU 40 1HB LEU 40 -16.707 -3.200 -2.723
321 2HB LEU 40 2HB LEU 40 -18.470 -2.969 -2.737
322 HG LEU 40 HG LEU 40 -17.616 -3.789 -0.527
323 1HD1 LEU 40 1HD1 LEU 40 -19.345 -5.776 -2.072
324 2HD1 LEU 40 2HD1 LEU 40 -19.256 -5.635 -0.299
325 3HD1 LEU 40 3HD1 LEU 40 -19.928 -4.300 -1.265
326 1HD2 LEU 40 1HD2 LEU 40 -15.735 -5.152 -1.404
327 2HD2 LEU 40 2HD2 LEU 40 -16.811 -6.131 -0.380
328 3HD2 LEU 40 3HD2 LEU 40 -16.897 -6.273 -2.151
329 H GLY 41 H GLY 41 -17.476 -2.901 -5.654
330 1HA GLY 41 1HA GLY 41 -18.948 -2.799 -7.672
331 2HA GLY 41 2HA GLY 41 -20.311 -3.330 -6.643
332 H ASP 42 H ASP 42 -18.358 -0.627 -7.702
333 HA ASP 42 HA ASP 42 -19.376 1.230 -5.623
334 1HB ASP 42 1HB ASP 42 -17.832 1.329 -8.245
335 2HB ASP 42 2HB ASP 42 -18.469 2.854 -7.579
336 HD2 ASP 42 HD2 ASP 42 -16.278 2.478 -4.751
337 H GLU 43 H GLU 43 -21.659 0.149 -6.277
338 HA GLU 43 HA GLU 43 -22.891 2.194 -8.159
339 1HB GLU 43 1HB GLU 43 -24.110 -0.547 -7.973
340 2HB GLU 43 2HB GLU 43 -23.815 0.445 -9.418
341 1HG GLU 43 1HG GLU 43 -21.346 -0.079 -9.147
342 2HG GLU 43 2HG GLU 43 -21.818 -1.264 -7.896
343 HE2 GLU 43 HE2 GLU 43 -21.966 -3.107 -11.033
344 H ALA 44 H ALA 44 -25.552 1.388 -7.846
345 HA ALA 44 HA ALA 44 -25.982 1.302 -4.868
346 1HB ALA 44 1HB ALA 44 -27.019 3.475 -6.791
347 2HB ALA 44 2HB ALA 44 -27.445 3.361 -5.066
348 3HB ALA 44 3HB ALA 44 -25.770 3.722 -5.548
349 H GLN 45 H GLN 45 -28.502 1.287 -4.486
350 HA GLN 45 HA GLN 45 -29.630 -0.486 -6.685
351 1HB GLN 45 1HB GLN 45 -30.571 -0.273 -3.781
352 2HB GLN 45 2HB GLN 45 -30.744 -1.657 -4.885
353 1HG GLN 45 1HG GLN 45 -28.039 -1.426 -4.853
354 2HG GLN 45 2HG GLN 45 -28.420 -0.815 -3.220
355 1HE2 GLN 45 2HE2 GLN 45 -29.572 -3.501 -5.413
356 2HE2 GLN 45 1HE2 GLN 45 -29.599 -4.722 -4.113
357 H ALA 46 H ALA 46 -30.342 2.128 -4.370
358 HA ALA 46 HA ALA 46 -32.245 3.217 -6.325
359 1HB ALA 46 1HB ALA 46 -34.178 3.134 -4.660
360 2HB ALA 46 2HB ALA 46 -33.607 1.510 -5.112
361 3HB ALA 46 3HB ALA 46 -33.129 2.219 -3.551
Start of MODEL 8
1 1H PHE 1 1H PHE 1 29.079 6.059 4.958
2 2H PHE 1 2H PHE 1 29.189 7.737 4.921
3 3H PHE 1 3H PHE 1 29.092 6.933 6.395
4 HA PHE 1 HA PHE 1 26.796 6.191 5.861
5 1HB PHE 1 2HB PHE 1 27.814 8.733 6.583
6 2HB PHE 1 1HB PHE 1 26.605 9.071 5.324
7 HD1 PHE 1 HD1 PHE 1 27.105 7.063 8.465
8 HD2 PHE 1 HD2 PHE 1 24.325 9.102 5.871
9 HE1 PHE 1 HE1 PHE 1 25.282 6.682 10.118
10 HE2 PHE 1 HE2 PHE 1 22.504 8.718 7.524
11 HZ PHE 1 HZ PHE 1 22.981 7.508 9.644
12 H GLY 2 H GLY 2 24.956 7.550 4.414
13 1HA GLY 2 1HA GLY 2 24.716 8.373 2.035
14 2HA GLY 2 2HA GLY 2 26.009 7.232 1.578
15 H PHE 3 H PHE 3 25.384 4.893 2.726
16 HA PHE 3 HA PHE 3 23.419 3.688 1.094
17 1HB PHE 3 1HB PHE 3 24.068 3.128 4.051
18 2HB PHE 3 2HB PHE 3 23.335 1.957 2.937
19 HD1 PHE 3 HD1 PHE 3 24.943 2.730 0.446
20 HD2 PHE 3 HD2 PHE 3 26.105 1.986 4.533
21 HE1 PHE 3 HE1 PHE 3 27.211 2.048 -0.322
22 HE2 PHE 3 HE2 PHE 3 28.370 1.302 3.764
23 HZ PHE 3 HZ PHE 3 28.925 1.336 1.338
24 H LYS 4 H LYS 4 22.861 5.235 4.286
25 HA LYS 4 HA LYS 4 20.108 4.565 4.617
26 1HB LYS 4 1HB LYS 4 21.836 7.016 5.176
27 2HB LYS 4 2HB LYS 4 20.112 7.043 5.601
28 1HG LYS 4 1HG LYS 4 21.129 4.546 6.518
29 2HG LYS 4 2HG LYS 4 22.307 5.788 7.008
30 1HD LYS 4 1HD LYS 4 20.608 7.062 8.167
31 2HD LYS 4 2HD LYS 4 19.302 6.096 7.456
32 1HE LYS 4 1HE LYS 4 20.036 5.649 9.873
33 2HE LYS 4 2HE LYS 4 19.762 4.252 8.744
34 1HZ LYS 4 1HZ LYS 4 22.406 5.555 9.304
35 2HZ LYS 4 2HZ LYS 4 21.958 4.055 9.916
36 3HZ LYS 4 3HZ LYS 4 22.153 4.263 8.259
37 H ASP 5 H ASP 5 21.481 7.225 2.607
38 HA ASP 5 HA ASP 5 18.811 8.130 1.801
39 1HB ASP 5 1HB ASP 5 20.848 9.523 1.629
40 2HB ASP 5 2HB ASP 5 21.582 8.334 0.511
41 HD2 ASP 5 HD2 ASP 5 19.890 9.877 -2.140
42 H ILE 6 H ILE 6 21.219 5.868 0.461
43 HA ILE 6 HA ILE 6 19.823 5.366 -2.000
44 HB ILE 6 HB ILE 6 21.366 3.357 -0.250
45 1HG1 ILE 6 1HG1 ILE 6 22.222 5.859 -1.597
46 2HG1 ILE 6 2HG1 ILE 6 23.010 4.940 -0.288
47 1HG2 ILE 6 1HG2 ILE 6 21.142 3.682 -3.275
48 2HG2 ILE 6 2HG2 ILE 6 22.111 2.451 -2.429
49 3HG2 ILE 6 3HG2 ILE 6 20.336 2.428 -2.303
50 1HD1 ILE 6 1HD1 ILE 6 23.005 4.179 -3.247
51 2HD1 ILE 6 2HD1 ILE 6 24.378 4.887 -2.363
52 3HD1 ILE 6 3HD1 ILE 6 23.792 3.262 -1.940
53 H ILE 7 H ILE 7 19.559 3.866 1.263
54 HA ILE 7 HA ILE 7 17.566 1.938 0.518
55 HB ILE 7 HB ILE 7 17.716 3.527 3.152
56 1HG1 ILE 7 1HG1 ILE 7 19.788 1.981 1.843
57 2HG1 ILE 7 2HG1 ILE 7 19.849 2.827 3.408
58 1HG2 ILE 7 1HG2 ILE 7 17.038 0.614 2.548
59 2HG2 ILE 7 2HG2 ILE 7 17.065 1.362 4.163
60 3HG2 ILE 7 3HG2 ILE 7 15.866 1.889 2.959
61 1HD1 ILE 7 1HD1 ILE 7 18.712 0.034 2.938
62 2HD1 ILE 7 2HD1 ILE 7 20.283 0.403 3.691
63 3HD1 ILE 7 3HD1 ILE 7 18.773 0.880 4.502
64 H ARG 8 H ARG 8 17.384 5.369 1.463
65 HA ARG 8 HA ARG 8 14.526 5.568 1.586
66 1HB ARG 8 1HB ARG 8 16.542 7.259 2.068
67 2HB ARG 8 2HB ARG 8 16.391 7.680 0.352
68 1HG ARG 8 1HG ARG 8 13.878 8.054 0.854
69 2HG ARG 8 2HG ARG 8 14.353 8.035 2.569
70 1HD ARG 8 1HD ARG 8 14.769 10.045 0.488
71 2HD ARG 8 2HD ARG 8 14.742 10.197 2.300
72 HE ARG 8 HE ARG 8 17.175 9.309 0.634
73 1HH1 ARG 8 1HH2 ARG 8 15.927 9.168 3.812
74 2HH1 ARG 8 2HH2 ARG 8 17.321 9.964 4.591
75 1HH2 ARG 8 2HH1 ARG 8 18.818 10.871 1.505
76 2HH2 ARG 8 1HH1 ARG 8 18.958 10.928 3.283
77 H ALA 9 H ALA 9 16.808 6.021 -1.160
78 HA ALA 9 HA ALA 9 14.732 6.522 -3.121
79 1HB ALA 9 1HB ALA 9 17.483 5.159 -3.353
80 2HB ALA 9 2HB ALA 9 16.584 5.866 -4.717
81 3HB ALA 9 3HB ALA 9 17.204 6.915 -3.420
82 H ILE 10 H ILE 10 16.311 3.525 -1.978
83 HA ILE 10 HA ILE 10 14.956 1.784 -3.859
84 HB ILE 10 HB ILE 10 15.897 1.313 -0.968
85 1HG1 ILE 10 1HG1 ILE 10 17.377 2.126 -3.223
86 2HG1 ILE 10 2HG1 ILE 10 18.028 1.414 -1.727
87 1HG2 ILE 10 1HG2 ILE 10 15.533 -0.626 -3.294
88 2HG2 ILE 10 2HG2 ILE 10 16.184 -1.035 -1.690
89 3HG2 ILE 10 3HG2 ILE 10 14.489 -0.522 -1.857
90 1HD1 ILE 10 1HD1 ILE 10 17.081 -0.144 -4.175
91 2HD1 ILE 10 2HD1 ILE 10 18.778 0.140 -3.719
92 3HD1 ILE 10 3HD1 ILE 10 17.731 -0.856 -2.679
93 H ARG 11 H ARG 11 14.038 3.027 -0.621
94 HA ARG 11 HA ARG 11 11.670 1.383 -0.399
95 1HB ARG 11 1HB ARG 11 11.401 2.662 1.550
96 2HB ARG 11 2HB ARG 11 12.994 3.295 1.142
97 1HG ARG 11 1HG ARG 11 11.743 5.264 1.420
98 2HG ARG 11 2HG ARG 11 11.633 5.039 -0.324
99 1HD ARG 11 1HD ARG 11 9.530 5.547 1.095
100 2HD ARG 11 2HD ARG 11 9.468 4.347 -0.262
101 HE ARG 11 HE ARG 11 10.112 3.319 2.532
102 1HH1 ARG 11 1HH2 ARG 11 8.984 2.232 -0.391
103 2HH1 ARG 11 2HH2 ARG 11 7.450 1.532 0.193
104 1HH2 ARG 11 2HH1 ARG 11 7.661 3.110 3.361
105 2HH2 ARG 11 1HH1 ARG 11 6.702 2.030 2.314
106 H ARG 12 H ARG 12 12.396 4.338 -2.211
107 HA ARG 12 HA ARG 12 9.516 4.785 -2.850
108 1HB ARG 12 1HB ARG 12 12.161 5.887 -3.974
109 2HB ARG 12 2HB ARG 12 10.555 6.558 -4.341
110 1HG ARG 12 1HG ARG 12 10.330 6.698 -1.703
111 2HG ARG 12 2HG ARG 12 12.103 6.624 -1.741
112 1HD ARG 12 1HD ARG 12 10.241 8.732 -2.603
113 2HD ARG 12 2HD ARG 12 11.932 8.830 -1.943
114 HE ARG 12 HE ARG 12 12.608 7.845 -4.337
115 1HH1 ARG 12 1HH2 ARG 12 9.615 8.053 -5.207
116 2HH1 ARG 12 2HH2 ARG 12 9.647 9.560 -6.163
117 1HH2 ARG 12 2HH1 ARG 12 12.758 10.616 -4.831
118 2HH2 ARG 12 1HH1 ARG 12 11.427 11.010 -5.950
119 H ILE 13 H ILE 13 12.447 3.617 -4.596
120 HA ILE 13 HA ILE 13 10.946 3.092 -7.055
121 HB ILE 13 HB ILE 13 13.499 3.342 -6.669
122 1HG1 ILE 13 1HG1 ILE 13 14.087 1.662 -8.389
123 2HG1 ILE 13 2HG1 ILE 13 12.527 0.849 -8.130
124 1HG2 ILE 13 1HG2 ILE 13 13.168 0.460 -5.750
125 2HG2 ILE 13 2HG2 ILE 13 14.712 1.301 -6.026
126 3HG2 ILE 13 3HG2 ILE 13 13.631 1.834 -4.717
127 1HD1 ILE 13 1HD1 ILE 13 12.899 3.730 -9.057
128 2HD1 ILE 13 2HD1 ILE 13 12.429 2.359 -10.089
129 3HD1 ILE 13 3HD1 ILE 13 11.337 2.917 -8.799
130 H ALA 14 H ALA 14 11.448 1.295 -4.054
131 HA ALA 14 HA ALA 14 10.524 -1.286 -5.221
132 1HB ALA 14 1HB ALA 14 10.675 -0.223 -2.344
133 2HB ALA 14 2HB ALA 14 10.492 -1.933 -2.804
134 3HB ALA 14 3HB ALA 14 11.997 -1.063 -3.190
135 H VAL 15 H VAL 15 8.907 1.590 -4.032
136 HA VAL 15 HA VAL 15 6.514 0.647 -2.897
137 HB VAL 15 HB VAL 15 6.924 2.678 -5.141
138 1HG1 VAL 15 1HG1 VAL 15 4.593 2.328 -3.209
139 2HG1 VAL 15 2HG1 VAL 15 4.798 3.667 -4.364
140 3HG1 VAL 15 3HG1 VAL 15 4.547 2.009 -4.959
141 1HG2 VAL 15 1HG2 VAL 15 8.228 3.077 -3.061
142 2HG2 VAL 15 2HG2 VAL 15 6.937 4.286 -3.251
143 3HG2 VAL 15 3HG2 VAL 15 6.733 2.941 -2.103
144 HA PRO 16 HA PRO 16 4.514 -0.712 -6.964
145 1HB PRO 16 1HB PRO 16 6.090 -1.034 -9.143
146 2HB PRO 16 2HB PRO 16 5.176 0.498 -8.757
147 1HG PRO 16 1HG PRO 16 8.075 -0.204 -8.367
148 2HG PRO 16 2HG PRO 16 7.345 1.345 -8.958
149 1HD PRO 16 1HD PRO 16 8.198 1.031 -6.330
150 2HD PRO 16 2HD PRO 16 6.842 2.068 -6.768
151 H VAL 17 H VAL 17 7.967 -1.608 -6.680
152 HA VAL 17 HA VAL 17 7.589 -4.356 -7.501
153 HB VAL 17 HB VAL 17 9.499 -3.252 -5.355
154 1HG1 VAL 17 1HG1 VAL 17 9.819 -5.435 -7.463
155 2HG1 VAL 17 2HG1 VAL 17 11.060 -4.929 -6.292
156 3HG1 VAL 17 3HG1 VAL 17 9.562 -5.703 -5.723
157 1HG2 VAL 17 1HG2 VAL 17 9.461 -1.735 -7.322
158 2HG2 VAL 17 2HG2 VAL 17 11.000 -2.621 -7.225
159 3HG2 VAL 17 3HG2 VAL 17 9.759 -3.122 -8.397
160 H VAL 18 H VAL 18 7.161 -2.690 -4.381
161 HA VAL 18 HA VAL 18 6.815 -5.057 -2.777
162 HB VAL 18 HB VAL 18 5.439 -2.298 -2.617
163 1HG1 VAL 18 1HG1 VAL 18 6.166 -4.298 -0.443
164 2HG1 VAL 18 2HG1 VAL 18 5.435 -2.696 -0.189
165 3HG1 VAL 18 3HG1 VAL 18 4.523 -3.965 -1.041
166 1HG2 VAL 18 1HG2 VAL 18 7.906 -2.123 -2.884
167 2HG2 VAL 18 2HG2 VAL 18 7.396 -1.635 -1.251
168 3HG2 VAL 18 3HG2 VAL 18 8.128 -3.236 -1.513
169 H SER 19 H SER 19 4.332 -2.988 -4.398
170 HA SER 19 HA SER 19 2.058 -4.598 -3.767
171 1HB SER 19 1HB SER 19 2.463 -3.523 -6.554
172 2HB SER 19 2HB SER 19 1.105 -3.241 -5.423
173 HG SER 19 HG SER 19 2.914 -2.093 -4.080
174 H THR 20 H THR 20 4.567 -5.152 -6.240
175 HA THR 20 HA THR 20 3.022 -7.547 -7.249
176 HB THR 20 HB THR 20 5.843 -6.849 -8.043
177 HG1 THR 20 HG1 THR 20 4.612 -4.787 -7.550
178 1HG2 THR 20 1HG2 THR 20 3.265 -7.338 -9.598
179 2HG2 THR 20 2HG2 THR 20 4.890 -7.180 -10.304
180 3HG2 THR 20 3HG2 THR 20 4.511 -8.559 -9.245
181 H LEU 21 H LEU 21 5.611 -6.855 -4.955
182 HA LEU 21 HA LEU 21 6.051 -9.885 -4.820
183 1HB LEU 21 1HB LEU 21 7.871 -7.453 -4.660
184 2HB LEU 21 2HB LEU 21 8.332 -8.938 -3.797
185 HG LEU 21 HG LEU 21 7.713 -10.051 -6.169
186 1HD1 LEU 21 1HD1 LEU 21 8.626 -7.224 -6.863
187 2HD1 LEU 21 2HD1 LEU 21 8.437 -8.569 -8.013
188 3HD1 LEU 21 3HD1 LEU 21 7.012 -7.900 -7.183
189 1HD2 LEU 21 1HD2 LEU 21 9.897 -10.185 -4.996
190 2HD2 LEU 21 2HD2 LEU 21 10.120 -9.897 -6.737
191 3HD2 LEU 21 3HD2 LEU 21 10.310 -8.557 -5.582
192 H PHE 22 H PHE 22 4.054 -8.154 -3.362
193 HA PHE 22 HA PHE 22 4.952 -9.102 -0.649
194 1HB PHE 22 1HB PHE 22 5.182 -6.434 -1.474
195 2HB PHE 22 2HB PHE 22 3.586 -6.441 -0.693
196 HD1 PHE 22 HD1 PHE 22 6.554 -8.565 0.146
197 HD2 PHE 22 HD2 PHE 22 4.004 -5.293 1.331
198 HE1 PHE 22 HE1 PHE 22 7.643 -8.524 2.383
199 HE2 PHE 22 HE2 PHE 22 5.094 -5.255 3.569
200 HZ PHE 22 HZ PHE 22 6.913 -6.871 4.096
201 HA PRO 23 HA PRO 23 0.757 -10.608 -1.030
202 1HB PRO 23 1HB PRO 23 0.609 -11.528 1.468
203 2HB PRO 23 2HB PRO 23 1.431 -12.388 0.083
204 1HG PRO 23 1HG PRO 23 2.570 -10.756 2.331
205 2HG PRO 23 2HG PRO 23 3.154 -12.338 1.653
206 1HD PRO 23 1HD PRO 23 4.350 -9.949 0.912
207 2HD PRO 23 2HD PRO 23 4.159 -11.276 -0.229
208 HA PRO 24 HA PRO 24 -1.016 -7.784 2.167
209 1HB PRO 24 1HB PRO 24 0.514 -5.872 3.333
210 2HB PRO 24 2HB PRO 24 0.316 -7.546 4.012
211 1HG PRO 24 1HG PRO 24 2.661 -6.278 2.692
212 2HG PRO 24 2HG PRO 24 2.602 -7.680 3.808
213 1HD PRO 24 1HD PRO 24 2.724 -7.735 0.863
214 2HD PRO 24 2HD PRO 24 2.594 -9.163 1.996
215 H ALA 25 H ALA 25 1.191 -6.833 -0.272
216 HA ALA 25 HA ALA 25 -0.248 -4.147 -0.534
217 1HB ALA 25 1HB ALA 25 2.335 -5.271 -1.759
218 2HB ALA 25 2HB ALA 25 1.737 -3.609 -1.973
219 3HB ALA 25 3HB ALA 25 2.262 -4.165 -0.366
220 H ALA 26 H ALA 26 0.101 -7.315 -1.958
221 HA ALA 26 HA ALA 26 -1.019 -6.318 -4.621
222 1HB ALA 26 1HB ALA 26 -0.192 -9.055 -3.548
223 2HB ALA 26 2HB ALA 26 -0.591 -8.669 -5.238
224 3HB ALA 26 3HB ALA 26 0.858 -7.965 -4.483
225 HA PRO 27 HA PRO 27 -4.582 -8.864 -2.876
226 1HB PRO 27 1HB PRO 27 -5.552 -7.895 -0.541
227 2HB PRO 27 2HB PRO 27 -4.394 -9.295 -0.663
228 1HG PRO 27 1HG PRO 27 -3.925 -6.440 0.122
229 2HG PRO 27 2HG PRO 27 -3.139 -7.939 0.742
230 1HD PRO 27 1HD PRO 27 -2.017 -6.206 -1.255
231 2HD PRO 27 2HD PRO 27 -1.561 -7.961 -1.040
232 H LEU 28 H LEU 28 -3.898 -5.452 -2.375
233 HA LEU 28 HA LEU 28 -6.644 -4.548 -2.613
234 1HB LEU 28 1HB LEU 28 -3.982 -3.284 -3.487
235 2HB LEU 28 2HB LEU 28 -5.500 -2.385 -3.251
236 HG LEU 28 HG LEU 28 -5.025 -3.980 -0.897
237 1HD1 LEU 28 1HD1 LEU 28 -2.677 -2.223 -1.738
238 2HD1 LEU 28 2HD1 LEU 28 -2.883 -2.994 -0.147
239 3HD1 LEU 28 3HD1 LEU 28 -2.648 -3.997 -1.599
