Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
21764 | 2i5o RC | 15160 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H ALA 6 H ALA 6 -10.143 -16.455 0.628
2 HA ALA 6 HA ALA 6 -8.820 -15.698 -1.887
3 1HB ALA 6 1HB ALA 6 -10.774 -17.121 -2.326
4 2HB ALA 6 2HB ALA 6 -11.009 -15.478 -2.933
5 3HB ALA 6 3HB ALA 6 -11.787 -15.983 -1.435
6 H GLU 7 H GLU 7 -10.985 -14.689 0.715
7 HA GLU 7 HA GLU 7 -11.065 -11.971 -0.222
8 1HB GLU 7 1HB GLU 7 -12.136 -13.201 2.308
9 2HB GLU 7 2HB GLU 7 -12.535 -11.596 1.679
10 1HG GLU 7 1HG GLU 7 -13.530 -12.613 -0.276
11 2HG GLU 7 2HG GLU 7 -13.126 -14.211 0.334
12 H ASP 8 H ASP 8 -8.518 -12.409 0.152
13 HA ASP 8 HA ASP 8 -7.794 -11.466 2.859
14 1HB ASP 8 1HB ASP 8 -5.995 -12.536 0.681
15 2HB ASP 8 2HB ASP 8 -5.499 -12.053 2.309
16 H GLN 9 H GLN 9 -8.879 -9.902 0.456
17 HA GLN 9 HA GLN 9 -6.640 -8.157 0.189
18 1HB GLN 9 1HB GLN 9 -9.412 -7.918 -1.010
19 2HB GLN 9 2HB GLN 9 -7.999 -6.946 -1.431
20 1HG GLN 9 1HG GLN 9 -6.911 -8.893 -2.318
21 2HG GLN 9 2HG GLN 9 -8.300 -9.901 -1.868
22 1HE2 GLN 9 1HE2 GLN 9 -10.236 -9.599 -2.954
23 2HE2 GLN 9 2HE2 GLN 9 -10.294 -8.846 -4.523
24 H VAL 10 H VAL 10 -6.412 -6.733 1.743
25 HA VAL 10 HA VAL 10 -8.795 -5.853 3.152
26 HB VAL 10 HB VAL 10 -7.196 -5.095 4.975
27 1HG1 VAL 10 1HG1 VAL 10 -7.201 -8.034 4.296
28 2HG1 VAL 10 2HG1 VAL 10 -8.452 -7.164 5.192
29 3HG1 VAL 10 3HG1 VAL 10 -6.840 -7.352 5.882
30 1HG2 VAL 10 1HG2 VAL 10 -5.210 -6.775 3.437
31 2HG2 VAL 10 2HG2 VAL 10 -4.942 -6.046 5.024
32 3HG2 VAL 10 3HG2 VAL 10 -5.159 -5.024 3.601
33 HA PRO 11 HA PRO 11 -8.360 -2.049 1.206
34 1HB PRO 11 1HB PRO 11 -9.241 -0.357 3.037
35 2HB PRO 11 2HB PRO 11 -10.338 -1.324 2.036
36 1HG PRO 11 1HG PRO 11 -9.497 -1.734 4.889
37 2HG PRO 11 2HG PRO 11 -11.061 -2.105 4.122
38 1HD PRO 11 1HD PRO 11 -9.184 -3.995 4.685
39 2HD PRO 11 2HD PRO 11 -10.325 -4.128 3.334
40 H CYS 12 H CYS 12 -6.616 -0.971 0.905
41 HA CYS 12 HA CYS 12 -4.636 -0.602 2.884
42 1HB CYS 12 1HB CYS 12 -3.980 -0.932 0.614
43 2HB CYS 12 2HB CYS 12 -4.969 0.431 0.087
44 H GLU 13 H GLU 13 -4.903 0.896 4.386
45 HA GLU 13 HA GLU 13 -6.881 2.830 4.543
46 1HB GLU 13 1HB GLU 13 -4.244 2.843 5.982
47 2HB GLU 13 2HB GLU 13 -5.708 3.677 6.478
48 1HG GLU 13 1HG GLU 13 -6.839 1.574 6.813
49 2HG GLU 13 2HG GLU 13 -5.435 0.696 6.212
50 H LYS 14 H LYS 14 -3.780 3.092 3.080
51 HA LYS 14 HA LYS 14 -3.868 5.919 3.045
52 1HB LYS 14 1HB LYS 14 -1.935 3.930 2.185
53 2HB LYS 14 2HB LYS 14 -1.781 5.417 1.275
54 1HG LYS 14 1HG LYS 14 -1.656 6.590 3.500
55 2HG LYS 14 2HG LYS 14 -1.593 4.997 4.258
56 1HD LYS 14 1HD LYS 14 0.439 4.477 3.101
57 2HD LYS 14 2HD LYS 14 0.318 5.957 2.142
58 1HE LYS 14 1HE LYS 14 0.619 5.913 5.144
59 2HE LYS 14 2HE LYS 14 1.960 6.094 4.011
60 1HZ LYS 14 1HZ LYS 14 0.941 8.125 3.180
61 2HZ LYS 14 2HZ LYS 14 1.235 8.232 4.824
62 3HZ LYS 14 3HZ LYS 14 -0.337 7.982 4.282
63 H CYS 15 H CYS 15 -5.110 3.657 1.129
64 HA CYS 15 HA CYS 15 -5.740 5.712 -0.910
65 1HB CYS 15 1HB CYS 15 -5.332 4.295 -2.880
66 2HB CYS 15 2HB CYS 15 -3.883 4.582 -1.906
67 H GLY 16 H GLY 16 -6.991 2.822 0.521
68 1HA GLY 16 1HA GLY 16 -9.271 2.435 0.783
69 2HA GLY 16 2HA GLY 16 -9.606 3.481 -0.599
70 H SER 17 H SER 17 -7.174 1.656 -1.633
71 HA SER 17 HA SER 17 -8.848 -0.034 -3.223
72 1HB SER 17 1HB SER 17 -5.845 0.021 -2.885
73 2HB SER 17 2HB SER 17 -6.708 -0.731 -4.235
74 HG SER 17 HG SER 17 -7.593 1.527 -4.471
75 H LEU 18 H LEU 18 -9.222 -2.191 -2.908
76 HA LEU 18 HA LEU 18 -8.429 -3.436 -0