240 1HD2 LEU 28 1HD2 LEU 28 -6.316 -1.866 -1.033
241 2HD2 LEU 28 2HD2 LEU 28 -5.019 -1.749 0.180
242 3HD2 LEU 28 3HD2 LEU 28 -4.820 -0.977 -1.412
243 H ALA 29 H ALA 29 -4.121 -5.425 -4.982
244 HA ALA 29 HA ALA 29 -5.441 -4.473 -7.313
245 1HB ALA 29 1HB ALA 29 -3.923 -7.117 -6.808
246 2HB ALA 29 2HB ALA 29 -4.150 -6.390 -8.417
247 3HB ALA 29 3HB ALA 29 -3.158 -5.557 -7.196
248 H HIS 30 H HIS 30 -5.900 -7.374 -5.341
249 HA HIS 30 HA HIS 30 -7.840 -8.711 -6.992
250 1HB HIS 30 1HB HIS 30 -6.583 -9.060 -4.541
251 2HB HIS 30 2HB HIS 30 -8.210 -8.595 -3.989
252 HD1 HIS 30 HD1 HIS 30 -6.389 -11.224 -6.090
253 HD2 HIS 30 HD2 HIS 30 -10.178 -10.567 -4.328
254 HE1 HIS 30 HE1 HIS 30 -7.726 -13.404 -6.311
255 H ALA 31 H ALA 31 -8.248 -6.307 -4.368
256 HA ALA 31 HA ALA 31 -11.147 -6.167 -4.516
257 1HB ALA 31 1HB ALA 31 -9.031 -4.038 -3.866
258 2HB ALA 31 2HB ALA 31 -10.740 -3.968 -3.375
259 3HB ALA 31 3HB ALA 31 -9.674 -5.228 -2.708
260 H ILE 32 H ILE 32 -8.650 -4.800 -6.603
261 HA ILE 32 HA ILE 32 -10.339 -2.722 -7.772
262 HB ILE 32 HB ILE 32 -8.072 -4.396 -9.000
263 1HG1 ILE 32 1HG1 ILE 32 -8.137 -2.462 -6.789
264 2HG1 ILE 32 2HG1 ILE 32 -6.814 -3.529 -7.326
265 1HG2 ILE 32 1HG2 ILE 32 -9.025 -1.556 -9.562
266 2HG2 ILE 32 2HG2 ILE 32 -7.636 -2.363 -10.328
267 3HG2 ILE 32 3HG2 ILE 32 -9.285 -2.966 -10.616
268 1HD1 ILE 32 1HD1 ILE 32 -7.593 -0.873 -8.615
269 2HD1 ILE 32 2HD1 ILE 32 -6.183 -1.140 -7.563
270 3HD1 ILE 32 3HD1 ILE 32 -6.272 -1.939 -9.151
271 H GLY 33 H GLY 33 -10.517 -6.166 -7.954
272 1HA GLY 33 1HA GLY 33 -12.678 -6.899 -9.058
273 2HA GLY 33 2HA GLY 33 -12.263 -5.802 -10.409
274 H GLU 34 H GLU 34 -9.331 -6.544 -10.035
275 HA GLU 34 HA GLU 34 -9.140 -8.527 -12.077
276 1HB GLU 34 1HB GLU 34 -7.297 -7.999 -9.664
277 2HB GLU 34 2HB GLU 34 -6.788 -8.768 -11.179
278 1HG GLU 34 1HG GLU 34 -7.042 -6.787 -12.418
279 2HG GLU 34 2HG GLU 34 -8.072 -6.032 -11.164
280 HE2 GLU 34 HE2 GLU 34 -5.068 -4.629 -9.987
281 H GLY 35 H GLY 35 -9.185 -8.955 -8.521
282 1HA GLY 35 1HA GLY 35 -8.857 -11.832 -8.652
283 2HA GLY 35 2HA GLY 35 -9.584 -10.925 -7.293
284 H VAL 36 H VAL 36 -11.746 -9.701 -8.601
285 HA VAL 36 HA VAL 36 -13.653 -11.880 -8.607
286 HB VAL 36 HB VAL 36 -13.903 -9.140 -9.980
287 1HG1 VAL 36 1HG1 VAL 36 -15.902 -10.872 -8.458
288 2HG1 VAL 36 2HG1 VAL 36 -16.247 -9.291 -9.198
289 3HG1 VAL 36 3HG1 VAL 36 -15.829 -10.682 -10.226
290 1HG2 VAL 36 1HG2 VAL 36 -12.850 -8.865 -7.746
291 2HG2 VAL 36 2HG2 VAL 36 -14.514 -8.233 -7.753
292 3HG2 VAL 36 3HG2 VAL 36 -14.166 -9.813 -7.011
293 H ASP 37 H ASP 37 -12.001 -10.083 -11.226
294 HA ASP 37 HA ASP 37 -13.394 -11.456 -13.385
295 1HB ASP 37 1HB ASP 37 -12.066 -9.402 -13.702
296 2HB ASP 37 2HB ASP 37 -10.597 -10.230 -13.105
297 HD2 ASP 37 HD2 ASP 37 -10.140 -11.733 -16.262
298 H TYR 38 H TYR 38 -10.396 -12.152 -11.576
299 HA TYR 38 HA TYR 38 -9.670 -14.466 -13.211
300 1HB TYR 38 1HB TYR 38 -8.379 -13.043 -11.394
301 2HB TYR 38 2HB TYR 38 -9.156 -14.137 -10.221
302 HD1 TYR 38 HD1 TYR 38 -6.720 -13.870 -12.986
303 HD2 TYR 38 HD2 TYR 38 -8.606 -16.521 -10.156
304 HE1 TYR 38 HE1 TYR 38 -5.007 -15.607 -13.473
305 HE2 TYR 38 HE2 TYR 38 -6.893 -18.259 -10.641
306 HH TYR 38 HH TYR 38 -4.869 -18.687 -11.588
307 H LEU 39 H LEU 39 -11.832 -14.023 -10.429
308 HA LEU 39 HA LEU 39 -12.198 -17.004 -10.223
309 1HB LEU 39 1HB LEU 39 -12.917 -14.484 -8.746
310 2HB LEU 39 2HB LEU 39 -14.078 -15.822 -8.593
311 HG LEU 39 HG LEU 39 -12.273 -17.328 -7.835
312 1HD1 LEU 39 1HD1 LEU 39 -10.500 -14.859 -8.098
313 2HD1 LEU 39 2HD1 LEU 39 -10.009 -16.427 -7.411
314 3HD1 LEU 39 3HD1 LEU 39 -10.429 -16.304 -9.136
315 1HD2 LEU 39 1HD2 LEU 39 -13.479 -15.962 -6.154
316 2HD2 LEU 39 2HD2 LEU 39 -11.786 -16.223 -5.673
317 3HD2 LEU 39 3HD2 LEU 39 -12.286 -14.658 -6.358
318 H LEU 40 H LEU 40 -13.769 -14.217 -11.709
319 HA LEU 40 HA LEU 40 -15.892 -16.172 -12.688
320 1HB LEU 40 1HB LEU 40 -16.133 -13.305 -11.623
321 2HB LEU 40 2HB LEU 40 -17.447 -14.116 -12.508
322 HG LEU 40 HG LEU 40 -16.814 -16.031 -10.643
323 1HD1 LEU 40 1HD1 LEU 40 -16.462 -13.308 -9.312
324 2HD1 LEU 40 2HD1 LEU 40 -16.570 -14.871 -8.469
325 3HD1 LEU 40 3HD1 LEU 40 -15.186 -14.527 -9.533
326 1HD2 LEU 40 1HD2 LEU 40 -19.072 -15.170 -11.206
327 2HD2 LEU 40 2HD2 LEU 40 -18.836 -15.244 -9.444
328 3HD2 LEU 40 3HD2 LEU 40 -18.732 -13.682 -10.290
329 H GLY 41 H GLY 41 -14.873 -12.764 -13.193
330 1HA GLY 41 1HA GLY 41 -13.602 -12.524 -15.442
331 2HA GLY 41 2HA GLY 41 -14.996 -13.408 -16.144
332 H ASP 42 H ASP 42 -13.749 -10.329 -15.560
333 HA ASP 42 HA ASP 42 -16.559 -9.159 -15.468
334 1HB ASP 42 1HB ASP 42 -14.802 -8.659 -13.630
335 2HB ASP 42 2HB ASP 42 -13.873 -7.804 -14.892
336 HD2 ASP 42 HD2 ASP 42 -16.064 -5.076 -14.657
337 H GLU 43 H GLU 43 -15.427 -10.212 -17.871
338 HA GLU 43 HA GLU 43 -14.255 -7.955 -19.383
339 1HB GLU 43 1HB GLU 43 -15.556 -10.635 -20.146
340 2HB GLU 43 2HB GLU 43 -14.666 -9.605 -21.291
341 1HG GLU 43 1HG GLU 43 -12.908 -10.954 -20.636
342 2HG GLU 43 2HG GLU 43 -12.810 -9.762 -19.319
343 HE2 GLU 43 HE2 GLU 43 -13.111 -12.886 -17.561
344 H ALA 44 H ALA 44 -16.175 -6.564 -18.456
345 HA ALA 44 HA ALA 44 -18.786 -6.926 -19.743
346 1HB ALA 44 1HB ALA 44 -17.353 -4.459 -18.586
347 2HB ALA 44 2HB ALA 44 -19.105 -4.574 -18.873
348 3HB ALA 44 3HB ALA 44 -18.336 -5.604 -17.643
349 H GLN 45 H GLN 45 -18.512 -7.177 -21.986
350 HA GLN 45 HA GLN 45 -17.330 -4.728 -23.354
351 1HB GLN 45 1HB GLN 45 -16.788 -7.497 -23.577
352 2HB GLN 45 2HB GLN 45 -17.844 -7.171 -24.969
353 1HG GLN 45 1HG GLN 45 -15.916 -5.035 -24.713
354 2HG GLN 45 2HG GLN 45 -15.068 -6.603 -24.715
355 1HE2 GLN 45 2HE2 GLN 45 -18.146 -5.591 -26.375
356 2HE2 GLN 45 1HE2 GLN 45 -17.554 -5.995 -28.008
357 H ALA 46 H ALA 46 -20.100 -5.132 -22.244
358 HA ALA 46 HA ALA 46 -21.462 -4.070 -24.574
359 1HB ALA 46 1HB ALA 46 -23.132 -5.990 -24.768
360 2HB ALA 46 2HB ALA 46 -21.469 -6.503 -25.141
361 3HB ALA 46 3HB ALA 46 -22.183 -6.882 -23.556
Start of MODEL 9
1 1H PHE 1 1H PHE 1 21.846 8.160 5.085
2 2H PHE 1 2H PHE 1 22.923 8.611 6.296
3 3H PHE 1 3H PHE 1 22.851 9.490 4.865
4 HA PHE 1 HA PHE 1 23.703 7.554 3.605
5 1HB PHE 1 2HB PHE 1 25.975 7.606 4.855
6 2HB PHE 1 1HB PHE 1 25.326 9.187 4.380
7 HD1 PHE 1 HD1 PHE 1 24.849 10.845 5.993
8 HD2 PHE 1 HD2 PHE 1 25.519 6.766 7.230
9 HE1 PHE 1 HE1 PHE 1 24.869 11.569 8.373
10 HE2 PHE 1 HE2 PHE 1 25.542 7.493 9.610
11 HZ PHE 1 HZ PHE 1 25.218 9.894 10.181
12 H GLY 2 H GLY 2 25.484 5.713 4.510
13 1HA GLY 2 1HA GLY 2 25.572 3.571 5.526
14 2HA GLY 2 2HA GLY 2 24.468 4.179 6.782
15 H PHE 3 H PHE 3 24.303 3.515 3.246
16 HA PHE 3 HA PHE 3 22.715 2.181 2.017
17 1HB PHE 3 1HB PHE 3 23.087 0.971 4.595
18 2HB PHE 3 2HB PHE 3 21.348 0.902 4.208
19 HD1 PHE 3 HD1 PHE 3 21.034 0.487 1.465
20 HD2 PHE 3 HD2 PHE 3 24.246 -0.952 3.960
21 HE1 PHE 3 HE1 PHE 3 21.468 -1.353 -0.154
22 HE2 PHE 3 HE2 PHE 3 24.678 -2.792 2.339
23 HZ PHE 3 HZ PHE 3 23.289 -2.994 0.282
24 H LYS 4 H LYS 4 21.238 3.342 5.088
25 HA LYS 4 HA LYS 4 18.531 3.473 4.305
26 1HB LYS 4 1HB LYS 4 20.219 5.637 5.694
27 2HB LYS 4 2HB LYS 4 18.456 5.474 5.833
28 1HG LYS 4 1HG LYS 4 18.617 3.768 7.332
29 2HG LYS 4 2HG LYS 4 19.936 2.980 6.432
30 1HD LYS 4 1HD LYS 4 21.477 4.831 7.314
31 2HD LYS 4 2HD LYS 4 20.151 5.310 8.391
32 1HE LYS 4 1HE LYS 4 21.865 3.766 9.358
33 2HE LYS 4 2HE LYS 4 20.132 3.232 9.476
34 1HZ LYS 4 1HZ LYS 4 22.076 2.402 7.347
35 2HZ LYS 4 2HZ LYS 4 21.590 1.400 8.606
36 3HZ LYS 4 3HZ LYS 4 20.473 1.908 7.456
37 H ASP 5 H ASP 5 21.115 5.748 3.313
38 HA ASP 5 HA ASP 5 19.382 7.646 2.025
39 1HB ASP 5 1HB ASP 5 22.222 6.612 1.657
40 2HB ASP 5 2HB ASP 5 21.572 7.727 0.434
41 HD2 ASP 5 HD2 ASP 5 22.892 9.915 2.980
42 H ILE 6 H ILE 6 20.941 4.697 0.722
43 HA ILE 6 HA ILE 6 19.544 4.995 -1.856
44 HB ILE 6 HB ILE 6 20.830 2.528 -0.533
45 1HG1 ILE 6 1HG1 ILE 6 22.004 5.077 -1.247
46 2HG1 ILE 6 2HG1 ILE 6 22.792 3.640 -0.549
47 1HG2 ILE 6 1HG2 ILE 6 20.551 3.357 -3.453
48 2HG2 ILE 6 2HG2 ILE 6 21.358 1.886 -2.860
49 3HG2 ILE 6 3HG2 ILE 6 19.603 2.090 -2.640
50 1HD1 ILE 6 1HD1 ILE 6 22.209 4.087 -3.513
51 2HD1 ILE 6 2HD1 ILE 6 23.804 4.235 -2.737
52 3HD1 ILE 6 3HD1 ILE 6 22.996 2.652 -2.815
53 H ILE 7 H ILE 7 19.009 3.242 1.197
54 HA ILE 7 HA ILE 7 16.893 1.531 0.260
55 HB ILE 7 HB ILE 7 17.214 2.988 2.950
56 1HG1 ILE 7 1HG1 ILE 7 18.989 1.207 1.628
57 2HG1 ILE 7 2HG1 ILE 7 19.046 1.718 3.332
58 1HG2 ILE 7 1HG2 ILE 7 15.893 0.333 2.242
59 2HG2 ILE 7 2HG2 ILE 7 16.067 1.005 3.880
60 3HG2 ILE 7 3HG2 ILE 7 15.041 1.830 2.683
61 1HD1 ILE 7 1HD1 ILE 7 17.443 -0.635 2.231
62 2HD1 ILE 7 2HD1 ILE 7 18.966 -0.754 3.145
63 3HD1 ILE 7 3HD1 ILE 7 17.500 -0.125 3.935
64 H ARG 8 H ARG 8 16.809 4.917 1.486
65 HA ARG 8 HA ARG 8 13.912 5.110 1.252
66 1HB ARG 8 1HB ARG 8 16.289 7.027 1.270
67 2HB ARG 8 2HB ARG 8 14.637 7.658 1.057
68 1HG ARG 8 1HG ARG 8 13.985 7.065 3.211
69 2HG ARG 8 2HG ARG 8 15.145 5.718 3.302
70 1HD ARG 8 1HD ARG 8 15.489 7.968 4.617
71 2HD ARG 8 2HD ARG 8 16.871 7.030 3.894
72 HE ARG 8 HE ARG 8 15.490 9.319 2.365
73 1HH1 ARG 8 1HH2 ARG 8 18.042 9.386 4.400
74 2HH1 ARG 8 2HH2 ARG 8 19.335 9.608 3.191
75 1HH2 ARG 8 2HH1 ARG 8 17.240 8.777 0.456
76 2HH2 ARG 8 1HH1 ARG 8 18.880 9.263 0.958
77 H ALA 9 H ALA 9 16.625 5.849 -0.972
78 HA ALA 9 HA ALA 9 14.974 6.939 -3.078
79 1HB ALA 9 1HB ALA 9 17.524 5.214 -3.184
80 2HB ALA 9 2HB ALA 9 16.955 6.264 -4.504
81 3HB ALA 9 3HB ALA 9 17.494 6.980 -2.967
82 H ILE 10 H ILE 10 16.056 3.592 -2.401
83 HA ILE 10 HA ILE 10 14.564 2.517 -4.687
84 HB ILE 10 HB ILE 10 15.506 1.192 -2.079
85 1HG1 ILE 10 1HG1 ILE 10 17.039 2.553 -4.023
86 2HG1 ILE 10 2HG1 ILE 10 17.642 1.421 -2.785
87 1HG2 ILE 10 1HG2 ILE 10 15.052 0.072 -4.880
88 2HG2 ILE 10 2HG2 ILE 10 15.667 -0.842 -3.482
89 3HG2 ILE 10 3HG2 ILE 10 14.005 -0.206 -3.469
90 1HD1 ILE 10 1HD1 ILE 10 16.642 0.651 -5.565
91 2HD1 ILE 10 2HD1 ILE 10 18.347 0.712 -5.060
92 3HD1 ILE 10 3HD1 ILE 10 17.244 -0.479 -4.329
93 H ARG 11 H ARG 11 13.818 3.233 -1.295
94 HA ARG 11 HA ARG 11 11.454 1.635 -1.058
95 1HB ARG 11 1HB ARG 11 12.021 2.755 0.941
96 2HB ARG 11 2HB ARG 11 12.580 4.198 0.078
97 1HG ARG 11 1HG ARG 11 10.564 4.757 1.333
98 2HG ARG 11 2HG ARG 11 10.178 4.783 -0.400
99 1HD ARG 11 1HD ARG 11 8.435 3.665 0.732
100 2HD ARG 11 2HD ARG 11 9.404 2.440 -0.203
101 HE ARG 11 HE ARG 11 10.662 2.001 2.056
102 1HH1 ARG 11 2HH1 ARG 11 9.204 4.248 3.546
103 2HH1 ARG 11 1HH1 ARG 11 7.965 3.341 4.455
104 1HH2 ARG 11 1HH2 ARG 11 8.272 0.443 2.431
105 2HH2 ARG 11 2HH2 ARG 11 7.436 1.182 3.823
106 H ARG 12 H ARG 12 12.012 4.769 -2.668
107 HA ARG 12 HA ARG 12 9.093 5.047 -3.289
108 1HB ARG 12 1HB ARG 12 11.533 6.501 -4.438
109 2HB ARG 12 2HB ARG 12 9.862 7.107 -4.358
110 1HG ARG 12 1HG ARG 12 10.143 6.743 -1.757
111 2HG ARG 12 2HG ARG 12 11.880 6.778 -2.123
112 1HD ARG 12 1HD ARG 12 10.860 8.955 -1.494
113 2HD ARG 12 2HD ARG 12 11.741 8.912 -3.086
114 HE ARG 12 HE ARG 12 8.763 8.333 -3.150
115 1HH1 ARG 12 1HH2 ARG 12 10.192 9.079 -5.662
116 2HH1 ARG 12 2HH2 ARG 12 9.819 10.814 -5.846
117 1HH2 ARG 12 2HH1 ARG 12 8.863 11.205 -2.452
118 2HH2 ARG 12 1HH1 ARG 12 9.066 12.020 -4.027
119 H ILE 13 H ILE 13 12.101 4.358 -5.172
120 HA ILE 13 HA ILE 13 10.580 3.990 -7.655
121 HB ILE 13 HB ILE 13 13.103 4.460 -7.285
122 1HG1 ILE 13 1HG1 ILE 13 13.801 2.905 -9.170
123 2HG1 ILE 13 2HG1 ILE 13 12.178 2.181 -9.073
124 1HG2 ILE 13 1HG2 ILE 13 13.103 1.468 -6.738
125 2HG2 ILE 13 2HG2 ILE 13 14.541 2.497 -6.936
126 3HG2 ILE 13 3HG2 ILE 13 13.456 2.741 -5.546
127 1HD1 ILE 13 1HD1 ILE 13 12.784 5.128 -9.572
128 2HD1 ILE 13 2HD1 ILE 13 12.260 3.952 -10.801
129 3HD1 ILE 13 3HD1 ILE 13 11.162 4.405 -9.475
130 H ALA 14 H ALA 14 11.289 1.910 -4.903
131 HA ALA 14 HA ALA 14 10.392 -0.504 -6.464
132 1HB ALA 14 1HB ALA 14 11.161 -0.046 -3.528
133 2HB ALA 14 2HB ALA 14 10.921 -1.637 -4.290
134 3HB ALA 14 3HB ALA 14 12.273 -0.599 -4.803
135 H VAL 15 H VAL 15 8.776 2.071 -5.094
136 HA VAL 15 HA VAL 15 6.825 1.010 -3.350
137 HB VAL 15 HB VAL 15 6.716 2.921 -5.729
138 1HG1 VAL 15 1HG1 VAL 15 4.443 2.303 -3.794
139 2HG1 VAL 15 2HG1 VAL 15 4.456 3.605 -5.007
140 3HG1 VAL 15 3HG1 VAL 15 4.466 1.904 -5.528
141 1HG2 VAL 15 1HG2 VAL 15 7.926 3.607 -3.675
142 2HG2 VAL 15 2HG2 VAL 15 6.466 4.594 -3.923
143 3HG2 VAL 15 3HG2 VAL 15 6.464 3.289 -2.711
144 HA PRO 16 HA PRO 16 4.346 -0.924 -6.905
145 1HB PRO 16 1HB PRO 16 5.618 -1.387 -9.252
146 2HB PRO 16 2HB PRO 16 4.644 0.111 -8.894
147 1HG PRO 16 1HG PRO 16 7.618 -0.325 -8.923
148 2HG PRO 16 2HG PRO 16 6.669 1.106 -9.481
149 1HD PRO 16 1HD PRO 16 7.982 1.014 -7.015
150 2HD PRO 16 2HD PRO 16 6.551 2.001 -7.319
151 H VAL 17 H VAL 17 7.869 -1.556 -7.071
152 HA VAL 17 HA VAL 17 7.587 -4.403 -7.503
153 HB VAL 17 HB VAL 17 9.716 -2.905 -5.862
154 1HG1 VAL 17 1HG1 VAL 17 9.876 -5.358 -7.669
155 2HG1 VAL 17 2HG1 VAL 17 11.240 -4.613 -6.802
156 3HG1 VAL 17 3HG1 VAL 17 9.916 -5.376 -5.890
157 1HG2 VAL 17 1HG2 VAL 17 9.250 -1.704 -7.986
158 2HG2 VAL 17 2HG2 VAL 17 10.852 -2.478 -8.024
159 3HG2 VAL 17 3HG2 VAL 17 9.486 -3.218 -8.892
160 H VAL 18 H VAL 18 7.823 -2.446 -4.505
161 HA VAL 18 HA VAL 18 7.738 -4.657 -2.667
162 HB VAL 18 HB VAL 18 6.537 -1.819 -2.526
163 1HG1 VAL 18 1HG1 VAL 18 7.429 -3.695 -0.297
164 2HG1 VAL 18 2HG1 VAL 18 6.854 -2.025 -0.088
165 3HG1 VAL 18 3HG1 VAL 18 5.745 -3.278 -0.691
166 1HG2 VAL 18 1HG2 VAL 18 8.938 -1.860 -3.159
167 2HG2 VAL 18 2HG2 VAL 18 8.715 -1.205 -1.519
168 3HG2 VAL 18 3HG2 VAL 18 9.292 -2.873 -1.741
169 H SER 19 H SER 19 5.046 -2.696 -4.038
170 HA SER 19 HA SER 19 2.921 -4.153 -2.722
171 1HB SER 19 1HB SER 19 2.991 -3.017 -5.563
172 2HB SER 19 2HB SER 19 1.578 -3.118 -4.480
173 HG SER 19 HG SER 19 2.234 -1.382 -3.343
174 H THR 20 H THR 20 4.973 -5.099 -5.440
175 HA THR 20 HA THR 20 3.092 -7.461 -5.903
176 HB THR 20 HB THR 20 5.528 -6.728 -7.554
177 HG1 THR 20 HG1 THR 20 3.021 -5.397 -8.051
178 1HG2 THR 20 1HG2 THR 20 4.032 -7.419 -9.403
179 2HG2 THR 20 2HG2 THR 20 4.124 -8.681 -8.152
180 3HG2 THR 20 3HG2 THR 20 2.695 -7.625 -8.247
181 H LEU 21 H LEU 21 6.130 -6.635 -4.412
182 HA LEU 21 HA LEU 21 6.912 -9.591 -4.554
183 1HB LEU 21 1HB LEU 21 8.331 -6.924 -4.379
184 2HB LEU 21 2HB LEU 21 9.089 -8.289 -3.534
185 HG LEU 21 HG LEU 21 9.951 -8.110 -5.838
186 1HD1 LEU 21 1HD1 LEU 21 8.064 -10.477 -5.464
187 2HD1 LEU 21 2HD1 LEU 21 9.450 -10.419 -6.578
188 3HD1 LEU 21 3HD1 LEU 21 9.718 -10.358 -4.820
189 1HD2 LEU 21 1HD2 LEU 21 7.971 -7.017 -6.847
190 2HD2 LEU 21 2HD2 LEU 21 8.434 -8.474 -7.758
191 3HD2 LEU 21 3HD2 LEU 21 7.041 -8.522 -6.653
192 H PHE 22 H PHE 22 6.060 -6.935 -2.376
193 HA PHE 22 HA PHE 22 6.923 -8.550 -0.015
194 1HB PHE 22 1HB PHE 22 5.647 -5.859 -0.600
195 2HB PHE 22 2HB PHE 22 5.504 -6.521 1.046
196 HD1 PHE 22 HD1 PHE 22 7.120 -5.765 2.533
197 HD2 PHE 22 HD2 PHE 22 8.182 -6.327 -1.610
198 HE1 PHE 22 HE1 PHE 22 9.448 -5.034 3.029
199 HE2 PHE 22 HE2 PHE 22 10.509 -5.598 -1.113
200 HZ PHE 22 HZ PHE 22 11.142 -4.951 1.208
201 HA PRO 23 HA PRO 23 3.041 -10.799 -0.182
202 1HB PRO 23 1HB PRO 23 3.615 -12.266 1.979
203 2HB PRO 23 2HB PRO 23 4.214 -12.619 0.291
204 1HG PRO 23 1HG PRO 23 5.583 -11.319 2.626
205 2HG PRO 23 2HG PRO 23 6.225 -12.567 1.471
206 1HD PRO 23 1HD PRO 23 6.848 -9.885 1.148
207 2HD PRO 23 2HD PRO 23 6.597 -10.945 -0.236
208 HA PRO 24 HA PRO 24 1.753 -9.184 3.995
209 1HB PRO 24 1HB PRO 24 3.134 -7.149 5.129
210 2HB PRO 24 2HB PRO 24 3.478 -8.903 5.461
211 1HG PRO 24 1HG PRO 24 5.011 -6.905 3.857
212 2HG PRO 24 2HG PRO 24 5.594 -8.371 4.713
213 1HD PRO 24 1HD PRO 24 4.980 -8.137 1.872
214 2HD PRO 24 2HD PRO 24 5.329 -9.679 2.783
215 H ALA 25 H ALA 25 3.039 -7.247 1.431
216 HA ALA 25 HA ALA 25 0.949 -5.106 2.052
217 1HB ALA 25 1HB ALA 25 3.387 -5.168 0.184
218 2HB ALA 25 2HB ALA 25 2.349 -3.751 0.468
219 3HB ALA 25 3HB ALA 25 3.348 -4.401 1.790
220 H ALA 26 H ALA 26 1.786 -7.709 -0.132
221 HA ALA 26 HA ALA 26 -0.186 -6.635 -2.209
222 1HB ALA 26 1HB ALA 26 1.631 -9.087 -2.069
223 2HB ALA 26 2HB ALA 26 0.723 -8.537 -3.498
224 3HB ALA 26 3HB ALA 26 2.053 -7.546 -2.853
225 HA PRO 27 HA PRO 27 -2.339 -10.440 -0.504
226 1HB PRO 27 1HB PRO 27 -3.113 -10.115 2.076
227 2HB PRO 27 2HB PRO 27 -1.611 -11.010 1.567
228 1HG PRO 27 1HG PRO 27 -1.941 -8.283 2.759
229 2HG PRO 27 2HG PRO 27 -0.594 -9.461 2.956
230 1HD PRO 27 1HD PRO 27 -0.601 -7.213 1.149
231 2HD PRO 27 2HD PRO 27 0.508 -8.656 1.024
232 H LEU 28 H LEU 28 -2.692 -7.076 0.480
233 HA LEU 28 HA LEU 28 -5.593 -7.178 0.732
234 1HB LEU 28 1HB LEU 28 -5.316 -4.842 1.149
235 2HB LEU 28 2HB LEU 28 -3.662 -5.303 1.339
236 HG LEU 28 HG LEU 28 -3.818 -3.353 -0.056
237 1HD1 LEU 28 1HD1 LEU 28 -3.119 -5.787 -1.732
238 2HD1 LEU 28 2HD1 LEU 28 -2.611 -4.110 -2.038
239 3HD1 LEU 28 3HD1 LEU 28 -2.029 -4.966 -0.591
240 1HD2 LEU 28 1HD2 LEU 28 -6.095 -3.654 -0.875
241 2HD2 LEU 28 2HD2 LEU 28 -4.950 -3.362 -2.205
242 3HD2 LEU 28 3HD2 LEU 28 -5.557 -5.007 -1.898
243 H ALA 29 H ALA 29 -3.351 -7.027 -2.008
244 HA ALA 29 HA ALA 29 -5.340 -6.162 -3.923
245 1HB ALA 29 1HB ALA 29 -2.886 -8.016 -4.191
246 2HB ALA 29 2HB ALA 29 -3.677 -7.206 -5.564
247 3HB ALA 29 3HB ALA 29 -2.846 -6.242 -4.320
248 H HIS 30 H HIS 30 -4.393 -9.212 -2.453
249 HA HIS 30 HA HIS 30 -5.848 -11.011 -4.140
250 1HB HIS 30 1HB HIS 30 -4.328 -11.052 -1.782
251 2HB HIS 30 2HB HIS 30 -5.950 -11.457 -1.166
252 HD1 HIS 30 HD1 HIS 30 -3.113 -12.764 -3.281
253 HD2 HIS 30 HD2 HIS 30 -7.026 -13.920 -2.178
254 HE1 HIS 30 HE1 HIS 30 -3.404 -15.222 -3.960
255 H ALA 31 H ALA 31 -6.846 -9.500 -1.030
256 HA ALA 31 HA ALA 31 -9.539 -10.367 -0.965
257 1HB ALA 31 1HB ALA 31 -8.392 -7.573 -0.396
258 2HB ALA 31 2HB ALA 31 -9.911 -8.209 0.279
259 3HB ALA 31 3HB ALA 31 -8.357 -8.944 0.739
260 H ILE 32 H ILE 32 -8.190 -7.602 -2.818
261 HA ILE 32 HA ILE 32 -10.758 -6.770 -3.858
262 HB ILE 32 HB ILE 32 -8.018 -6.685 -5.258
263 1HG1 ILE 32 1HG1 ILE 32 -8.852 -5.578 -2.691
264 2HG1 ILE 32 2HG1 ILE 32 -7.245 -5.557 -3.460
265 1HG2 ILE 32 1HG2 ILE 32 -10.375 -4.750 -5.257
266 2HG2 ILE 32 2HG2 ILE 32 -8.843 -4.525 -6.134
267 3HG2 ILE 32 3HG2 ILE 32 -9.938 -5.853 -6.584
268 1HD1 ILE 32 1HD1 ILE 32 -9.539 -3.639 -4.077
269 2HD1 ILE 32 2HD1 ILE 32 -8.096 -3.252 -3.110
270 3HD1 ILE 32 3HD1 ILE 32 -7.933 -3.618 -4.844
271 H GLY 33 H GLY 33 -8.285 -9.068 -5.063
272 1HA GLY 33 1HA GLY 33 -9.768 -9.738 -7.473
273 2HA GLY 33 2HA GLY 33 -8.497 -10.736 -6.711
274 H GLU 34 H GLU 34 -9.731 -11.036 -4.137
275 HA GLU 34 HA GLU 34 -11.392 -13.350 -4.610
276 1HB GLU 34 1HB GLU 34 -11.245 -11.375 -2.253
277 2HB GLU 34 2HB GLU 34 -11.959 -12.996 -2.152
278 1HG GLU 34 1HG GLU 34 -9.856 -14.046 -2.602
279 2HG GLU 34 2HG GLU 34 -9.102 -12.482 -3.030
280 HE2 GLU 34 HE2 GLU 34 -10.009 -12.328 0.793
281 H GLY 35 H GLY 35 -12.202 -9.929 -4.616
282 1HA GLY 35 1HA GLY 35 -14.993 -10.133 -3.998
283 2HA GLY 35 2HA GLY 35 -14.290 -8.933 -5.114
284 H VAL 36 H VAL 36 -13.302 -10.556 -7.164
285 HA VAL 36 HA VAL 36 -15.798 -11.144 -8.559
286 HB VAL 36 HB VAL 36 -13.305 -10.508 -9.361
287 1HG1 VAL 36 1HG1 VAL 36 -13.244 -13.545 -9.441
288 2HG1 VAL 36 2HG1 VAL 36 -12.042 -12.446 -10.157
289 3HG1 VAL 36 3HG1 VAL 36 -12.244 -12.515 -8.390
290 1HG2 VAL 36 1HG2 VAL 36 -15.267 -10.755 -10.847
291 2HG2 VAL 36 2HG2 VAL 36 -13.800 -11.450 -11.577
292 3HG2 VAL 36 3HG2 VAL 36 -15.028 -12.519 -10.860
293 H ASP 37 H ASP 37 -13.302 -13.121 -6.952
294 HA ASP 37 HA ASP 37 -14.401 -15.689 -7.674
295 1HB ASP 37 1HB ASP 37 -12.292 -15.744 -6.601
296 2HB ASP 37 2HB ASP 37 -12.771 -14.495 -5.413
297 HD2 ASP 37 HD2 ASP 37 -14.040 -18.209 -4.605
298 H TYR 38 H TYR 38 -15.161 -13.404 -5.050
299 HA TYR 38 HA TYR 38 -16.924 -15.106 -3.573
300 1HB TYR 38 1HB TYR 38 -16.439 -12.979 -2.619
301 2HB TYR 38 2HB TYR 38 -16.682 -12.133 -4.169
302 HD1 TYR 38 HD1 TYR 38 -18.544 -14.125 -1.578
303 HD2 TYR 38 HD2 TYR 38 -18.722 -11.046 -4.592
304 HE1 TYR 38 HE1 TYR 38 -20.899 -13.639 -0.942
305 HE2 TYR 38 HE2 TYR 38 -21.077 -10.560 -3.957
306 HH TYR 38 HH TYR 38 -22.928 -12.684 -1.846
307 H LEU 39 H LEU 39 -17.742 -12.762 -6.187
308 HA LEU 39 HA LEU 39 -20.501 -13.561 -6.393
309 1HB LEU 39 1HB LEU 39 -18.374 -12.342 -8.171
310 2HB LEU 39 2HB LEU 39 -19.912 -12.825 -8.932
311 HG LEU 39 HG LEU 39 -20.607 -11.489 -6.520
312 1HD1 LEU 39 1HD1 LEU 39 -18.529 -9.961 -8.150
313 2HD1 LEU 39 2HD1 LEU 39 -19.512 -9.288 -6.827
314 3HD1 LEU 39 3HD1 LEU 39 -18.311 -10.556 -6.486
315 1HD2 LEU 39 1HD2 LEU 39 -21.879 -11.506 -8.646
316 2HD2 LEU 39 2HD2 LEU 39 -21.592 -9.842 -8.086
317 3HD2 LEU 39 3HD2 LEU 39 -20.614 -10.516 -9.412
318 H LEU 40 H LEU 40 -17.542 -14.921 -7.835
319 HA LEU 40 HA LEU 40 -18.921 -16.793 -9.593
320 1HB LEU 40 1HB LEU 40 -16.272 -16.048 -8.817
321 2HB LEU 40 2HB LEU 40 -16.398 -17.783 -8.447
322 HG LEU 40 HG LEU 40 -15.605 -17.336 -10.789
323 1HD1 LEU 40 1HD1 LEU 40 -18.368 -18.612 -10.567
324 2HD1 LEU 40 2HD1 LEU 40 -17.203 -18.883 -11.884
325 3HD1 LEU 40 3HD1 LEU 40 -16.821 -19.425 -10.232
326 1HD2 LEU 40 1HD2 LEU 40 -16.889 -15.246 -11.158
327 2HD2 LEU 40 2HD2 LEU 40 -17.243 -16.445 -12.424
328 3HD2 LEU 40 3HD2 LEU 40 -18.408 -16.170 -11.108
329 H GLY 41 H GLY 41 -18.335 -16.767 -6.128
330 1HA GLY 41 1HA GLY 41 -18.806 -19.687 -5.881
331 2HA GLY 41 2HA GLY 41 -18.698 -18.511 -4.544
332 H ASP 42 H ASP 42 -20.815 -18.966 -7.418
333 HA ASP 42 HA ASP 42 -23.200 -18.849 -7.563
334 1HB ASP 42 1HB ASP 42 -22.637 -20.905 -6.055
335 2HB ASP 42 2HB ASP 42 -23.153 -19.870 -4.698
336 HD2 ASP 42 HD2 ASP 42 -26.508 -20.286 -5.642
337 H GLU 43 H GLU 43 -21.719 -16.499 -6.410
338 HA GLU 43 HA GLU 43 -24.076 -15.426 -4.810
339 1HB GLU 43 1HB GLU 43 -21.066 -14.830 -4.813
340 2HB GLU 43 2HB GLU 43 -22.239 -13.790 -3.970
341 1HG GLU 43 1HG GLU 43 -22.494 -16.697 -3.418
342 2HG GLU 43 2HG GLU 43 -20.993 -15.936 -2.824
343 HE2 GLU 43 HE2 GLU 43 -24.095 -13.952 -1.382
344 H ALA 44 H ALA 44 -24.420 -15.442 -7.497
345 HA ALA 44 HA ALA 44 -24.084 -12.505 -8.111
346 1HB ALA 44 1HB ALA 44 -23.433 -14.889 -9.953
347 2HB ALA 44 2HB ALA 44 -23.350 -13.180 -10.442
348 3HB ALA 44 3HB ALA 44 -22.225 -13.809 -9.214
349 H GLN 45 H GLN 45 -25.426 -12.061 -10.254
350 HA GLN 45 HA GLN 45 -27.836 -13.895 -10.272
351 1HB GLN 45 1HB GLN 45 -29.158 -11.590 -10.337
352 2HB GLN 45 2HB GLN 45 -28.524 -12.120 -8.769
353 1HG GLN 45 1HG GLN 45 -26.715 -10.479 -10.505
354 2HG GLN 45 2HG GLN 45 -28.085 -9.656 -9.719
355 1HE2 GLN 45 2HE2 GLN 45 -28.338 -10.693 -7.236
356 2HE2 GLN 45 1HE2 GLN 45 -26.802 -10.614 -6.331
357 H ALA 46 H ALA 46 -25.536 -13.435 -12.079
358 HA ALA 46 HA ALA 46 -27.087 -13.234 -14.511
359 1HB ALA 46 1HB ALA 46 -25.973 -11.095 -15.348
360 2HB ALA 46 2HB ALA 46 -26.967 -10.816 -13.898
361 3HB ALA 46 3HB ALA 46 -25.196 -10.927 -13.757
Start of MODEL 10
1 1H PHE 1 1H PHE 1 30.400 7.139 1.782
2 2H PHE 1 2H PHE 1 30.140 6.378 3.259
3 3H PHE 1 3H PHE 1 31.130 5.659 2.106
4 HA PHE 1 HA PHE 1 29.194 5.347 0.607
5 1HB PHE 1 2HB PHE 1 28.920 4.386 3.500
6 2HB PHE 1 1HB PHE 1 28.150 3.634 2.083
7 HD1 PHE 1 HD1 PHE 1 31.082 3.727 4.157
8 HD2 PHE 1 HD2 PHE 1 29.723 2.879 0.150
9 HE1 PHE 1 HE1 PHE 1 33.149 2.407 3.733
10 HE2 PHE 1 HE2 PHE 1 31.788 1.554 -0.268
11 HZ PHE 1 HZ PHE 1 33.502 1.321 1.520
12 H GLY 2 H GLY 2 26.855 5.440 0.438
13 1HA GLY 2 1HA GLY 2 25.667 7.471 2.344
14 2HA GLY 2 2HA GLY 2 25.482 7.656 0.572
15 H PHE 3 H PHE 3 25.458 4.664 2.517
16 HA PHE 3 HA PHE 3 23.297 3.417 1.130
17 1HB PHE 3 1HB PHE 3 23.999 3.314 4.116
18 2HB PHE 3 2HB PHE 3 23.165 2.035 3.197
19 HD1 PHE 3 HD1 PHE 3 26.130 2.497 4.683
20 HD2 PHE 3 HD2 PHE 3 24.631 1.911 0.681
21 HE1 PHE 3 HE1 PHE 3 28.334 1.568 3.993
22 HE2 PHE 3 HE2 PHE 3 26.836 0.980 -0.008
23 HZ PHE 3 HZ PHE 3 28.687 0.809 1.648
24 H LYS 4 H LYS 4 23.133 5.564 4.000
25 HA LYS 4 HA LYS 4 20.353 5.344 4.564
26 1HB LYS 4 1HB LYS 4 22.411 7.582 4.581
27 2HB LYS 4 2HB LYS 4 20.723 7.966 4.990
28 1HG LYS 4 1HG LYS 4 20.765 6.172 6.733
29 2HG LYS 4 2HG LYS 4 22.476 5.870 6.354
30 1HD LYS 4 1HD LYS 4 23.021 8.223 6.957
31 2HD LYS 4 2HD LYS 4 21.314 8.519 7.341
32 1HE LYS 4 1HE LYS 4 23.279 6.699 8.696
33 2HE LYS 4 2HE LYS 4 22.332 8.090 9.382
34 1HZ LYS 4 1HZ LYS 4 21.166 5.546 8.296
35 2HZ LYS 4 2HZ LYS 4 21.262 5.901 9.938
36 3HZ LYS 4 3HZ LYS 4 20.290 6.834 8.931
37 H ASP 5 H ASP 5 21.870 7.503 2.082
38 HA ASP 5 HA ASP 5 19.255 8.467 1.199
39 1HB ASP 5 1HB ASP 5 21.699 9.337 0.791
40 2HB ASP 5 2HB ASP 5 21.701 8.176 -0.575
41 HD2 ASP 5 HD2 ASP 5 18.970 10.121 -2.034
42 H ILE 6 H ILE 6 21.395 5.798 0.213
43 HA ILE 6 HA ILE 6 19.878 5.004 -2.089
44 HB ILE 6 HB ILE 6 21.260 3.191 -0.019
45 1HG1 ILE 6 1HG1 ILE 6 22.328 5.390 -1.628
46 2HG1 ILE 6 2HG1 ILE 6 23.134 4.413 -0.376
47 1HG2 ILE 6 1HG2 ILE 6 20.995 3.001 -3.052
48 2HG2 ILE 6 2HG2 ILE 6 21.857 1.845 -2.008
49 3HG2 ILE 6 3HG2 ILE 6 20.092 2.025 -1.869
50 1HD1 ILE 6 1HD1 ILE 6 22.720 3.589 -3.284
51 2HD1 ILE 6 2HD1 ILE 6 24.253 4.147 -2.572
52 3HD1 ILE 6 3HD1 ILE 6 23.527 2.613 -2.034
53 H ILE 7 H ILE 7 19.446 4.358 1.405
54 HA ILE 7 HA ILE 7 17.318 2.424 1.068
55 HB ILE 7 HB ILE 7 17.661 4.533 3.281
56 1HG1 ILE 7 1HG1 ILE 7 19.510 2.504 2.367
57 2HG1 ILE 7 2HG1 ILE 7 19.689 3.636 3.727
58 1HG2 ILE 7 1HG2 ILE 7 16.614 1.667 3.328
59 2HG2 ILE 7 2HG2 ILE 7 16.757 2.747 4.737
60 3HG2 ILE 7 3HG2 ILE 7 15.617 3.138 3.427
61 1HD1 ILE 7 1HD1 ILE 7 18.211 0.969 3.816
62 2HD1 ILE 7 2HD1 ILE 7 19.822 1.288 4.503
63 3HD1 ILE 7 3HD1 ILE 7 18.390 2.102 5.176
64 H ARG 8 H ARG 8 17.365 6.004 1.261
65 HA ARG 8 HA ARG 8 14.505 6.350 1.281
66 1HB ARG 8 1HB ARG 8 16.880 7.931 0.124
67 2HB ARG 8 2HB ARG 8 15.233 8.596 0.103
68 1HG ARG 8 1HG ARG 8 15.173 8.876 2.414
69 2HG ARG 8 2HG ARG 8 16.277 7.525 2.718
70 1HD ARG 8 1HD ARG 8 16.953 10.124 2.900
71 2HD ARG 8 2HD ARG 8 18.113 8.785 2.521
72 HE ARG 8 HE ARG 8 17.841 9.339 0.057
73 1HH1 ARG 8 1HH2 ARG 8 15.251 10.995 1.267
74 2HH1 ARG 8 2HH2 ARG 8 15.704 12.616 0.677
75 1HH2 ARG 8 2HH1 ARG 8 19.014 11.649 -0.148
76 2HH2 ARG 8 1HH1 ARG 8 17.832 12.987 -0.123
77 H ALA 9 H ALA 9 16.845 6.143 -1.434
78 HA ALA 9 HA ALA 9 14.799 6.351 -3.492
79 1HB ALA 9 1HB ALA 9 17.529 4.929 -3.435
80 2HB ALA 9 2HB ALA 9 16.655 5.390 -4.916
81 3HB ALA 9 3HB ALA 9 17.277 6.648 -3.821
82 H ILE 10 H ILE 10 16.291 3.596 -1.779
83 HA ILE 10 HA ILE 10 14.958 1.547 -3.326
84 HB ILE 10 HB ILE 10 16.227 1.871 -0.587
85 1HG1 ILE 10 1HG1 ILE 10 17.092 1.091 -3.105
86 2HG1 ILE 10 2HG1 ILE 10 17.936 0.743 -1.572
87 1HG2 ILE 10 1HG2 ILE 10 14.687 -0.615 -1.447
88 2HG2 ILE 10 2HG2 ILE 10 15.717 -0.473 -0.002
89 3HG2 ILE 10 3HG2 ILE 10 14.224 0.487 -0.130
90 1HD1 ILE 10 1HD1 ILE 10 15.840 -1.043 -2.897
91 2HD1 ILE 10 2HD1 ILE 10 17.595 -1.338 -2.895
92 3HD1 ILE 10 3HD1 ILE 10 16.682 -1.391 -1.369
93 H ARG 11 H ARG 11 13.982 3.392 -0.414
94 HA ARG 11 HA ARG 11 11.558 1.898 0.083
95 1HB ARG 11 1HB ARG 11 12.921 4.201 1.028
96 2HB ARG 11 2HB ARG 11 11.329 4.807 0.500
97 1HG ARG 11 1HG ARG 11 11.754 2.417 2.352
98 2HG ARG 11 2HG ARG 11 11.335 4.059 2.900
99 1HD ARG 11 1HD ARG 11 9.605 3.309 0.767
100 2HD ARG 11 2HD ARG 11 9.634 1.994 2.027
101 HE ARG 11 HE ARG 11 9.030 3.746 3.765
102 1HH1 ARG 11 2HH1 ARG 11 6.680 3.845 1.879
103 2HH1 ARG 11 1HH1 ARG 11 6.570 5.580 1.478
104 1HH2 ARG 11 1HH2 ARG 11 9.877 6.275 2.560
105 2HH2 ARG 11 2HH2 ARG 11 8.383 6.958 1.864
106 H ARG 12 H ARG 12 12.283 4.562 -2.179
107 HA ARG 12 HA ARG 12 9.416 4.751 -2.971
108 1HB ARG 12 1HB ARG 12 11.993 5.768 -4.298
109 2HB ARG 12 2HB ARG 12 10.350 6.383 -4.598
110 1HG ARG 12 1HG ARG 12 10.204 7.042 -2.173
111 2HG ARG 12 2HG ARG 12 11.892 6.531 -1.965
112 1HD ARG 12 1HD ARG 12 11.454 8.982 -2.369
113 2HD ARG 12 2HD ARG 12 12.699 8.160 -3.410
114 HE ARG 12 HE ARG 12 9.840 8.245 -4.444
115 1HH1 ARG 12 2HH1 ARG 12 12.300 7.591 -6.152
116 2HH1 ARG 12 1HH1 ARG 12 12.534 9.113 -7.054
117 1HH2 ARG 12 1HH2 ARG 12 10.529 11.013 -4.826
118 2HH2 ARG 12 2HH2 ARG 12 11.531 11.052 -6.303
119 H ILE 13 H ILE 13 12.425 3.365 -4.362
120 HA ILE 13 HA ILE 13 11.033 2.449 -6.785
121 HB ILE 13 HB ILE 13 13.586 2.847 -6.213
122 1HG1 ILE 13 1HG1 ILE 13 12.266 1.357 -8.176
123 2HG1 ILE 13 2HG1 ILE 13 13.972 1.872 -8.205
124 1HG2 ILE 13 1HG2 ILE 13 13.214 -0.027 -5.279
125 2HG2 ILE 13 2HG2 ILE 13 14.769 0.814 -5.481
126 3HG2 ILE 13 3HG2 ILE 13 13.618 1.359 -4.238
127 1HD1 ILE 13 1HD1 ILE 13 12.915 -0.726 -6.998
128 2HD1 ILE 13 2HD1 ILE 13 13.773 -0.578 -8.550
129 3HD1 ILE 13 3HD1 ILE 13 14.618 -0.213 -7.028
130 H ALA 14 H ALA 14 11.347 1.206 -3.506
131 HA ALA 14 HA ALA 14 10.617 -1.577 -4.300
132 1HB ALA 14 1HB ALA 14 10.556 -0.069 -1.629
133 2HB ALA 14 2HB ALA 14 10.454 -1.835 -1.815
134 3HB ALA 14 3HB ALA 14 11.951 -0.979 -2.254
135 H VAL 15 H VAL 15 8.860 1.379 -3.483
136 HA VAL 15 HA VAL 15 6.410 0.302 -2.517
137 HB VAL 15 HB VAL 15 6.869 2.464 -4.636
138 1HG1 VAL 15 1HG1 VAL 15 4.574 2.019 -2.676
139 2HG1 VAL 15 2HG1 VAL 15 4.749 3.407 -3.774
140 3HG1 VAL 15 3HG1 VAL 15 4.498 1.775 -4.438
141 1HG2 VAL 15 1HG2 VAL 15 8.208 2.784 -2.564
142 2HG2 VAL 15 2HG2 VAL 15 6.908 3.993 -2.682
143 3HG2 VAL 15 3HG2 VAL 15 6.732 2.602 -1.586
144 HA PRO 16 HA PRO 16 4.883 -0.791 -6.883
145 1HB PRO 16 1HB PRO 16 6.708 -1.030 -8.854
146 2HB PRO 16 2HB PRO 16 5.771 0.496 -8.504
147 1HG PRO 16 1HG PRO 16 8.596 -0.269 -7.811
148 2HG PRO 16 2HG PRO 16 7.956 1.322 -8.391
149 1HD PRO 16 1HD PRO 16 8.489 0.830 -5.705
150 2HD PRO 16 2HD PRO 16 7.220 1.931 -6.238
151 H VAL 17 H VAL 17 8.314 -1.799 -6.408
152 HA VAL 17 HA VAL 17 7.896 -4.491 -7.357
153 HB VAL 17 HB VAL 17 9.683 -3.485 -5.063
154 1HG1 VAL 17 1HG1 VAL 17 10.033 -5.766 -7.059
155 2HG1 VAL 17 2HG1 VAL 17 11.210 -5.284 -5.812
156 3HG1 VAL 17 3HG1 VAL 17 9.629 -5.948 -5.334
157 1HG2 VAL 17 1HG2 VAL 17 9.883 -2.049 -7.081
158 2HG2 VAL 17 2HG2 VAL 17 11.358 -3.014 -6.833
159 3HG2 VAL 17 3HG2 VAL 17 10.180 -3.494 -8.077
160 H VAL 18 H VAL 18 7.584 -3.100 -4.063
161 HA VAL 18 HA VAL 18 6.834 -5.584 -2.796
162 HB VAL 18 HB VAL 18 6.094 -2.632 -2.277
163 1HG1 VAL 18 1HG1 VAL 18 6.015 -5.008 -0.377
164 2HG1 VAL 18 2HG1 VAL 18 5.710 -3.309 0.057
165 3HG1 VAL 18 3HG1 VAL 18 4.597 -4.161 -1.039
166 1HG2 VAL 18 1HG2 VAL 18 8.530 -3.115 -2.348
167 2HG2 VAL 18 2HG2 VAL 18 7.998 -2.715 -0.698
168 3HG2 VAL 18 3HG2 VAL 18 8.304 -4.409 -1.148
169 H SER 19 H SER 19 4.829 -2.969 -4.245
170 HA SER 19 HA SER 19 2.271 -4.234 -3.720
171 1HB SER 19 1HB SER 19 3.234 -2.557 -6.096
172 2HB SER 19 2HB SER 19 1.548 -2.711 -5.538
173 HG SER 19 HG SER 19 2.917 -2.026 -3.351
174 H THR 20 H THR 20 4.793 -5.121 -5.985
175 HA THR 20 HA THR 20 2.749 -6.888 -7.396
176 HB THR 20 HB THR 20 5.634 -6.372 -8.224
177 HG1 THR 20 HG1 THR 20 3.497 -4.502 -8.011
178 1HG2 THR 20 1HG2 THR 20 4.641 -6.534 -10.490
179 2HG2 THR 20 2HG2 THR 20 4.241 -7.969 -9.517
180 3HG2 THR 20 3HG2 THR 20 3.022 -6.698 -9.771
181 H LEU 21 H LEU 21 5.451 -6.931 -5.169
182 HA LEU 21 HA LEU 21 5.749 -9.930 -5.681
183 1HB LEU 21 1HB LEU 21 7.455 -7.652 -4.665
184 2HB LEU 21 2HB LEU 21 7.739 -9.246 -3.937
185 HG LEU 21 HG LEU 21 9.211 -8.939 -5.882
186 1HD1 LEU 21 1HD1 LEU 21 6.912 -10.857 -6.470
187 2HD1 LEU 21 2HD1 LEU 21 8.542 -10.940 -7.178
188 3HD1 LEU 21 3HD1 LEU 21 8.315 -11.207 -5.433
189 1HD2 LEU 21 1HD2 LEU 21 7.807 -7.295 -7.095
190 2HD2 LEU 21 2HD2 LEU 21 8.246 -8.663 -8.145
191 3HD2 LEU 21 3HD2 LEU 21 6.614 -8.569 -7.441
192 H PHE 22 H PHE 22 4.304 -7.669 -3.488
193 HA PHE 22 HA PHE 22 4.531 -9.649 -1.226
194 1HB PHE 22 1HB PHE 22 3.542 -6.819 -1.676
195 2HB PHE 22 2HB PHE 22 2.906 -7.717 -0.278
196 HD1 PHE 22 HD1 PHE 22 6.298 -7.729 -1.910
197 HD2 PHE 22 HD2 PHE 22 3.984 -6.907 1.636
198 HE1 PHE 22 HE1 PHE 22 8.393 -7.268 -0.649
199 HE2 PHE 22 HE2 PHE 22 6.080 -6.443 2.896
200 HZ PHE 22 HZ PHE 22 8.285 -6.624 1.753
201 HA PRO 23 HA PRO 23 0.763 -11.496 -2.899
202 1HB PRO 23 1HB PRO 23 0.777 -13.499 -1.130
203 2HB PRO 23 2HB PRO 23 1.742 -13.473 -2.679
204 1HG PRO 23 1HG PRO 23 2.570 -12.918 0.154
205 2HG PRO 23 2HG PRO 23 3.423 -13.898 -1.118
206 1HD PRO 23 1HD PRO 23 4.189 -11.287 -0.590
207 2HD PRO 23 2HD PRO 23 4.232 -11.948 -2.222
208 HA PRO 24 HA PRO 24 -1.415 -10.806 1.124
209 1HB PRO 24 1HB PRO 24 -0.210 -9.419 3.124
210 2HB PRO 24 2HB PRO 24 -0.091 -11.223 2.952
211 1HG PRO 24 1HG PRO 24 1.958 -9.119 2.502
212 2HG PRO 24 2HG PRO 24 2.174 -10.869 2.828
213 1HD PRO 24 1HD PRO 24 2.201 -9.505 0.208
214 2HD PRO 24 2HD PRO 24 2.392 -11.292 0.536
215 H ALA 25 H ALA 25 -0.269 -8.842 -1.020
216 HA ALA 25 HA ALA 25 -2.014 -6.579 -0.090
217 1HB ALA 25 1HB ALA 25 0.975 -6.301 -0.752
218 2HB ALA 25 2HB ALA 25 -0.123 -4.946 -0.399
219 3HB ALA 25 3HB ALA 25 0.270 -6.127 0.873
220 H ALA 26 H ALA 26 0.378 -7.665 -2.536
221 HA ALA 26 HA ALA 26 -0.455 -6.018 -4.717
222 1HB ALA 26 1HB ALA 26 0.275 -8.989 -4.697
223 2HB ALA 26 2HB ALA 26 0.380 -7.908 -6.107
224 3HB ALA 26 3HB ALA 26 1.439 -7.643 -4.702
225 HA PRO 27 HA PRO 27 -3.890 -9.004 -5.960
226 1HB PRO 27 1HB PRO 27 -4.763 -10.814 -4.156
227 2HB PRO 27 2HB PRO 27 -3.476 -11.149 -5.406
228 1HG PRO 27 1HG PRO 27 -3.241 -10.543 -2.471
229 2HG PRO 27 2HG PRO 27 -2.311 -11.731 -3.467
230 1HD PRO 27 1HD PRO 27 -1.289 -9.234 -2.776
231 2HD PRO 27 2HD PRO 27 -0.840 -10.077 -4.259
232 H LEU 28 H LEU 28 -3.609 -8.068 -2.555
233 HA LEU 28 HA LEU 28 -6.503 -7.700 -2.265
234 1HB LEU 28 1HB LEU 28 -4.122 -6.397 -0.813
235 2HB LEU 28 2HB LEU 28 -5.786 -6.459 -0.196
236 HG LEU 28 HG LEU 28 -3.843 -8.759 -0.608
237 1HD1 LEU 28 1HD1 LEU 28 -5.545 -7.819 1.744
238 2HD1 LEU 28 2HD1 LEU 28 -4.425 -9.202 1.759
239 3HD1 LEU 28 3HD1 LEU 28 -3.797 -7.549 1.555
240 1HD2 LEU 28 1HD2 LEU 28 -6.028 -9.404 -1.590
241 2HD2 LEU 28 2HD2 LEU 28 -5.724 -10.282 -0.072
242 3HD2 LEU 28 3HD2 LEU 28 -6.848 -8.904 -0.092
243 H ALA 29 H ALA 29 -3.723 -5.532 -3.004
244 HA ALA 29 HA ALA 29 -5.280 -3.164 -3.247
245 1HB ALA 29 1HB ALA 29 -2.888 -4.171 -4.927
246 2HB ALA 29 2HB ALA 29 -3.365 -2.461 -4.803
247 3HB ALA 29 3HB ALA 29 -2.756 -3.321 -3.369
248 H HIS 30 H HIS 30 -4.617 -5.858 -5.418
249 HA HIS 30 HA HIS 30 -5.850 -4.898 -7.808
250 1HB HIS 30 1HB HIS 30 -4.725 -7.249 -6.754
251 2HB HIS 30 2HB HIS 30 -6.429 -7.724 -6.935
252 HD1 HIS 30 HD1 HIS 30 -3.304 -6.941 -8.861
253 HD2 HIS 30 HD2 HIS 30 -7.394 -7.649 -9.664
254 HE1 HIS 30 HE1 HIS 30 -3.529 -7.352 -11.384
255 H ALA 31 H ALA 31 -7.288 -6.728 -5.081
256 HA ALA 31 HA ALA 31 -9.993 -6.693 -6.116
257 1HB ALA 31 1HB ALA 31 -8.907 -6.606 -3.244
258 2HB ALA 31 2HB ALA 31 -10.541 -7.142 -3.703
259 3HB ALA 31 3HB ALA 31 -9.120 -8.084 -4.212
260 H ILE 32 H ILE 32 -8.194 -4.333 -4.125
261 HA ILE 32 HA ILE 32 -10.611 -2.643 -3.783
262 HB ILE 32 HB ILE 32 -7.666 -1.841 -3.560
263 1HG1 ILE 32 1HG1 ILE 32 -9.070 -3.971 -2.154
264 2HG1 ILE 32 2HG1 ILE 32 -7.361 -3.480 -2.039
265 1HG2 ILE 32 1HG2 ILE 32 -10.165 -1.068 -1.991
266 2HG2 ILE 32 2HG2 ILE 32 -8.525 -0.436 -1.712
267 3HG2 ILE 32 3HG2 ILE 32 -9.372 -0.073 -3.236
268 1HD1 ILE 32 1HD1 ILE 32 -9.699 -2.148 -0.594
269 2HD1 ILE 32 2HD1 ILE 32 -8.507 -3.240 0.151
270 3HD1 ILE 32 3HD1 ILE 32 -7.992 -1.657 -0.479
271 H GLY 33 H GLY 33 -7.850 -2.745 -6.047
272 1HA GLY 33 1HA GLY 33 -8.297 -0.171 -7.221
273 2HA GLY 33 2HA GLY 33 -7.617 -1.584 -8.082
274 H GLU 34 H GLU 34 -9.584 -3.378 -8.204
275 HA GLU 34 HA GLU 34 -12.228 -2.234 -8.834
276 1HB GLU 34 1HB GLU 34 -10.047 -2.262 -10.845
277 2HB GLU 34 2HB GLU 34 -11.443 -3.210 -11.396
278 1HG GLU 34 1HG GLU 34 -12.067 -0.573 -10.152
279 2HG GLU 34 2HG GLU 34 -11.238 -0.522 -11.727
280 HE2 GLU 34 HE2 GLU 34 -14.338 -2.726 -12.446
281 H GLY 35 H GLY 35 -10.750 -4.580 -7.494
282 1HA GLY 35 1HA GLY 35 -11.684 -6.848 -9.161
283 2HA GLY 35 2HA GLY 35 -10.960 -6.948 -7.525
284 H VAL 36 H VAL 36 -12.491 -5.580 -5.874
285 HA VAL 36 HA VAL 36 -14.838 -7.186 -5.538
286 HB VAL 36 HB VAL 36 -15.512 -5.191 -4.033
287 1HG1 VAL 36 1HG1 VAL 36 -12.647 -6.230 -3.843
288 2HG1 VAL 36 2HG1 VAL 36 -13.580 -5.512 -2.508
289 3HG1 VAL 36 3HG1 VAL 36 -14.094 -7.058 -3.223
290 1HG2 VAL 36 1HG2 VAL 36 -14.499 -3.410 -5.429
291 2HG2 VAL 36 2HG2 VAL 36 -13.827 -3.394 -3.781
292 3HG2 VAL 36 3HG2 VAL 36 -12.881 -4.088 -5.119
293 H ASP 37 H ASP 37 -14.412 -4.052 -7.224
294 HA ASP 37 HA ASP 37 -17.225 -3.646 -7.746
295 1HB ASP 37 1HB ASP 37 -15.442 -1.960 -8.152
296 2HB ASP 37 2HB ASP 37 -14.702 -3.022 -9.383
297 HD2 ASP 37 HD2 ASP 37 -16.958 -1.792 -11.763
298 H TYR 38 H TYR 38 -14.673 -5.311 -9.623
299 HA TYR 38 HA TYR 38 -16.380 -6.117 -11.816
300 1HB TYR 38 1HB TYR 38 -14.245 -6.851 -12.370
301 2HB TYR 38 2HB TYR 38 -13.721 -6.640 -10.690
302 HD1 TYR 38 HD1 TYR 38 -13.101 -8.526 -9.448
303 HD2 TYR 38 HD2 TYR 38 -15.738 -8.989 -12.831
304 HE1 TYR 38 HE1 TYR 38 -12.998 -10.999 -9.193
305 HE2 TYR 38 HE2 TYR 38 -15.646 -11.458 -12.565
306 HH TYR 38 HH TYR 38 -13.960 -12.987 -9.763
307 H LEU 39 H LEU 39 -15.527 -7.852 -8.795
308 HA LEU 39 HA LEU 39 -17.377 -10.080 -9.471
309 1HB LEU 39 1HB LEU 39 -16.684 -10.836 -7.192
310 2HB LEU 39 2HB LEU 39 -15.282 -10.345 -8.151
311 HG LEU 39 HG LEU 39 -15.532 -8.050 -7.090
312 1HD1 LEU 39 1HD1 LEU 39 -17.294 -9.716 -5.240
313 2HD1 LEU 39 2HD1 LEU 39 -16.760 -8.049 -4.923
314 3HD1 LEU 39 3HD1 LEU 39 -17.846 -8.390 -6.291
315 1HD2 LEU 39 1HD2 LEU 39 -13.785 -9.693 -6.432
316 2HD2 LEU 39 2HD2 LEU 39 -14.370 -8.798 -5.010
317 3HD2 LEU 39 3HD2 LEU 39 -14.929 -10.461 -5.305
318 H LEU 40 H LEU 40 -17.837 -6.912 -8.154
319 HA LEU 40 HA LEU 40 -20.041 -7.608 -6.371
320 1HB LEU 40 1HB LEU 40 -18.634 -5.289 -7.348
321 2HB LEU 40 2HB LEU 40 -20.352 -5.010 -7.708
322 HG LEU 40 HG LEU 40 -20.125 -6.130 -5.053
323 1HD1 LEU 40 1HD1 LEU 40 -18.442 -3.638 -5.574
324 2HD1 LEU 40 2HD1 LEU 40 -18.844 -4.306 -3.974
325 3HD1 LEU 40 3HD1 LEU 40 -17.815 -5.232 -5.092
326 1HD2 LEU 40 1HD2 LEU 40 -21.982 -4.735 -5.927
327 2HD2 LEU 40 2HD2 LEU 40 -21.273 -4.014 -4.462
328 3HD2 LEU 40 3HD2 LEU 40 -20.875 -3.349 -6.063
329 H GLY 41 H GLY 41 -19.822 -6.685 -9.812
330 1HA GLY 41 1HA GLY 41 -21.903 -8.328 -10.733
331 2HA GLY 41 2HA GLY 41 -22.746 -6.862 -10.162
332 H ASP 42 H ASP 42 -19.596 -7.421 -11.826
333 HA ASP 42 HA ASP 42 -20.564 -5.383 -13.881
334 1HB ASP 42 1HB ASP 42 -18.545 -4.938 -12.264
335 2HB ASP 42 2HB ASP 42 -17.683 -6.160 -13.237
336 HD2 ASP 42 HD2 ASP 42 -17.023 -3.168 -15.101
337 H GLU 43 H GLU 43 -21.084 -8.282 -13.930
338 HA GLU 43 HA GLU 43 -19.135 -9.385 -15.876
339 1HB GLU 43 1HB GLU 43 -21.993 -10.230 -15.112
340 2HB GLU 43 2HB GLU 43 -20.757 -11.276 -15.855
341 1HG GLU 43 1HG GLU 43 -20.126 -11.845 -13.757
342 2HG GLU 43 2HG GLU 43 -19.497 -10.186 -13.586
343 HE2 GLU 43 HE2 GLU 43 -22.370 -10.961 -11.216
344 H ALA 44 H ALA 44 -19.744 -7.015 -16.958
345 HA ALA 44 HA ALA 44 -21.797 -7.722 -19.087
346 1HB ALA 44 1HB ALA 44 -20.795 -5.014 -18.008
347 2HB ALA 44 2HB ALA 44 -22.044 -5.203 -19.260
348 3HB ALA 44 3HB ALA 44 -22.358 -5.760 -17.599
349 H GLN 45 H GLN 45 -18.751 -5.946 -18.422
350 HA GLN 45 HA GLN 45 -17.821 -6.864 -21.144
351 1HB GLN 45 1HB GLN 45 -18.246 -4.062 -20.063
352 2HB GLN 45 2HB GLN 45 -16.814 -4.320 -21.084
353 1HG GLN 45 1HG GLN 45 -18.198 -4.025 -22.846
354 2HG GLN 45 2HG GLN 45 -18.840 -5.644 -22.467
355 1HE2 GLN 45 2HE2 GLN 45 -21.034 -5.769 -21.910
356 2HE2 GLN 45 1HE2 GLN 45 -22.015 -4.356 -21.438
357 H ALA 46 H ALA 46 -17.217 -7.864 -18.533
358 HA ALA 46 HA ALA 46 -14.305 -7.329 -18.625
359 1HB ALA 46 1HB ALA 46 -14.291 -6.866 -16.110
360 2HB ALA 46 2HB ALA 46 -15.233 -5.657 -17.014
361 3HB ALA 46 3HB ALA 46 -16.068 -6.956 -16.128
Start of MODEL 11
1 1H PHE 1 1H PHE 1 23.592 9.237 -0.054
2 2H PHE 1 2H PHE 1 24.889 10.271 0.221
3 3H PHE 1 3H PHE 1 24.384 9.957 -1.352
4 HA PHE 1 HA PHE 1 25.074 7.602 -1.125
5 1HB PHE 1 2HB PHE 1 26.572 9.463 -1.970
6 2HB PHE 1 1HB PHE 1 27.157 9.681 -0.301
7 HD1 PHE 1 HD1 PHE 1 28.844 8.282 0.589
8 HD2 PHE 1 HD2 PHE 1 26.827 7.160 -3.056
9 HE1 PHE 1 HE1 PHE 1 30.461 6.416 0.268
10 HE2 PHE 1 HE2 PHE 1 28.448 5.296 -3.377
11 HZ PHE 1 HZ PHE 1 30.262 4.924 -1.715
12 H GLY 2 H GLY 2 26.111 6.019 0.188
13 1HA GLY 2 1HA GLY 2 27.223 5.764 2.494
14 2HA GLY 2 2HA GLY 2 25.839 6.719 3.119
15 H PHE 3 H PHE 3 23.669 5.809 2.867
16 HA PHE 3 HA PHE 3 23.257 3.102 1.858
17 1HB PHE 3 1HB PHE 3 24.570 3.283 4.358
18 2HB PHE 3 2HB PHE 3 22.868 2.965 4.783
19 HD1 PHE 3 HD1 PHE 3 21.686 0.978 3.757
20 HD2 PHE 3 HD2 PHE 3 25.939 1.588 3.384
21 HE1 PHE 3 HE1 PHE 3 21.972 -1.408 3.109
22 HE2 PHE 3 HE2 PHE 3 26.224 -0.798 2.736
23 HZ PHE 3 HZ PHE 3 24.242 -2.298 2.601
24 H LYS 4 H LYS 4 22.179 5.032 4.720
25 HA LYS 4 HA LYS 4 19.397 4.434 4.464
26 1HB LYS 4 1HB LYS 4 20.920 6.973 5.289
27 2HB LYS 4 2HB LYS 4 19.178 6.770 5.570
28 1HG LYS 4 1HG LYS 4 21.036 4.587 6.498
29 2HG LYS 4 2HG LYS 4 20.962 6.091 7.440
30 1HD LYS 4 1HD LYS 4 18.311 5.695 7.134
31 2HD LYS 4 2HD LYS 4 18.840 4.006 6.995
32 1HE LYS 4 1HE LYS 4 18.266 4.720 9.290
33 2HE LYS 4 2HE LYS 4 19.962 4.098 9.085
34 1HZ LYS 4 1HZ LYS 4 19.142 6.985 9.047
35 2HZ LYS 4 2HZ LYS 4 19.932 6.258 10.341
36 3HZ LYS 4 3HZ LYS 4 20.710 6.409 8.858
37 H ASP 5 H ASP 5 21.297 7.007 2.834
38 HA ASP 5 HA ASP 5 19.035 8.200 1.462
39 1HB ASP 5 1HB ASP 5 20.796 9.186 0.052
40 2HB ASP 5 2HB ASP 5 21.449 9.058 1.695
41 HD2 ASP 5 HD2 ASP 5 23.538 6.345 0.593
42 H ILE 6 H ILE 6 20.961 5.296 0.783
43 HA ILE 6 HA ILE 6 19.716 5.044 -1.891
44 HB ILE 6 HB ILE 6 21.188 2.969 -0.148
45 1HG1 ILE 6 1HG1 ILE 6 22.133 5.471 -1.222
46 2HG1 ILE 6 2HG1 ILE 6 23.053 4.222 -0.348
47 1HG2 ILE 6 1HG2 ILE 6 20.930 3.263 -3.174
48 2HG2 ILE 6 2HG2 ILE 6 21.856 2.002 -2.327
49 3HG2 ILE 6 3HG2 ILE 6 20.084 2.059 -2.173
50 1HD1 ILE 6 1HD1 ILE 6 22.449 4.220 -3.340
51 2HD1 ILE 6 2HD1 ILE 6 24.016 4.626 -2.599
52 3HD1 ILE 6 3HD1 ILE 6 23.369 2.973 -2.466
53 H ILE 7 H ILE 7 19.331 3.713 1.396
54 HA ILE 7 HA ILE 7 17.347 1.730 0.749
55 HB ILE 7 HB ILE 7 17.753 3.551 3.203
56 1HG1 ILE 7 1HG1 ILE 7 18.687 0.693 2.699
57 2HG1 ILE 7 2HG1 ILE 7 19.711 2.129 2.455
58 1HG2 ILE 7 1HG2 ILE 7 16.286 0.891 2.977
59 2HG2 ILE 7 2HG2 ILE 7 16.588 1.794 4.480
60 3HG2 ILE 7 3HG2 ILE 7 15.522 2.479 3.229
61 1HD1 ILE 7 1HD1 ILE 7 18.357 1.330 5.071
62 2HD1 ILE 7 2HD1 ILE 7 20.086 1.137 4.698
63 3HD1 ILE 7 3HD1 ILE 7 19.380 2.766 4.828
64 H ARG 8 H ARG 8 16.984 5.213 1.654
65 HA ARG 8 HA ARG 8 14.077 5.113 1.384
66 1HB ARG 8 1HB ARG 8 14.381 7.666 1.229
67 2HB ARG 8 2HB ARG 8 15.204 6.935 2.613
68 1HG ARG 8 1HG ARG 8 16.996 8.121 1.837
69 2HG ARG 8 2HG ARG 8 17.177 6.758 0.720
70 1HD ARG 8 1HD ARG 8 17.248 8.953 -0.368
71 2HD ARG 8 2HD ARG 8 15.911 7.873 -0.961
72 HE ARG 8 HE ARG 8 14.273 9.249 0.341
73 1HH1 ARG 8 1HH2 ARG 8 16.105 10.093 2.592
74 2HH1 ARG 8 2HH2 ARG 8 16.397 11.815 2.230
75 1HH2 ARG 8 2HH1 ARG 8 15.335 11.528 -1.143
76 2HH2 ARG 8 1HH1 ARG 8 15.961 12.628 0.112
77 H ALA 9 H ALA 9 16.772 5.688 -0.884
78 HA ALA 9 HA ALA 9 15.092 6.608 -3.067
79 1HB ALA 9 1HB ALA 9 17.704 4.974 -3.033
80 2HB ALA 9 2HB ALA 9 17.104 5.890 -4.436
81 3HB ALA 9 3HB ALA 9 17.610 6.749 -2.961
82 H ILE 10 H ILE 10 16.322 3.366 -2.147
83 HA ILE 10 HA ILE 10 14.874 2.050 -4.314
84 HB ILE 10 HB ILE 10 15.776 0.968 -1.579
85 1HG1 ILE 10 1HG1 ILE 10 17.335 2.203 -3.613
86 2HG1 ILE 10 2HG1 ILE 10 17.923 1.271 -2.215
87 1HG2 ILE 10 1HG2 ILE 10 15.467 -0.378 -4.300
88 2HG2 ILE 10 2HG2 ILE 10 16.053 -1.161 -2.813
89 3HG2 ILE 10 3HG2 ILE 10 14.373 -0.583 -2.911
90 1HD1 ILE 10 1HD1 ILE 10 17.106 0.103 -4.914
91 2HD1 ILE 10 2HD1 ILE 10 18.777 0.318 -4.340
92 3HD1 ILE 10 3HD1 ILE 10 17.693 -0.828 -3.515
93 H ARG 11 H ARG 11 14.102 3.014 -0.990
94 HA ARG 11 HA ARG 11 11.694 1.433 -0.718
95 1HB ARG 11 1HB ARG 11 12.787 2.695 1.135
96 2HB ARG 11 2HB ARG 11 12.497 4.231 0.291
97 1HG ARG 11 1HG ARG 11 10.835 3.803 2.116
98 2HG ARG 11 2HG ARG 11 10.070 3.941 0.519
99 1HD ARG 11 1HD ARG 11 9.306 2.065 2.010
100 2HD ARG 11 2HD ARG 11 9.800 1.645 0.308
101 HE ARG 11 HE ARG 11 11.834 0.559 1.189
102 1HH1 ARG 11 1HH2 ARG 11 9.820 -0.163 3.466
103 2HH1 ARG 11 2HH2 ARG 11 10.774 0.276 4.908
104 1HH2 ARG 11 2HH1 ARG 11 13.088 2.236 3.066
105 2HH2 ARG 11 1HH1 ARG 11 12.626 1.635 4.682
106 H ARG 12 H ARG 12 12.337 4.570 -2.301
107 HA ARG 12 HA ARG 12 9.414 4.925 -2.877
108 1HB ARG 12 1HB ARG 12 11.898 6.461 -2.897
109 2HB ARG 12 2HB ARG 12 11.104 6.620 -4.474
110 1HG ARG 12 1HG ARG 12 9.937 7.275 -1.733
111 2HG ARG 12 2HG ARG 12 10.207 8.380 -3.088
112 1HD ARG 12 1HD ARG 12 8.247 6.095 -2.929
113 2HD ARG 12 2HD ARG 12 7.896 7.874 -2.968
114 HE ARG 12 HE ARG 12 9.390 6.540 -5.293
115 1HH1 ARG 12 2HH1 ARG 12 8.576 9.523 -5.185
116 2HH1 ARG 12 1HH1 ARG 12 7.118 9.527 -6.214
117 1HH2 ARG 12 1HH2 ARG 12 6.692 6.008 -6.019
118 2HH2 ARG 12 2HH2 ARG 12 6.050 7.533 -6.686
119 H ILE 13 H ILE 13 12.350 3.867 -4.641
120 HA ILE 13 HA ILE 13 10.829 3.769 -7.185
121 HB ILE 13 HB ILE 13 13.382 4.073 -6.794
122 1HG1 ILE 13 1HG1 ILE 13 13.987 2.706 -8.783
123 2HG1 ILE 13 2HG1 ILE 13 12.426 1.860 -8.660
124 1HG2 ILE 13 1HG2 ILE 13 13.187 1.064 -6.384
125 2HG2 ILE 13 2HG2 ILE 13 14.689 2.007 -6.543
126 3HG2 ILE 13 3HG2 ILE 13 13.625 2.256 -5.138
127 1HD1 ILE 13 1HD1 ILE 13 12.798 4.861 -9.059
128 2HD1 ILE 13 2HD1 ILE 13 12.313 3.697 -10.316
129 3HD1 ILE 13 3HD1 ILE 13 11.236 4.016 -8.936
130 H ALA 14 H ALA 14 11.542 1.549 -4.515
131 HA ALA 14 HA ALA 14 10.449 -0.771 -6.090
132 1HB ALA 14 1HB ALA 14 11.280 -0.407 -3.158
133 2HB ALA 14 2HB ALA 14 10.948 -1.967 -3.948
134 3HB ALA 14 3HB ALA 14 12.348 -0.992 -4.456
135 H VAL 15 H VAL 15 9.021 1.846 -4.516
136 HA VAL 15 HA VAL 15 7.032 0.761 -2.818
137 HB VAL 15 HB VAL 15 6.950 2.869 -5.026
138 1HG1 VAL 15 1HG1 VAL 15 4.811 2.261 -2.942
139 2HG1 VAL 15 2HG1 VAL 15 4.822 3.654 -4.050
140 3HG1 VAL 15 3HG1 VAL 15 4.654 2.004 -4.695
141 1HG2 VAL 15 1HG2 VAL 15 8.377 3.296 -3.040
142 2HG2 VAL 15 2HG2 VAL 15 6.984 4.402 -3.082
143 3HG2 VAL 15 3HG2 VAL 15 6.979 3.007 -1.978
144 HA PRO 16 HA PRO 16 4.309 -0.707 -6.402
145 1HB PRO 16 1HB PRO 16 5.357 -0.851 -8.892
146 2HB PRO 16 2HB PRO 16 4.494 0.617 -8.244
147 1HG PRO 16 1HG PRO 16 7.427 0.084 -8.617
148 2HG PRO 16 2HG PRO 16 6.507 1.617 -8.850
149 1HD PRO 16 1HD PRO 16 8.001 0.962 -6.488
150 2HD PRO 16 2HD PRO 16 6.594 2.132 -6.512
151 H VAL 17 H VAL 17 7.788 -1.400 -6.858
152 HA VAL 17 HA VAL 17 7.350 -4.114 -7.768
153 HB VAL 17 HB VAL 17 9.635 -3.040 -6.006
154 1HG1 VAL 17 1HG1 VAL 17 9.580 -5.079 -8.276
155 2HG1 VAL 17 2HG1 VAL 17 11.022 -4.579 -7.362
156 3HG1 VAL 17 3HG1 VAL 17 9.712 -5.460 -6.542
157 1HG2 VAL 17 1HG2 VAL 17 9.119 -1.416 -7.817
158 2HG2 VAL 17 2HG2 VAL 17 10.678 -2.226 -8.106
159 3HG2 VAL 17 3HG2 VAL 17 9.233 -2.724 -9.018
160 H VAL 18 H VAL 18 7.702 -2.641 -4.540
161 HA VAL 18 HA VAL 18 7.686 -5.066 -3.010
162 HB VAL 18 HB VAL 18 6.551 -2.240 -2.541
163 1HG1 VAL 18 1HG1 VAL 18 7.175 -4.415 -0.505
164 2HG1 VAL 18 2HG1 VAL 18 6.683 -2.746 -0.134
165 3HG1 VAL 18 3HG1 VAL 18 5.549 -3.846 -0.952
166 1HG2 VAL 18 1HG2 VAL 18 8.981 -2.362 -3.025
167 2HG2 VAL 18 2HG2 VAL 18 8.684 -1.890 -1.336
168 3HG2 VAL 18 3HG2 VAL 18 9.179 -3.555 -1.720
169 H SER 19 H SER 19 4.967 -3.053 -4.236
170 HA SER 19 HA SER 19 2.857 -4.550 -3.018
171 1HB SER 19 1HB SER 19 2.558 -3.728 -5.882
172 2HB SER 19 2HB SER 19 1.627 -3.191 -4.453
173 HG SER 19 HG SER 19 4.110 -2.198 -5.541
174 H THR 20 H THR 20 4.475 -5.108 -6.191
175 HA THR 20 HA THR 20 2.950 -7.550 -6.734
176 HB THR 20 HB THR 20 5.753 -7.236 -7.748
177 HG1 THR 20 HG1 THR 20 5.260 -5.263 -8.884
178 1HG2 THR 20 1HG2 THR 20 3.019 -7.279 -9.104
179 2HG2 THR 20 2HG2 THR 20 4.592 -7.394 -9.930
180 3HG2 THR 20 3HG2 THR 20 4.065 -8.693 -8.833
181 H LEU 21 H LEU 21 5.995 -6.910 -4.985
182 HA LEU 21 HA LEU 21 6.583 -9.821 -4.751
183 1HB LEU 21 1HB LEU 21 7.579 -7.312 -3.278
184 2HB LEU 21 2HB LEU 21 8.348 -8.910 -3.175
185 HG LEU 21 HG LEU 21 7.932 -7.416 -5.799
186 1HD1 LEU 21 1HD1 LEU 21 10.410 -7.590 -4.027
187 2HD1 LEU 21 2HD1 LEU 21 10.338 -6.853 -5.644
188 3HD1 LEU 21 3HD1 LEU 21 9.428 -6.131 -4.297
189 1HD2 LEU 21 1HD2 LEU 21 8.197 -9.879 -5.958
190 2HD2 LEU 21 2HD2 LEU 21 9.622 -9.036 -6.612
191 3HD2 LEU 21 3HD2 LEU 21 9.691 -9.779 -4.996
192 H PHE 22 H PHE 22 4.676 -7.467 -2.979
193 HA PHE 22 HA PHE 22 4.551 -9.379 -0.638
194 1HB PHE 22 1HB PHE 22 3.905 -6.479 -1.246
195 2HB PHE 22 2HB PHE 22 2.991 -7.264 0.061
196 HD1 PHE 22 HD1 PHE 22 6.565 -7.554 -1.101
197 HD2 PHE 22 HD2 PHE 22 3.856 -6.615 2.123
198 HE1 PHE 22 HE1 PHE 22 8.498 -7.250 0.436
199 HE2 PHE 22 HE2 PHE 22 5.792 -6.311 3.658
200 HZ PHE 22 HZ PHE 22 8.112 -6.628 2.815
201 HA PRO 23 HA PRO 23 0.855 -10.928 -2.698
202 1HB PRO 23 1HB PRO 23 0.448 -12.839 -0.868
203 2HB PRO 23 2HB PRO 23 1.578 -12.979 -2.297
204 1HG PRO 23 1HG PRO 23 2.136 -12.380 0.592
205 2HG PRO 23 2HG PRO 23 3.021 -13.497 -0.538
206 1HD PRO 23 1HD PRO 23 3.996 -10.954 -0.020
207 2HD PRO 23 2HD PRO 23 4.140 -11.683 -1.616
208 HA PRO 24 HA PRO 24 -1.692 -9.814 1.012
209 1HB PRO 24 1HB PRO 24 -0.581 -8.438 3.073
210 2HB PRO 24 2HB PRO 24 -0.649 -10.252 3.003
211 1HG PRO 24 1HG PRO 24 1.662 -8.408 2.704
212 2HG PRO 24 2HG PRO 24 1.640 -10.145 3.146
213 1HD PRO 24 1HD PRO 24 2.139 -8.974 0.486
214 2HD PRO 24 2HD PRO 24 2.064 -10.744 0.924
215 H ALA 25 H ALA 25 0.459 -7.913 -0.702
216 HA ALA 25 HA ALA 25 -1.318 -5.479 -0.177
217 1HB ALA 25 1HB ALA 25 1.699 -5.631 -0.730
218 2HB ALA 25 2HB ALA 25 0.771 -4.129 -0.507
219 3HB ALA 25 3HB ALA 25 0.968 -5.263 0.849
220 H ALA 26 H ALA 26 -1.101 -7.769 -2.314
221 HA ALA 26 HA ALA 26 -1.153 -5.766 -4.606
222 1HB ALA 26 1HB ALA 26 0.032 -8.588 -4.565
223 2HB ALA 26 2HB ALA 26 -0.055 -7.533 -5.996
224 3HB ALA 26 3HB ALA 26 0.964 -7.072 -4.611
225 HA PRO 27 HA PRO 27 -4.148 -9.156 -5.877
226 1HB PRO 27 1HB PRO 27 -4.376 -11.395 -4.366
227 2HB PRO 27 2HB PRO 27 -3.260 -11.228 -5.802
228 1HG PRO 27 1HG PRO 27 -2.696 -11.061 -2.853
229 2HG PRO 27 2HG PRO 27 -1.728 -11.864 -4.156
230 1HD PRO 27 1HD PRO 27 -1.062 -9.354 -3.164
231 2HD PRO 27 2HD PRO 27 -0.752 -9.825 -4.834
232 H LEU 28 H LEU 28 -3.525 -8.680 -2.430
233 HA LEU 28 HA LEU 28 -6.303 -9.078 -1.628
234 1HB LEU 28 1HB LEU 28 -3.879 -7.574 -0.533
235 2HB LEU 28 2HB LEU 28 -5.439 -7.505 0.314
236 HG LEU 28 HG LEU 28 -3.711 -9.942 -0.249
237 1HD1 LEU 28 1HD1 LEU 28 -4.982 -8.787 2.273
238 2HD1 LEU 28 2HD1 LEU 28 -3.956 -10.237 2.199
239 3HD1 LEU 28 3HD1 LEU 28 -3.269 -8.642 1.816
240 1HD2 LEU 28 1HD2 LEU 28 -6.057 -10.485 -0.857
241 2HD2 LEU 28 2HD2 LEU 28 -5.575 -11.311 0.644
242 3HD2 LEU 28 3HD2 LEU 28 -6.607 -9.863 0.718
243 H ALA 29 H ALA 29 -4.436 -6.299 -2.888
244 HA ALA 29 HA ALA 29 -6.422 -4.315 -2.396
245 1HB ALA 29 1HB ALA 29 -4.607 -4.762 -4.857
246 2HB ALA 29 2HB ALA 29 -5.343 -3.198 -4.431
247 3HB ALA 29 3HB ALA 29 -4.117 -3.925 -3.364
248 H HIS 30 H HIS 30 -6.124 -6.874 -4.791
249 HA HIS 30 HA HIS 30 -8.317 -6.047 -6.509
250 1HB HIS 30 1HB HIS 30 -6.368 -7.967 -6.508
251 2HB HIS 30 2HB HIS 30 -7.703 -8.956 -5.862
252 HD1 HIS 30 HD1 HIS 30 -6.307 -9.121 -8.839
253 HD2 HIS 30 HD2 HIS 30 -10.054 -7.459 -7.817
254 HE1 HIS 30 HE1 HIS 30 -7.750 -9.125 -10.962
255 H ALA 31 H ALA 31 -8.102 -8.120 -3.613
256 HA ALA 31 HA ALA 31 -10.899 -8.942 -3.638
257 1HB ALA 31 1HB ALA 31 -8.913 -8.479 -1.343
258 2HB ALA 31 2HB ALA 31 -10.386 -9.473 -1.236
259 3HB ALA 31 3HB ALA 31 -9.046 -9.977 -2.295
260 H ILE 32 H ILE 32 -9.297 -5.962 -2.607
261 HA ILE 32 HA ILE 32 -11.280 -4.969 -0.810
262 HB ILE 32 HB ILE 32 -9.764 -3.511 -3.056
263 1HG1 ILE 32 1HG1 ILE 32 -8.696 -5.022 -1.000
264 2HG1 ILE 32 2HG1 ILE 32 -7.870 -3.661 -1.801
265 1HG2 ILE 32 1HG2 ILE 32 -10.877 -2.487 -0.408
266 2HG2 ILE 32 2HG2 ILE 32 -9.923 -1.538 -1.573
267 3HG2 ILE 32 3HG2 ILE 32 -11.541 -2.130 -2.021
268 1HD1 ILE 32 1HD1 ILE 32 -9.633 -3.459 0.685
269 2HD1 ILE 32 2HD1 ILE 32 -7.855 -3.383 0.668
270 3HD1 ILE 32 3HD1 ILE 32 -8.808 -2.100 -0.115
271 H GLY 33 H GLY 33 -11.339 -5.212 -4.365
272 1HA GLY 33 1HA GLY 33 -14.216 -4.269 -4.178
273 2HA GLY 33 2HA GLY 33 -13.162 -3.924 -5.583
274 H GLU 34 H GLU 34 -12.954 -6.979 -3.868
275 HA GLU 34 HA GLU 34 -13.114 -9.181 -4.863
276 1HB GLU 34 1HB GLU 34 -15.816 -7.790 -5.042
277 2HB GLU 34 2HB GLU 34 -15.625 -9.515 -5.452
278 1HG GLU 34 1HG GLU 34 -14.580 -8.384 -2.840
279 2HG GLU 34 2HG GLU 34 -16.275 -8.918 -3.007
280 HE2 GLU 34 HE2 GLU 34 -15.224 -12.250 -2.813
281 H GLY 35 H GLY 35 -11.888 -7.468 -6.743
282 1HA GLY 35 1HA GLY 35 -13.291 -7.499 -9.262
283 2HA GLY 35 2HA GLY 35 -11.510 -7.439 -9.060
284 H VAL 36 H VAL 36 -10.944 -9.808 -7.791
285 HA VAL 36 HA VAL 36 -11.055 -11.711 -9.966
286 HB VAL 36 HB VAL 36 -10.308 -13.295 -8.085
287 1HG1 VAL 36 1HG1 VAL 36 -8.996 -10.539 -8.175
288 2HG1 VAL 36 2HG1 VAL 36 -8.222 -12.038 -7.608
289 3HG1 VAL 36 3HG1 VAL 36 -8.692 -11.871 -9.316
290 1HG2 VAL 36 1HG2 VAL 36 -11.674 -12.305 -6.275
291 2HG2 VAL 36 2HG2 VAL 36 -9.947 -12.307 -5.847
292 3HG2 VAL 36 3HG2 VAL 36 -10.730 -10.801 -6.381
293 H ASP 37 H ASP 37 -13.061 -11.368 -7.003
294 HA ASP 37 HA ASP 37 -14.641 -13.749 -7.539
295 1HB ASP 37 1HB ASP 37 -14.491 -12.315 -5.420
296 2HB ASP 37 2HB ASP 37 -15.542 -11.129 -6.255
297 HD2 ASP 37 HD2 ASP 37 -17.392 -14.626 -5.809
298 H TYR 38 H TYR 38 -14.913 -10.349 -8.566
299 HA TYR 38 HA TYR 38 -17.510 -10.500 -9.737
300 1HB TYR 38 1HB TYR 38 -16.113 -8.438 -9.560
301 2HB TYR 38 2HB TYR 38 -14.925 -9.129 -10.692
302 HD1 TYR 38 HD1 TYR 38 -18.396 -7.825 -10.356
303 HD2 TYR 38 HD2 TYR 38 -15.307 -9.139 -13.065
304 HE1 TYR 38 HE1 TYR 38 -19.699 -6.931 -12.278
305 HE2 TYR 38 HE2 TYR 38 -16.609 -8.244 -14.987
306 HH TYR 38 HH TYR 38 -18.848 -7.660 -15.628
307 H LEU 39 H LEU 39 -14.316 -11.419 -11.087
308 HA LEU 39 HA LEU 39 -15.499 -12.320 -13.626
309 1HB LEU 39 1HB LEU 39 -12.869 -12.639 -12.108
310 2HB LEU 39 2HB LEU 39 -13.136 -13.566 -13.604
311 HG LEU 39 HG LEU 39 -13.963 -10.993 -14.299
312 1HD1 LEU 39 1HD1 LEU 39 -11.446 -10.832 -12.583
313 2HD1 LEU 39 2HD1 LEU 39 -12.104 -9.521 -13.591
314 3HD1 LEU 39 3HD1 LEU 39 -13.022 -10.108 -12.184
315 1HD2 LEU 39 1HD2 LEU 39 -12.616 -12.567 -15.662
316 2HD2 LEU 39 2HD2 LEU 39 -11.866 -10.955 -15.617
317 3HD2 LEU 39 3HD2 LEU 39 -11.209 -12.270 -14.614
318 H LEU 40 H LEU 40 -14.651 -13.843 -10.519
319 HA LEU 40 HA LEU 40 -15.216 -16.571 -11.455
320 1HB LEU 40 1HB LEU 40 -14.655 -15.056 -8.939
321 2HB LEU 40 2HB LEU 40 -15.677 -16.490 -8.689
322 HG LEU 40 HG LEU 40 -14.001 -17.899 -9.845
323 1HD1 LEU 40 1HD1 LEU 40 -12.397 -15.310 -10.017
324 2HD1 LEU 40 2HD1 LEU 40 -11.814 -16.928 -10.478
325 3HD1 LEU 40 3HD1 LEU 40 -13.138 -16.165 -11.391
326 1HD2 LEU 40 1HD2 LEU 40 -13.808 -17.547 -7.396
327 2HD2 LEU 40 2HD2 LEU 40 -12.205 -17.731 -8.145
328 3HD2 LEU 40 3HD2 LEU 40 -12.790 -16.115 -7.683
329 H GLY 41 H GLY 41 -17.209 -13.866 -10.524
330 1HA GLY 41 1HA GLY 41 -19.556 -13.738 -10.527
331 2HA GLY 41 2HA GLY 41 -19.600 -15.390 -11.225
332 H ASP 42 H ASP 42 -18.389 -13.969 -8.149
333 HA ASP 42 HA ASP 42 -18.634 -14.803 -5.933
334 1HB ASP 42 1HB ASP 42 -21.148 -14.234 -7.134
335 2HB ASP 42 2HB ASP 42 -21.381 -15.779 -6.284
336 HD2 ASP 42 HD2 ASP 42 -20.022 -13.566 -3.448
337 H GLU 43 H GLU 43 -17.520 -16.637 -7.782
338 HA GLU 43 HA GLU 43 -17.153 -18.983 -8.048
339 1HB GLU 43 1HB GLU 43 -18.244 -19.168 -5.212
340 2HB GLU 43 2HB GLU 43 -16.845 -20.014 -5.917
341 1HG GLU 43 1HG GLU 43 -16.179 -17.336 -6.240
342 2HG GLU 43 2HG GLU 43 -17.003 -17.355 -4.657
343 HE2 GLU 43 HE2 GLU 43 -14.460 -19.926 -3.767
344 H ALA 44 H ALA 44 -19.854 -17.996 -8.794
345 HA ALA 44 HA ALA 44 -21.739 -20.065 -7.839
346 1HB ALA 44 1HB ALA 44 -21.726 -18.197 -10.286
347 2HB ALA 44 2HB ALA 44 -23.159 -19.053 -9.670
348 3HB ALA 44 3HB ALA 44 -22.391 -17.781 -8.689
349 H GLN 45 H GLN 45 -19.957 -21.778 -8.343
350 HA GLN 45 HA GLN 45 -20.083 -22.526 -11.270
351 1HB GLN 45 1HB GLN 45 -18.511 -23.727 -8.914
352 2HB GLN 45 2HB GLN 45 -18.185 -23.999 -10.641
353 1HG GLN 45 1HG GLN 45 -18.238 -21.168 -10.185
354 2HG GLN 45 2HG GLN 45 -17.190 -21.911 -8.945
355 1HE2 GLN 45 2HE2 GLN 45 -17.867 -22.725 -12.437
356 2HE2 GLN 45 1HE2 GLN 45 -16.144 -22.737 -12.903
357 H ALA 46 H ALA 46 -20.244 -24.993 -11.622
358 HA ALA 46 HA ALA 46 -21.848 -26.350 -9.562
359 1HB ALA 46 1HB ALA 46 -23.825 -26.629 -11.161
360 2HB ALA 46 2HB ALA 46 -23.517 -24.924 -10.756
361 3HB ALA 46 3HB ALA 46 -22.978 -25.578 -12.320
Start of MODEL 12
1 1H PHE 1 1H PHE 1 22.646 12.726 1.574
2 2H PHE 1 2H PHE 1 21.370 11.632 1.635
3 3H PHE 1 3H PHE 1 21.442 12.903 2.735
4 HA PHE 1 HA PHE 1 23.469 11.941 3.751
5 1HB PHE 1 2HB PHE 1 20.748 11.011 3.789
6 2HB PHE 1 1HB PHE 1 21.798 9.581 3.856
7 HD1 PHE 1 HD1 PHE 1 24.192 10.791 5.245
8 HD2 PHE 1 HD2 PHE 1 19.962 11.154 6.013
9 HE1 PHE 1 HE1 PHE 1 24.665 11.273 7.641
10 HE2 PHE 1 HE2 PHE 1 20.440 11.635 8.408
11 HZ PHE 1 HZ PHE 1 22.791 11.695 9.221
12 H GLY 2 H GLY 2 23.929 9.233 3.981
13 1HA GLY 2 1HA GLY 2 25.100 8.704 1.249
14 2HA GLY 2 2HA GLY 2 25.711 8.037 2.795
15 H PHE 3 H PHE 3 25.107 5.962 3.268
16 HA PHE 3 HA PHE 3 23.498 4.347 1.534
17 1HB PHE 3 1HB PHE 3 24.325 4.312 4.452
18 2HB PHE 3 2HB PHE 3 23.139 3.105 3.906
19 HD1 PHE 3 HD1 PHE 3 23.723 1.611 1.938
20 HD2 PHE 3 HD2 PHE 3 26.633 4.095 3.929
21 HE1 PHE 3 HE1 PHE 3 25.559 0.242 0.961
22 HE2 PHE 3 HE2 PHE 3 28.468 2.726 2.952
23 HZ PHE 3 HZ PHE 3 27.933 0.802 1.466
24 H LYS 4 H LYS 4 22.469 6.271 4.386
25 HA LYS 4 HA LYS 4 19.762 5.334 4.517
26 1HB LYS 4 1HB LYS 4 21.001 8.124 4.866
27 2HB LYS 4 2HB LYS 4 19.361 7.708 5.409
28 1HG LYS 4 1HG LYS 4 20.146 6.655 7.261
29 2HG LYS 4 2HG LYS 4 21.358 5.753 6.325
30 1HD LYS 4 1HD LYS 4 23.007 7.180 6.956
31 2HD LYS 4 2HD LYS 4 22.049 8.593 6.472
32 1HE LYS 4 1HE LYS 4 22.702 8.430 8.899
33 2HE LYS 4 2HE LYS 4 20.944 8.702 8.527
34 1HZ LYS 4 1HZ LYS 4 22.225 6.042 9.073
35 2HZ LYS 4 2HZ LYS 4 21.247 6.850 10.177
36 3HZ LYS 4 3HZ LYS 4 20.597 6.295 8.728
37 H ASP 5 H ASP 5 21.242 7.687 2.278
38 HA ASP 5 HA ASP 5 18.665 8.450 1.115
39 1HB ASP 5 1HB ASP 5 21.625 8.673 0.500
40 2HB ASP 5 2HB ASP 5 20.524 8.925 -0.870
41 HD2 ASP 5 HD2 ASP 5 20.464 12.192 0.472
42 H ILE 6 H ILE 6 21.214 6.080 0.308
43 HA ILE 6 HA ILE 6 19.977 5.140 -2.110
44 HB ILE 6 HB ILE 6 21.550 3.532 -0.002
45 1HG1 ILE 6 1HG1 ILE 6 22.307 5.833 -1.706
46 2HG1 ILE 6 2HG1 ILE 6 23.124 5.159 -0.273
47 1HG2 ILE 6 1HG2 ILE 6 21.423 3.316 -3.040
48 2HG2 ILE 6 2HG2 ILE 6 22.425 2.313 -1.965
49 3HG2 ILE 6 3HG2 ILE 6 20.651 2.202 -1.888
50 1HD1 ILE 6 1HD1 ILE 6 23.208 3.981 -3.090
51 2HD1 ILE 6 2HD1 ILE 6 24.524 4.889 -2.306
52 3HD1 ILE 6 3HD1 ILE 6 24.024 3.308 -1.658
53 H ILE 7 H ILE 7 19.687 4.063 1.315
54 HA ILE 7 HA ILE 7 17.769 1.989 0.800
55 HB ILE 7 HB ILE 7 18.060 3.942 3.176
56 1HG1 ILE 7 1HG1 ILE 7 19.441 1.351 2.411
57 2HG1 ILE 7 2HG1 ILE 7 20.177 2.916 2.847
58 1HG2 ILE 7 1HG2 ILE 7 16.873 1.138 3.070
59 2HG2 ILE 7 2HG2 ILE 7 17.086 2.127 4.534
60 3HG2 ILE 7 3HG2 ILE 7 15.952 2.648 3.265
61 1HD1 ILE 7 1HD1 ILE 7 18.573 1.118 4.721
62 2HD1 ILE 7 2HD1 ILE 7 20.344 1.298 4.725
63 3HD1 ILE 7 3HD1 ILE 7 19.307 2.679 5.156
64 H ARG 8 H ARG 8 17.430 5.503 1.345
65 HA ARG 8 HA ARG 8 14.549 5.527 1.381
66 1HB ARG 8 1HB ARG 8 16.732 7.339 1.449
67 2HB ARG 8 2HB ARG 8 15.866 7.798 -0.033
68 1HG ARG 8 1HG ARG 8 14.037 8.566 1.118
69 2HG ARG 8 2HG ARG 8 14.152 7.293 2.354
70 1HD ARG 8 1HD ARG 8 16.198 9.467 2.140
71 2HD ARG 8 2HD ARG 8 14.620 9.711 3.018
72 HE ARG 8 HE ARG 8 16.663 7.501 3.705
73 1HH1 ARG 8 2HH1 ARG 8 16.567 9.891 5.547
74 2HH1 ARG 8 1HH1 ARG 8 15.395 9.380 6.792
75 1HH2 ARG 8 1HH2 ARG 8 14.034 6.790 4.786
76 2HH2 ARG 8 2HH2 ARG 8 13.961 7.624 6.361
77 H ALA 9 H ALA 9 16.907 5.894 -1.308
78 HA ALA 9 HA ALA 9 14.918 6.156 -3.392
79 1HB ALA 9 1HB ALA 9 17.698 4.829 -3.385
80 2HB ALA 9 2HB ALA 9 16.852 5.402 -4.841
81 3HB ALA 9 3HB ALA 9 17.398 6.568 -3.613
82 H ILE 10 H ILE 10 16.529 3.290 -1.982
83 HA ILE 10 HA ILE 10 15.231 1.391 -3.757
84 HB ILE 10 HB ILE 10 16.204 1.150 -0.843
85 1HG1 ILE 10 1HG1 ILE 10 17.635 1.798 -3.195
86 2HG1 ILE 10 2HG1 ILE 10 18.317 1.266 -1.639
87 1HG2 ILE 10 1HG2 ILE 10 15.858 -0.974 -3.003
88 2HG2 ILE 10 2HG2 ILE 10 16.537 -1.238 -1.379
89 3HG2 ILE 10 3HG2 ILE 10 14.828 -0.779 -1.565
90 1HD1 ILE 10 1HD1 ILE 10 17.405 -0.569 -3.904
91 2HD1 ILE 10 2HD1 ILE 10 19.094 -0.187 -3.497
92 3HD1 ILE 10 3HD1 ILE 10 18.087 -1.101 -2.350
93 H ARG 11 H ARG 11 14.309 2.760 -0.572
94 HA ARG 11 HA ARG 11 11.958 1.089 -0.275
95 1HB ARG 11 1HB ARG 11 13.289 3.227 1.050
96 2HB ARG 11 2HB ARG 11 11.650 3.845 0.720
97 1HG ARG 11 1HG ARG 11 12.301 1.192 2.088
98 2HG ARG 11 2HG ARG 11 11.753 2.669 2.914
99 1HD ARG 11 1HD ARG 11 10.074 2.023 0.659
100 2HD ARG 11 2HD ARG 11 10.192 0.645 1.844
101 HE ARG 11 HE ARG 11 9.452 3.526 2.661
102 1HH1 ARG 11 1HH2 ARG 11 10.310 1.284 4.675
103 2HH1 ARG 11 2HH2 ARG 11 8.717 0.745 5.268
104 1HH2 ARG 11 2HH1 ARG 11 6.949 2.258 2.589
105 2HH2 ARG 11 1HH1 ARG 11 6.811 1.298 4.085
106 H ARG 12 H ARG 12 12.498 4.251 -1.851
107 HA ARG 12 HA ARG 12 9.656 4.571 -2.558
108 1HB ARG 12 1HB ARG 12 12.268 5.697 -3.728
109 2HB ARG 12 2HB ARG 12 10.651 6.365 -4.039
110 1HG ARG 12 1HG ARG 12 10.381 7.062 -1.781
111 2HG ARG 12 2HG ARG 12 11.722 6.036 -1.217
112 1HD ARG 12 1HD ARG 12 11.988 8.625 -1.596
113 2HD ARG 12 2HD ARG 12 13.319 7.434 -1.958
114 HE ARG 12 HE ARG 12 12.752 7.590 -4.393
115 1HH1 ARG 12 2HH1 ARG 12 9.772 8.090 -4.075
116 2HH1 ARG 12 1HH1 ARG 12 9.619 9.802 -4.550
117 1HH2 ARG 12 1HH2 ARG 12 13.080 10.465 -4.144
118 2HH2 ARG 12 2HH2 ARG 12 11.493 11.147 -4.589
119 H ILE 13 H ILE 13 12.544 3.314 -4.296
120 HA ILE 13 HA ILE 13 10.984 2.832 -6.749
121 HB ILE 13 HB ILE 13 13.567 3.102 -6.342
122 1HG1 ILE 13 1HG1 ILE 13 12.086 1.894 -8.365
123 2HG1 ILE 13 2HG1 ILE 13 13.810 2.333 -8.450
124 1HG2 ILE 13 1HG2 ILE 13 13.220 0.144 -5.719
125 2HG2 ILE 13 2HG2 ILE 13 14.768 0.992 -5.940
126 3HG2 ILE 13 3HG2 ILE 13 13.722 1.397 -4.559
127 1HD1 ILE 13 1HD1 ILE 13 12.701 -0.340 -7.479
128 2HD1 ILE 13 2HD1 ILE 13 13.467 -0.048 -9.059
129 3HD1 ILE 13 3HD1 ILE 13 14.423 0.100 -7.565
130 H ALA 14 H ALA 14 11.475 1.084 -3.730
131 HA ALA 14 HA ALA 14 10.592 -1.512 -4.918
132 1HB ALA 14 1HB ALA 14 10.834 -0.493 -2.032
133 2HB ALA 14 2HB ALA 14 10.641 -2.197 -2.509
134 3HB ALA 14 3HB ALA 14 12.127 -1.317 -2.937
135 H VAL 15 H VAL 15 9.028 1.337 -3.589
136 HA VAL 15 HA VAL 15 6.646 0.297 -2.469
137 HB VAL 15 HB VAL 15 6.982 2.537 -4.526
138 1HG1 VAL 15 1HG1 VAL 15 4.859 2.076 -2.388
139 2HG1 VAL 15 2HG1 VAL 15 4.988 3.508 -3.438
140 3HG1 VAL 15 3HG1 VAL 15 4.615 1.918 -4.144
141 1HG2 VAL 15 1HG2 VAL 15 8.513 2.714 -2.574
142 2HG2 VAL 15 2HG2 VAL 15 7.254 3.970 -2.520
143 3HG2 VAL 15 3HG2 VAL 15 7.125 2.535 -1.475
144 HA PRO 16 HA PRO 16 4.644 -0.558 -6.682
145 1HB PRO 16 1HB PRO 16 6.256 -0.780 -8.848
146 2HB PRO 16 2HB PRO 16 5.416 0.761 -8.351
147 1HG PRO 16 1HG PRO 16 8.268 -0.120 -7.980
148 2HG PRO 16 2HG PRO 16 7.627 1.513 -8.420
149 1HD PRO 16 1HD PRO 16 8.417 0.870 -5.829
150 2HD PRO 16 2HD PRO 16 7.153 2.048 -6.179
151 H VAL 17 H VAL 17 8.037 -1.675 -6.431
152 HA VAL 17 HA VAL 17 7.503 -4.323 -7.486
153 HB VAL 17 HB VAL 17 9.474 -3.481 -5.270
154 1HG1 VAL 17 1HG1 VAL 17 9.680 -5.540 -7.510
155 2HG1 VAL 17 2HG1 VAL 17 10.942 -5.176 -6.310
156 3HG1 VAL 17 3HG1 VAL 17 9.403 -5.902 -5.789
157 1HG2 VAL 17 1HG2 VAL 17 9.518 -1.839 -7.129
158 2HG2 VAL 17 2HG2 VAL 17 11.009 -2.811 -7.095
159 3HG2 VAL 17 3HG2 VAL 17 9.743 -3.165 -8.294
160 H VAL 18 H VAL 18 7.383 -2.975 -4.182
161 HA VAL 18 HA VAL 18 6.768 -5.461 -2.854
162 HB VAL 18 HB VAL 18 5.905 -2.548 -2.296
163 1HG1 VAL 18 1HG1 VAL 18 6.247 -4.903 -0.398
164 2HG1 VAL 18 2HG1 VAL 18 5.842 -3.234 0.067
165 3HG1 VAL 18 3HG1 VAL 18 4.696 -4.191 -0.900
166 1HG2 VAL 18 1HG2 VAL 18 8.353 -2.809 -2.629
167 2HG2 VAL 18 2HG2 VAL 18 7.965 -2.441 -0.931
168 3HG2 VAL 18 3HG2 VAL 18 8.377 -4.106 -1.410
169 H SER 19 H SER 19 4.580 -2.894 -4.141
170 HA SER 19 HA SER 19 2.117 -4.274 -3.449
171 1HB SER 19 1HB SER 19 2.706 -2.594 -5.927
172 2HB SER 19 2HB SER 19 1.176 -2.689 -5.015
173 HG SER 19 HG SER 19 2.542 -1.882 -3.112
174 H THR 20 H THR 20 4.422 -4.909 -6.058
175 HA THR 20 HA THR 20 2.337 -6.745 -7.323
176 HB THR 20 HB THR 20 5.129 -6.183 -8.347
177 HG1 THR 20 HG1 THR 20 2.870 -4.336 -8.261
178 1HG2 THR 20 1HG2 THR 20 2.380 -6.397 -9.661
179 2HG2 THR 20 2HG2 THR 20 3.929 -6.223 -10.521
180 3HG2 THR 20 3HG2 THR 20 3.595 -7.696 -9.579
181 H LEU 21 H LEU 21 5.121 -6.887 -5.218
182 HA LEU 21 HA LEU 21 5.192 -9.899 -5.805
183 1HB LEU 21 1HB LEU 21 7.352 -7.847 -5.142
184 2HB LEU 21 2HB LEU 21 7.628 -9.603 -4.992
185 HG LEU 21 HG LEU 21 6.403 -8.697 -7.562
186 1HD1 LEU 21 1HD1 LEU 21 9.320 -8.129 -6.874
187 2HD1 LEU 21 2HD1 LEU 21 8.582 -7.974 -8.486
188 3HD1 LEU 21 3HD1 LEU 21 8.064 -6.902 -7.163
189 1HD2 LEU 21 1HD2 LEU 21 7.016 -11.051 -7.098
190 2HD2 LEU 21 2HD2 LEU 21 7.973 -10.394 -8.447
191 3HD2 LEU 21 3HD2 LEU 21 8.706 -10.559 -6.833
192 H PHE 22 H PHE 22 5.378 -7.332 -3.335
193 HA PHE 22 HA PHE 22 5.735 -9.261 -1.157
194 1HB PHE 22 1HB PHE 22 5.442 -6.396 -1.601
195 2HB PHE 22 2HB PHE 22 4.379 -6.897 -0.262
196 HD1 PHE 22 HD1 PHE 22 5.421 -6.418 1.772
197 HD2 PHE 22 HD2 PHE 22 7.743 -8.104 -1.445
198 HE1 PHE 22 HE1 PHE 22 7.396 -6.574 3.279
199 HE2 PHE 22 HE2 PHE 22 9.718 -8.262 0.061
200 HZ PHE 22 HZ PHE 22 9.547 -7.491 2.422
201 HA PRO 23 HA PRO 23 1.563 -10.833 -1.355
202 1HB PRO 23 1HB PRO 23 1.847 -12.370 0.810
203 2HB PRO 23 2HB PRO 23 2.435 -12.806 -0.860
204 1HG PRO 23 1HG PRO 23 3.918 -11.748 1.526
205 2HG PRO 23 2HG PRO 23 4.401 -13.058 0.365
206 1HD PRO 23 1HD PRO 23 5.407 -10.481 0.122
207 2HD PRO 23 2HD PRO 23 5.080 -11.489 -1.286
208 HA PRO 24 HA PRO 24 0.380 -9.036 2.744
209 1HB PRO 24 1HB PRO 24 2.037 -7.288 4.003
210 2HB PRO 24 2HB PRO 24 2.052 -9.079 4.305
211 1HG PRO 24 1HG PRO 24 4.005 -7.356 2.859
212 2HG PRO 24 2HG PRO 24 4.255 -8.945 3.654
213 1HD PRO 24 1HD PRO 24 3.801 -8.442 0.800
214 2HD PRO 24 2HD PRO 24 3.901 -10.066 1.627
215 H ALA 25 H ALA 25 -0.017 -8.040 0.257
216 HA ALA 25 HA ALA 25 -0.890 -5.300 0.788
217 1HB ALA 25 1HB ALA 25 1.628 -5.708 -0.934
218 2HB ALA 25 2HB ALA 25 0.789 -4.156 -0.700
219 3HB ALA 25 3HB ALA 25 1.608 -4.940 0.671
220 H ALA 26 H ALA 26 0.576 -6.963 -2.031
221 HA ALA 26 HA ALA 26 -1.260 -6.059 -4.047
222 1HB ALA 26 1HB ALA 26 -0.007 -8.814 -3.650
223 2HB ALA 26 2HB ALA 26 -0.584 -8.139 -5.193
224 3HB ALA 26 3HB ALA 26 0.812 -7.407 -4.367
225 HA PRO 27 HA PRO 27 -4.239 -9.738 -3.227
226 1HB PRO 27 1HB PRO 27 -4.428 -10.505 -0.666
227 2HB PRO 27 2HB PRO 27 -3.402 -11.329 -1.936
228 1HG PRO 27 1HG PRO 27 -2.659 -9.358 0.210
229 2HG PRO 27 2HG PRO 27 -1.819 -10.900 -0.262
230 1HD PRO 27 1HD PRO 27 -0.879 -8.480 -1.194
231 2HD PRO 27 2HD PRO 27 -0.879 -9.906 -2.227
232 H LEU 28 H LEU 28 -3.566 -7.047 -1.058
233 HA LEU 28 HA LEU 28 -6.305 -6.927 -0.074
234 1HB LEU 28 1HB LEU 28 -3.834 -5.427 0.082
235 2HB LEU 28 2HB LEU 28 -5.115 -4.279 -0.373
236 HG LEU 28 HG LEU 28 -5.184 -6.187 2.009
237 1HD1 LEU 28 1HD1 LEU 28 -4.960 -3.148 1.835
238 2HD1 LEU 28 2HD1 LEU 28 -5.089 -4.095 3.336
239 3HD1 LEU 28 3HD1 LEU 28 -3.651 -4.259 2.301
240 1HD2 LEU 28 1HD2 LEU 28 -7.420 -5.814 0.998
241 2HD2 LEU 28 2HD2 LEU 28 -7.287 -5.001 2.576
242 3HD2 LEU 28 3HD2 LEU 28 -7.160 -4.055 1.075
243 H ALA 29 H ALA 29 -4.550 -5.534 -2.863
244 HA ALA 29 HA ALA 29 -6.716 -4.002 -3.914
245 1HB ALA 29 1HB ALA 29 -4.571 -5.717 -5.333
246 2HB ALA 29 2HB ALA 29 -5.449 -4.377 -6.108
247 3HB ALA 29 3HB ALA 29 -4.330 -4.048 -4.763
248 H HIS 30 H HIS 30 -5.955 -7.447 -3.966
249 HA HIS 30 HA HIS 30 -7.873 -8.311 -5.925
250 1HB HIS 30 1HB HIS 30 -5.997 -9.460 -4.303
251 2HB HIS 30 2HB HIS 30 -7.435 -9.821 -3.317
252 HD1 HIS 30 HD1 HIS 30 -5.428 -11.539 -5.584
253 HD2 HIS 30 HD2 HIS 30 -9.585 -10.779 -5.508
254 HE1 HIS 30 HE1 HIS 30 -6.556 -13.312 -7.056
255 H ALA 31 H ALA 31 -8.183 -7.838 -2.380
256 HA ALA 31 HA ALA 31 -10.955 -8.612 -2.220
257 1HB ALA 31 1HB ALA 31 -9.364 -6.460 -0.700
258 2HB ALA 31 2HB ALA 31 -10.871 -7.207 -0.118
259 3HB ALA 31 3HB ALA 31 -9.398 -8.191 -0.287
260 H ILE 32 H ILE 32 -9.379 -5.674 -3.354
261 HA ILE 32 HA ILE 32 -12.099 -4.370 -3.605
262 HB ILE 32 HB ILE 32 -9.323 -3.262 -4.282
263 1HG1 ILE 32 1HG1 ILE 32 -10.386 -4.077 -1.669
264 2HG1 ILE 32 2HG1 ILE 32 -8.735 -3.578 -2.117
265 1HG2 ILE 32 1HG2 ILE 32 -11.887 -1.969 -3.259
266 2HG2 ILE 32 2HG2 ILE 32 -10.378 -1.112 -3.648
267 3HG2 ILE 32 3HG2 ILE 32 -11.298 -1.921 -4.938
268 1HD1 ILE 32 1HD1 ILE 32 -11.084 -1.698 -1.595
269 2HD1 ILE 32 2HD1 ILE 32 -9.730 -1.998 -0.479
270 3HD1 ILE 32 3HD1 ILE 32 -9.435 -1.199 -2.042
271 H GLY 33 H GLY 33 -11.289 -6.670 -5.259
272 1HA GLY 33 1HA GLY 33 -11.300 -5.215 -7.932
273 2HA GLY 33 2HA GLY 33 -10.384 -6.719 -7.680
274 H GLU 34 H GLU 34 -13.489 -6.310 -6.071
275 HA GLU 34 HA GLU 34 -14.496 -8.702 -7.423
276 1HB GLU 34 1HB GLU 34 -16.351 -6.654 -6.112
277 2HB GLU 34 2HB GLU 34 -16.354 -8.405 -5.919
278 1HG GLU 34 1HG GLU 34 -15.396 -7.980 -3.941
279 2HG GLU 34 2HG GLU 34 -13.898 -7.753 -4.888
280 HE2 GLU 34 HE2 GLU 34 -14.838 -4.615 -3.018
281 H GLY 35 H GLY 35 -15.073 -5.192 -7.744
282 1HA GLY 35 1HA GLY 35 -17.149 -5.333 -9.691
283 2HA GLY 35 2HA GLY 35 -15.929 -4.023 -9.595
284 H VAL 36 H VAL 36 -13.604 -5.678 -10.016
285 HA VAL 36 HA VAL 36 -13.642 -5.750 -12.910
286 HB VAL 36 HB VAL 36 -11.777 -7.297 -11.012
287 1HG1 VAL 36 1HG1 VAL 36 -11.284 -5.837 -13.645
288 2HG1 VAL 36 2HG1 VAL 36 -10.057 -6.703 -12.692
289 3HG1 VAL 36 3HG1 VAL 36 -11.397 -7.601 -13.443
290 1HG2 VAL 36 1HG2 VAL 36 -12.141 -5.005 -10.124
291 2HG2 VAL 36 2HG2 VAL 36 -10.489 -5.190 -10.760
292 3HG2 VAL 36 3HG2 VAL 36 -11.717 -4.324 -11.712
293 H ASP 37 H ASP 37 -13.823 -8.268 -10.366
294 HA ASP 37 HA ASP 37 -14.010 -10.539 -12.101
295 1HB ASP 37 1HB ASP 37 -13.986 -11.206 -9.856
296 2HB ASP 37 2HB ASP 37 -14.818 -9.718 -9.333
297 HD2 ASP 37 HD2 ASP 37 -17.167 -12.770 -10.395
298 H TYR 38 H TYR 38 -16.570 -8.389 -10.802
299 HA TYR 38 HA TYR 38 -18.753 -9.738 -12.159
300 1HB TYR 38 1HB TYR 38 -18.714 -7.922 -10.287
301 2HB TYR 38 2HB TYR 38 -18.481 -6.738 -11.602
302 HD1 TYR 38 HD1 TYR 38 -20.642 -9.751 -10.911
303 HD2 TYR 38 HD2 TYR 38 -20.421 -5.704 -12.378
304 HE1 TYR 38 HE1 TYR 38 -23.086 -9.785 -11.364
305 HE2 TYR 38 HE2 TYR 38 -22.869 -5.734 -12.830
306 HH TYR 38 HH TYR 38 -24.914 -8.596 -11.914
307 H LEU 39 H LEU 39 -16.613 -7.040 -13.133
308 HA LEU 39 HA LEU 39 -17.987 -6.579 -15.662
309 1HB LEU 39 1HB LEU 39 -15.402 -5.923 -14.291
310 2HB LEU 39 2HB LEU 39 -15.320 -5.878 -16.067
311 HG LEU 39 HG LEU 39 -17.058 -4.227 -16.204
312 1HD1 LEU 39 1HD1 LEU 39 -17.505 -4.700 -13.224
313 2HD1 LEU 39 2HD1 LEU 39 -18.364 -3.508 -14.230
314 3HD1 LEU 39 3HD1 LEU 39 -18.577 -5.249 -14.533
315 1HD2 LEU 39 1HD2 LEU 39 -14.860 -3.345 -15.472
316 2HD2 LEU 39 2HD2 LEU 39 -16.196 -2.400 -14.772
317 3HD2 LEU 39 3HD2 LEU 39 -15.328 -3.589 -13.772
318 H LEU 40 H LEU 40 -15.558 -8.919 -14.592
319 HA LEU 40 HA LEU 40 -14.853 -9.753 -17.334
320 1HB LEU 40 1HB LEU 40 -14.366 -10.522 -14.481
321 2HB LEU 40 2HB LEU 40 -14.304 -11.888 -15.615
322 HG LEU 40 HG LEU 40 -12.552 -10.886 -16.892
323 1HD1 LEU 40 1HD1 LEU 40 -13.060 -8.343 -15.284
324 2HD1 LEU 40 2HD1 LEU 40 -11.802 -8.555 -16.524
325 3HD1 LEU 40 3HD1 LEU 40 -13.520 -8.604 -16.983
326 1HD2 LEU 40 1HD2 LEU 40 -11.812 -11.806 -14.709
327 2HD2 LEU 40 2HD2 LEU 40 -10.806 -10.421 -15.196
328 3HD2 LEU 40 3HD2 LEU 40 -12.065 -10.214 -13.955
329 H GLY 41 H GLY 41 -17.358 -10.607 -14.986
330 1HA GLY 41 1HA GLY 41 -19.031 -11.784 -16.989
331 2HA GLY 41 2HA GLY 41 -18.099 -13.114 -16.247
332 H ASP 42 H ASP 42 -18.557 -13.760 -14.135
333 HA ASP 42 HA ASP 42 -20.022 -14.043 -12.276
334 1HB ASP 42 1HB ASP 42 -18.740 -11.655 -12.105
335 2HB ASP 42 2HB ASP 42 -20.405 -11.040 -12.225
336 HD2 ASP 42 HD2 ASP 42 -20.041 -11.707 -8.698
337 H GLU 43 H GLU 43 -21.248 -14.054 -14.910
338 HA GLU 43 HA GLU 43 -24.037 -13.538 -13.991
339 1HB GLU 43 1HB GLU 43 -22.525 -11.624 -15.521
340 2HB GLU 43 2HB GLU 43 -23.636 -12.384 -16.678
341 1HG GLU 43 1HG GLU 43 -25.038 -11.841 -14.210
342 2HG GLU 43 2HG GLU 43 -24.219 -10.360 -14.777
343 HE2 GLU 43 HE2 GLU 43 -26.598 -11.855 -17.594
344 H ALA 44 H ALA 44 -25.124 -13.717 -16.718
345 HA ALA 44 HA ALA 44 -25.164 -16.579 -17.011
346 1HB ALA 44 1HB ALA 44 -25.542 -14.346 -19.097
347 2HB ALA 44 2HB ALA 44 -26.158 -16.008 -19.266
348 3HB ALA 44 3HB ALA 44 -26.808 -14.942 -17.997
349 H GLN 45 H GLN 45 -23.254 -17.676 -17.182
350 HA GLN 45 HA GLN 45 -21.551 -16.916 -19.580
351 1HB GLN 45 1HB GLN 45 -20.938 -17.136 -16.654
352 2HB GLN 45 2HB GLN 45 -19.802 -18.037 -17.678
353 1HG GLN 45 1HG GLN 45 -19.330 -16.031 -18.988
354 2HG GLN 45 2HG GLN 45 -20.548 -15.112 -18.059
355 1HE2 GLN 45 2HE2 GLN 45 -17.204 -16.047 -18.162
356 2HE2 GLN 45 1HE2 GLN 45 -16.789 -15.551 -16.499
357 H ALA 46 H ALA 46 -22.310 -19.424 -17.124
358 HA ALA 46 HA ALA 46 -22.332 -21.370 -19.374
359 1HB ALA 46 1HB ALA 46 -20.817 -22.918 -18.017
360 2HB ALA 46 2HB ALA 46 -20.014 -21.386 -18.440
361 3HB ALA 46 3HB ALA 46 -20.663 -21.629 -16.800
Start of MODEL 13
1 1H PHE 1 1H PHE 1 25.901 1.125 6.430
2 2H PHE 1 2H PHE 1 27.155 1.934 7.203
3 3H PHE 1 3H PHE 1 26.112 0.958 8.090
4 HA PHE 1 HA PHE 1 24.236 2.501 7.611
5 1HB PHE 1 2HB PHE 1 25.853 2.662 9.605
6 2HB PHE 1 1HB PHE 1 26.771 3.855 8.658
7 HD1 PHE 1 HD1 PHE 1 23.200 3.126 9.644
8 HD2 PHE 1 HD2 PHE 1 26.249 6.098 8.947
9 HE1 PHE 1 HE1 PHE 1 21.619 4.917 10.343
10 HE2 PHE 1 HE2 PHE 1 24.667 7.885 9.650
11 HZ PHE 1 HZ PHE 1 22.351 7.294 10.347
12 H GLY 2 H GLY 2 23.931 4.912 7.023
13 1HA GLY 2 1HA GLY 2 24.523 6.729 5.525
14 2HA GLY 2 2HA GLY 2 25.783 5.704 4.785
15 H PHE 3 H PHE 3 24.807 3.607 3.768
16 HA PHE 3 HA PHE 3 23.249 4.277 1.464
17 1HB PHE 3 1HB PHE 3 23.868 1.822 3.112
18 2HB PHE 3 2HB PHE 3 22.607 1.670 1.866
19 HD1 PHE 3 HD1 PHE 3 23.295 2.942 -0.446
20 HD2 PHE 3 HD2 PHE 3 26.029 1.283 2.449
21 HE1 PHE 3 HE1 PHE 3 25.050 2.768 -2.202
22 HE2 PHE 3 HE2 PHE 3 27.783 1.109 0.690
23 HZ PHE 3 HZ PHE 3 27.295 1.852 -1.635
24 H LYS 4 H LYS 4 22.098 3.713 4.738
25 HA LYS 4 HA LYS 4 19.413 2.915 4.332
26 1HB LYS 4 1HB LYS 4 18.977 4.457 6.332
27 2HB LYS 4 2HB LYS 4 20.393 3.408 6.539
28 1HG LYS 4 1HG LYS 4 21.585 5.271 6.959
29 2HG LYS 4 2HG LYS 4 21.394 5.688 5.237
30 1HD LYS 4 1HD LYS 4 18.936 6.432 6.391
31 2HD LYS 4 2HD LYS 4 20.130 6.917 7.603
32 1HE LYS 4 1HE LYS 4 19.816 7.787 4.759
33 2HE LYS 4 2HE LYS 4 20.023 8.768 6.267
34 1HZ LYS 4 1HZ LYS 4 22.101 6.990 5.040
35 2HZ LYS 4 2HZ LYS 4 22.129 8.670 4.953
36 3HZ LYS 4 3HZ LYS 4 22.294 7.901 6.440
37 H ASP 5 H ASP 5 20.824 6.094 3.514
38 HA ASP 5 HA ASP 5 18.180 7.287 3.010
39 1HB ASP 5 1HB ASP 5 19.930 8.849 3.312
40 2HB ASP 5 2HB ASP 5 21.088 7.863 2.374
41 HD2 ASP 5 HD2 ASP 5 18.528 9.994 0.159
42 H ILE 6 H ILE 6 20.688 5.729 0.999
43 HA ILE 6 HA ILE 6 19.232 6.083 -1.476
44 HB ILE 6 HB ILE 6 21.081 3.757 -0.659
45 1HG1 ILE 6 1HG1 ILE 6 21.595 6.658 -0.807
46 2HG1 ILE 6 2HG1 ILE 6 22.576 5.362 -0.076
47 1HG2 ILE 6 1HG2 ILE 6 20.702 5.235 -3.299
48 2HG2 ILE 6 2HG2 ILE 6 21.833 3.892 -3.010
49 3HG2 ILE 6 3HG2 ILE 6 20.078 3.611 -2.920
50 1HD1 ILE 6 1HD1 ILE 6 22.409 6.002 -3.057
51 2HD1 ILE 6 2HD1 ILE 6 23.769 6.413 -1.986
52 3HD1 ILE 6 3HD1 ILE 6 23.388 4.708 -2.328
53 H ILE 7 H ILE 7 19.230 3.601 1.085
54 HA ILE 7 HA ILE 7 17.605 1.663 -0.240
55 HB ILE 7 HB ILE 7 17.553 2.604 2.695
56 1HG1 ILE 7 1HG1 ILE 7 19.685 1.534 1.114
57 2HG1 ILE 7 2HG1 ILE 7 19.664 1.823 2.872
58 1HG2 ILE 7 1HG2 ILE 7 16.927 -0.111 1.455
59 2HG2 ILE 7 2HG2 ILE 7 16.938 0.262 3.195
60 3HG2 ILE 7 3HG2 ILE 7 15.732 1.021 2.129
61 1HD1 ILE 7 1HD1 ILE 7 18.640 -0.688 1.468
62 2HD1 ILE 7 2HD1 ILE 7 20.170 -0.554 2.367
63 3HD1 ILE 7 3HD1 ILE 7 18.618 -0.399 3.224
64 H ARG 8 H ARG 8 16.707 4.656 1.540
65 HA ARG 8 HA ARG 8 13.858 4.237 1.354
66 1HB ARG 8 1HB ARG 8 15.541 6.820 1.191
67 2HB ARG 8 2HB ARG 8 13.820 6.769 1.626
68 1HG ARG 8 1HG ARG 8 14.250 5.755 3.721
69 2HG ARG 8 2HG ARG 8 15.809 5.104 3.203
70 1HD ARG 8 1HD ARG 8 15.153 7.625 4.440
71 2HD ARG 8 2HD ARG 8 16.753 6.808 4.210
72 HE ARG 8 HE ARG 8 16.755 7.779 1.815
73 1HH1 ARG 8 2HH1 ARG 8 13.821 8.705 3.236
74 2HH1 ARG 8 1HH1 ARG 8 13.999 10.454 2.935
75 1HH2 ARG 8 1HH2 ARG 8 17.386 10.167 1.921
76 2HH2 ARG 8 2HH2 ARG 8 16.020 11.281 2.191
77 H ALA 9 H ALA 9 16.190 5.888 -0.821
78 HA ALA 9 HA ALA 9 14.255 6.658 -2.814
79 1HB ALA 9 1HB ALA 9 17.168 5.699 -3.093
80 2HB ALA 9 2HB ALA 9 16.300 6.670 -4.304
81 3HB ALA 9 3HB ALA 9 16.674 7.365 -2.709
82 H ILE 10 H ILE 10 16.198 3.669 -2.448
83 HA ILE 10 HA ILE 10 15.122 2.431 -4.834
84 HB ILE 10 HB ILE 10 16.048 1.159 -2.190
85 1HG1 ILE 10 1HG1 ILE 10 17.455 2.886 -3.978
86 2HG1 ILE 10 2HG1 ILE 10 18.121 1.942 -2.621
87 1HG2 ILE 10 1HG2 ILE 10 16.127 0.140 -5.066
88 2HG2 ILE 10 2HG2 ILE 10 16.771 -0.713 -3.643
89 3HG2 ILE 10 3HG2 ILE 10 15.020 -0.430 -3.794
90 1HD1 ILE 10 1HD1 ILE 10 17.708 0.919 -5.468
91 2HD1 ILE 10 2HD1 ILE 10 19.270 1.376 -4.748
92 3HD1 ILE 10 3HD1 ILE 10 18.373 -0.023 -4.112
93 H ARG 11 H ARG 11 14.018 2.582 -1.438
94 HA ARG 11 HA ARG 11 11.858 0.687 -1.859
95 1HB ARG 11 1HB ARG 11 12.549 1.285 0.413
96 2HB ARG 11 2HB ARG 11 12.392 3.020 0.072
97 1HG ARG 11 1HG ARG 11 10.503 2.084 1.465
98 2HG ARG 11 2HG ARG 11 9.960 2.835 -0.048
99 1HD ARG 11 1HD ARG 11 8.891 0.670 0.484
100 2HD ARG 11 2HD ARG 11 9.751 0.733 -1.118
101 HE ARG 11 HE ARG 11 11.669 -0.549 -0.066
102 1HH1 ARG 11 2HH1 ARG 11 11.220 0.156 2.814
103 2HH1 ARG 11 1HH1 ARG 11 10.472 -1.321 3.479
104 1HH2 ARG 11 1HH2 ARG 11 9.556 -2.572 0.288
105 2HH2 ARG 11 2HH2 ARG 11 9.528 -2.868 2.047
106 H ARG 12 H ARG 12 12.261 4.188 -2.317
107 HA ARG 12 HA ARG 12 9.420 4.682 -2.915
108 1HB ARG 12 1HB ARG 12 12.088 6.086 -3.468
109 2HB ARG 12 2HB ARG 12 10.538 6.796 -3.969
110 1HG ARG 12 1HG ARG 12 10.577 5.855 -1.164
111 2HG ARG 12 2HG ARG 12 11.725 7.171 -1.504
112 1HD ARG 12 1HD ARG 12 9.396 7.827 -0.796
113 2HD ARG 12 2HD ARG 12 10.060 8.582 -2.314
114 HE ARG 12 HE ARG 12 8.165 6.148 -2.326
115 1HH1 ARG 12 2HH1 ARG 12 7.723 9.377 -2.805
116 2HH1 ARG 12 1HH1 ARG 12 7.380 9.321 -4.555
117 1HH2 ARG 12 1HH2 ARG 12 8.494 5.973 -4.909
118 2HH2 ARG 12 2HH2 ARG 12 7.816 7.395 -5.746
119 H ILE 13 H ILE 13 12.297 3.858 -4.883
120 HA ILE 13 HA ILE 13 10.701 4.161 -7.361
121 HB ILE 13 HB ILE 13 13.231 4.507 -7.127
122 1HG1 ILE 13 1HG1 ILE 13 13.824 3.476 -9.226
123 2HG1 ILE 13 2HG1 ILE 13 12.535 2.263 -9.057
124 1HG2 ILE 13 1HG2 ILE 13 13.238 1.480 -6.856
125 2HG2 ILE 13 2HG2 ILE 13 14.670 2.524 -7.019
126 3HG2 ILE 13 3HG2 ILE 13 13.643 2.640 -5.569
127 1HD1 ILE 13 1HD1 ILE 13 12.122 5.273 -9.319
128 2HD1 ILE 13 2HD1 ILE 13 11.858 4.070 -10.603
129 3HD1 ILE 13 3HD1 ILE 13 10.832 4.058 -9.150
130 H ALA 14 H ALA 14 11.619 1.610 -5.094
131 HA ALA 14 HA ALA 14 10.521 -0.515 -6.875
132 1HB ALA 14 1HB ALA 14 11.333 -0.451 -3.910
133 2HB ALA 14 2HB ALA 14 11.030 -1.929 -4.853
134 3HB ALA 14 3HB ALA 14 12.413 -0.884 -5.256
135 H VAL 15 H VAL 15 9.097 1.924 -5.078
136 HA VAL 15 HA VAL 15 7.094 0.883 -3.432
137 HB VAL 15 HB VAL 15 7.124 2.937 -5.675
138 1HG1 VAL 15 1HG1 VAL 15 4.714 2.265 -3.936
139 2HG1 VAL 15 2HG1 VAL 15 4.847 3.651 -5.043
140 3HG1 VAL 15 3HG1 VAL 15 4.835 1.994 -5.691
141 1HG2 VAL 15 1HG2 VAL 15 8.220 3.422 -3.501
142 2HG2 VAL 15 2HG2 VAL 15 6.813 4.479 -3.763
143 3HG2 VAL 15 3HG2 VAL 15 6.689 3.090 -2.658
144 HA PRO 16 HA PRO 16 4.361 -0.676 -6.994
145 1HB PRO 16 1HB PRO 16 5.582 -1.245 -9.341
146 2HB PRO 16 2HB PRO 16 4.740 0.330 -8.968
147 1HG PRO 16 1HG PRO 16 7.663 -0.374 -8.968
148 2HG PRO 16 2HG PRO 16 6.850 1.122 -9.582
149 1HD PRO 16 1HD PRO 16 8.106 1.052 -7.104
150 2HD PRO 16 2HD PRO 16 6.689 2.054 -7.415
151 H VAL 17 H VAL 17 7.790 -1.709 -7.384
152 HA VAL 17 HA VAL 17 7.113 -4.530 -7.640
153 HB VAL 17 HB VAL 17 9.625 -3.330 -6.351
154 1HG1 VAL 17 1HG1 VAL 17 9.181 -5.680 -8.247
155 2HG1 VAL 17 2HG1 VAL 17 10.747 -5.170 -7.572
156 3HG1 VAL 17 3HG1 VAL 17 9.477 -5.801 -6.496
157 1HG2 VAL 17 1HG2 VAL 17 9.029 -1.963 -8.338
158 2HG2 VAL 17 2HG2 VAL 17 10.487 -2.937 -8.642
159 3HG2 VAL 17 3HG2 VAL 17 8.921 -3.443 -9.321
160 H VAL 18 H VAL 18 7.541 -2.372 -4.850
161 HA VAL 18 HA VAL 18 7.739 -4.475 -2.894
162 HB VAL 18 HB VAL 18 6.474 -1.659 -2.806
163 1HG1 VAL 18 1HG1 VAL 18 7.522 -3.400 -0.533
164 2HG1 VAL 18 2HG1 VAL 18 6.930 -1.728 -0.377
165 3HG1 VAL 18 3HG1 VAL 18 5.811 -3.027 -0.852
166 1HG2 VAL 18 1HG2 VAL 18 8.834 -1.698 -3.570
167 2HG2 VAL 18 2HG2 VAL 18 8.694 -0.956 -1.958
168 3HG2 VAL 18 3HG2 VAL 18 9.287 -2.625 -2.121
169 H SER 19 H SER 19 4.960 -2.653 -4.232
170 HA SER 19 HA SER 19 2.902 -4.052 -2.757
171 1HB SER 19 1HB SER 19 2.801 -3.098 -5.666
172 2HB SER 19 2HB SER 19 1.491 -3.036 -4.458
173 HG SER 19 HG SER 19 2.476 -1.350 -3.371
174 H THR 20 H THR 20 4.854 -5.062 -5.535
175 HA THR 20 HA THR 20 2.973 -7.400 -5.990
176 HB THR 20 HB THR 20 5.295 -7.563 -7.598
177 HG1 THR 20 HG1 THR 20 4.489 -4.783 -7.222
178 1HG2 THR 20 1HG2 THR 20 3.829 -6.669 -9.381
179 2HG2 THR 20 2HG2 THR 20 2.948 -7.823 -8.351
180 3HG2 THR 20 3HG2 THR 20 2.691 -6.073 -8.149
181 H LEU 21 H LEU 21 6.107 -6.681 -4.501
182 HA LEU 21 HA LEU 21 6.587 -9.686 -4.249
183 1HB LEU 21 1HB LEU 21 8.185 -7.122 -4.179
184 2HB LEU 21 2HB LEU 21 8.778 -8.473 -3.187
185 HG LEU 21 HG LEU 21 9.805 -8.570 -5.418
186 1HD1 LEU 21 1HD1 LEU 21 7.638 -10.688 -5.062
187 2HD1 LEU 21 2HD1 LEU 21 9.100 -10.855 -6.062
188 3HD1 LEU 21 3HD1 LEU 21 9.243 -10.708 -4.295
189 1HD2 LEU 21 1HD2 LEU 21 8.036 -7.338 -6.641
190 2HD2 LEU 21 2HD2 LEU 21 8.397 -8.892 -7.429
191 3HD2 LEU 21 3HD2 LEU 21 6.932 -8.719 -6.433
192 H PHE 22 H PHE 22 6.022 -6.758 -2.293
193 HA PHE 22 HA PHE 22 6.460 -8.327 0.197
194 1HB PHE 22 1HB PHE 22 5.564 -5.528 -0.584
195 2HB PHE 22 2HB PHE 22 5.360 -6.078 1.097
196 HD1 PHE 22 HD1 PHE 22 7.152 -5.892 2.598
197 HD2 PHE 22 HD2 PHE 22 7.935 -5.914 -1.645
198 HE1 PHE 22 HE1 PHE 22 9.560 -5.444 3.039
199 HE2 PHE 22 HE2 PHE 22 10.343 -5.464 -1.202
200 HZ PHE 22 HZ PHE 22 11.155 -5.227 1.139
201 HA PRO 23 HA PRO 23 2.318 -10.019 -0.054
202 1HB PRO 23 1HB PRO 23 2.527 -11.320 2.268
203 2HB PRO 23 2HB PRO 23 3.198 -11.915 0.680
204 1HG PRO 23 1HG PRO 23 4.552 -10.580 3.003
205 2HG PRO 23 2HG PRO 23 5.105 -12.004 2.016
206 1HD PRO 23 1HD PRO 23 6.098 -9.457 1.530
207 2HD PRO 23 2HD PRO 23 5.830 -10.612 0.226
208 HA PRO 24 HA PRO 24 0.974 -7.893 3.882
209 1HB PRO 24 1HB PRO 24 2.473 -5.855 4.851
210 2HB PRO 24 2HB PRO 24 2.622 -7.579 5.413
211 1HG PRO 24 1HG PRO 24 4.406 -5.953 3.645
212 2HG PRO 24 2HG PRO 24 4.825 -7.293 4.769
213 1HD PRO 24 1HD PRO 24 4.457 -7.529 1.904
214 2HD PRO 24 2HD PRO 24 4.480 -8.917 3.089
215 H ALA 25 H ALA 25 3.088 -5.740 1.928
216 HA ALA 25 HA ALA 25 0.896 -3.720 1.787
217 1HB ALA 25 1HB ALA 25 3.569 -4.068 0.300
218 2HB ALA 25 2HB ALA 25 2.598 -2.577 0.307
219 3HB ALA 25 3HB ALA 25 3.355 -3.153 1.811
220 H ALA 26 H ALA 26 -0.493 -5.700 0.926
221 HA ALA 26 HA ALA 26 -0.751 -5.189 -2.011
222 1HB ALA 26 1HB ALA 26 -0.036 -7.947 -0.880
223 2HB ALA 26 2HB ALA 26 -0.444 -7.606 -2.578
224 3HB ALA 26 3HB ALA 26 1.040 -6.928 -1.866
225 HA PRO 27 HA PRO 27 -4.376 -7.945 -0.657
226 1HB PRO 27 1HB PRO 27 -4.456 -8.760 1.917
227 2HB PRO 27 2HB PRO 27 -3.756 -9.736 0.539
228 1HG PRO 27 1HG PRO 27 -2.406 -8.044 2.626
229 2HG PRO 27 2HG PRO 27 -1.943 -9.690 2.016
230 1HD PRO 27 1HD PRO 27 -0.678 -7.414 1.073
231 2HD PRO 27 2HD PRO 27 -0.989 -8.800 0.028
232 H LEU 28 H LEU 28 -2.849 -5.727 1.635
233 HA LEU 28 HA LEU 28 -5.391 -4.924 2.820
234 1HB LEU 28 1HB LEU 28 -2.560 -3.854 2.589
235 2HB LEU 28 2HB LEU 28 -3.811 -2.732 3.160
236 HG LEU 28 HG LEU 28 -4.459 -4.445 4.906
237 1HD1 LEU 28 1HD1 LEU 28 -1.916 -5.814 3.927
238 2HD1 LEU 28 2HD1 LEU 28 -2.866 -6.277 5.359
239 3HD1 LEU 28 3HD1 LEU 28 -3.571 -6.438 3.733
240 1HD2 LEU 28 1HD2 LEU 28 -2.932 -2.560 5.426
241 2HD2 LEU 28 2HD2 LEU 28 -2.487 -4.020 6.340
242 3HD2 LEU 28 3HD2 LEU 28 -1.543 -3.545 4.909
243 H ALA 29 H ALA 29 -3.316 -3.572 0.200
244 HA ALA 29 HA ALA 29 -5.168 -1.509 -0.501
245 1HB ALA 29 1HB ALA 29 -3.272 -3.217 -2.250
246 2HB ALA 29 2HB ALA 29 -3.918 -1.633 -2.743
247 3HB ALA 29 3HB ALA 29 -2.798 -1.747 -1.364
248 H HIS 30 H HIS 30 -4.874 -4.927 -1.233
249 HA HIS 30 HA HIS 30 -6.816 -5.196 -3.308
250 1HB HIS 30 1HB HIS 30 -5.217 -6.786 -1.632
251 2HB HIS 30 2HB HIS 30 -6.854 -7.201 -1.067
252 HD1 HIS 30 HD1 HIS 30 -4.524 -7.470 -4.041
253 HD2 HIS 30 HD2 HIS 30 -8.483 -8.534 -3.003
254 HE1 HIS 30 HE1 HIS 30 -5.390 -9.067 -5.856
255 H ALA 31 H ALA 31 -7.285 -5.497 0.250
256 HA ALA 31 HA ALA 31 -10.112 -5.834 0.249
257 1HB ALA 31 1HB ALA 31 -8.347 -4.110 2.081
258 2HB ALA 31 2HB ALA 31 -9.943 -4.762 2.518
259 3HB ALA 31 3HB ALA 31 -8.577 -5.868 2.239
260 H ILE 32 H ILE 32 -8.245 -2.792 -0.033
261 HA ILE 32 HA ILE 32 -10.548 -1.053 0.080
262 HB ILE 32 HB ILE 32 -8.040 -0.747 -1.672
263 1HG1 ILE 32 1HG1 ILE 32 -8.336 -0.972 1.266
264 2HG1 ILE 32 2HG1 ILE 32 -6.881 -1.129 0.251
265 1HG2 ILE 32 1HG2 ILE 32 -9.723 1.269 -0.121
266 2HG2 ILE 32 2HG2 ILE 32 -8.281 1.647 -1.093
267 3HG2 ILE 32 3HG2 ILE 32 -9.751 1.033 -1.885
268 1HD1 ILE 32 1HD1 ILE 32 -8.223 1.497 1.045
269 2HD1 ILE 32 2HD1 ILE 32 -6.718 0.851 1.742
270 3HD1 ILE 32 3HD1 ILE 32 -6.769 1.340 0.032
271 H GLY 33 H GLY 33 -9.090 -2.902 -2.609
272 1HA GLY 33 1HA GLY 33 -11.120 -1.762 -4.496
273 2HA GLY 33 2HA GLY 33 -9.840 -2.933 -4.899
274 H GLU 34 H GLU 34 -10.614 -4.606 -2.473
275 HA GLU 34 HA GLU 34 -12.421 -6.432 -3.856
276 1HB GLU 34 1HB GLU 34 -11.454 -5.983 -1.000
277 2HB GLU 34 2HB GLU 34 -12.622 -7.274 -1.363
278 1HG GLU 34 1HG GLU 34 -11.048 -8.178 -3.071
279 2HG GLU 34 2HG GLU 34 -9.866 -6.924 -2.611
280 HE2 GLU 34 HE2 GLU 34 -9.999 -8.689 0.708
281 H GLY 35 H GLY 35 -13.165 -3.429 -2.343
282 1HA GLY 35 1HA GLY 35 -15.642 -4.015 -1.085
283 2HA GLY 35 2HA GLY 35 -15.318 -2.511 -1.995
284 H VAL 36 H VAL 36 -15.063 -3.308 -4.589
285 HA VAL 36 HA VAL 36 -17.807 -3.810 -5.359
286 HB VAL 36 HB VAL 36 -16.687 -4.195 -7.636
287 1HG1 VAL 36 1HG1 VAL 36 -15.636 -1.856 -5.981
288 2HG1 VAL 36 2HG1 VAL 36 -15.695 -1.926 -7.758
289 3HG1 VAL 36 3HG1 VAL 36 -17.205 -1.912 -6.817
290 1HG2 VAL 36 1HG2 VAL 36 -14.670 -5.360 -6.801
291 2HG2 VAL 36 2HG2 VAL 36 -14.234 -3.927 -7.761
292 3HG2 VAL 36 3HG2 VAL 36 -14.145 -3.868 -5.984
293 H ASP 37 H ASP 37 -14.966 -5.968 -5.056
294 HA ASP 37 HA ASP 37 -16.273 -8.329 -6.086
295 1HB ASP 37 1HB ASP 37 -13.889 -8.319 -5.682
296 2HB ASP 37 2HB ASP 37 -14.117 -7.783 -3.990
297 HD2 ASP 37 HD2 ASP 37 -14.440 -11.130 -3.004
298 H TYR 38 H TYR 38 -16.157 -6.885 -2.826
299 HA TYR 38 HA TYR 38 -17.506 -8.981 -1.419
300 1HB TYR 38 1HB TYR 38 -16.492 -6.589 -0.753
301 2HB TYR 38 2HB TYR 38 -18.154 -6.019 -1.031
302 HD1 TYR 38 HD1 TYR 38 -15.927 -7.323 1.378
303 HD2 TYR 38 HD2 TYR 38 -20.037 -7.546 0.095
304 HE1 TYR 38 HE1 TYR 38 -16.585 -8.147 3.631
305 HE2 TYR 38 HE2 TYR 38 -20.698 -8.368 2.348
306 HH TYR 38 HH TYR 38 -18.283 -9.327 4.779
307 H LEU 39 H LEU 39 -18.791 -6.381 -3.494
308 HA LEU 39 HA LEU 39 -21.597 -7.357 -2.959
309 1HB LEU 39 1HB LEU 39 -20.200 -5.080 -4.408
310 2HB LEU 39 2HB LEU 39 -21.897 -5.444 -4.804
311 HG LEU 39 HG LEU 39 -22.038 -5.479 -2.082
312 1HD1 LEU 39 1HD1 LEU 39 -19.910 -3.412 -2.796
313 2HD1 LEU 39 2HD1 LEU 39 -20.698 -3.590 -1.211
314 3HD1 LEU 39 3HD1 LEU 39 -19.644 -4.883 -1.831
315 1HD2 LEU 39 1HD2 LEU 39 -23.461 -4.170 -3.633
316 2HD2 LEU 39 2HD2 LEU 39 -22.920 -3.174 -2.262
317 3HD2 LEU 39 3HD2 LEU 39 -22.141 -2.996 -3.852
318 H LEU 40 H LEU 40 -19.026 -8.159 -5.071
319 HA LEU 40 HA LEU 40 -21.031 -9.063 -7.182
320 1HB LEU 40 1HB LEU 40 -18.192 -8.138 -7.066
321 2HB LEU 40 2HB LEU 40 -18.447 -9.544 -8.123
322 HG LEU 40 HG LEU 40 -18.711 -7.377 -9.346
323 1HD1 LEU 40 1HD1 LEU 40 -21.295 -8.962 -8.990
324 2HD1 LEU 40 2HD1 LEU 40 -20.900 -7.911 -10.372
325 3HD1 LEU 40 3HD1 LEU 40 -19.956 -9.391 -10.081
326 1HD2 LEU 40 1HD2 LEU 40 -19.574 -6.047 -7.439
327 2HD2 LEU 40 2HD2 LEU 40 -20.679 -5.964 -8.830
328 3HD2 LEU 40 3HD2 LEU 40 -21.070 -7.011 -7.445
329 H GLY 41 H GLY 41 -18.625 -10.192 -4.842
330 1HA GLY 41 1HA GLY 41 -18.693 -12.952 -5.932
331 2HA GLY 41 2HA GLY 41 -17.934 -12.437 -4.407
332 H ASP 42 H ASP 42 -21.297 -12.380 -5.732
333 HA ASP 42 HA ASP 42 -22.246 -13.183 -3.015
334 1HB ASP 42 1HB ASP 42 -23.540 -11.568 -4.322
335 2HB ASP 42 2HB ASP 42 -23.572 -12.678 -5.725
336 HD2 ASP 42 HD2 ASP 42 -26.549 -13.941 -4.344
337 H GLU 43 H GLU 43 -21.175 -15.266 -2.925
338 HA GLU 43 HA GLU 43 -21.904 -17.307 -4.979
339 1HB GLU 43 1HB GLU 43 -20.731 -18.800 -3.201
340 2HB GLU 43 2HB GLU 43 -19.745 -17.481 -3.850
341 1HG GLU 43 1HG GLU 43 -21.280 -16.522 -1.594
342 2HG GLU 43 2HG GLU 43 -20.385 -17.997 -1.143
343 HE2 GLU 43 HE2 GLU 43 -17.869 -15.336 -2.644
344 H ALA 44 H ALA 44 -24.292 -16.167 -3.989
345 HA ALA 44 HA ALA 44 -25.321 -17.937 -1.844
346 1HB ALA 44 1HB ALA 44 -26.681 -16.113 -3.919
347 2HB ALA 44 2HB ALA 44 -27.475 -16.763 -2.466
348 3HB ALA 44 3HB ALA 44 -26.140 -15.596 -2.305
349 H GLN 45 H GLN 45 -24.480 -19.911 -3.133
350 HA GLN 45 HA GLN 45 -26.707 -20.742 -5.039
351 1HB GLN 45 1HB GLN 45 -23.737 -21.558 -4.928
352 2HB GLN 45 2HB GLN 45 -24.901 -22.091 -6.162
353 1HG GLN 45 1HG GLN 45 -24.861 -20.086 -7.263
354 2HG GLN 45 2HG GLN 45 -24.663 -19.146 -5.760
355 1HE2 GLN 45 2HE2 GLN 45 -22.832 -17.915 -6.702
356 2HE2 GLN 45 1HE2 GLN 45 -21.248 -18.710 -6.909
357 H ALA 46 H ALA 46 -27.194 -23.066 -5.015
358 HA ALA 46 HA ALA 46 -26.105 -24.632 -2.798
359 1HB ALA 46 1HB ALA 46 -28.356 -24.799 -1.604
360 2HB ALA 46 2HB ALA 46 -27.723 -23.135 -1.622
361 3HB ALA 46 3HB ALA 46 -29.008 -23.611 -2.758
Contact the webmaster for help, if required. Friday, May 17, 2024 11:18:01 PM GMT (wattos1)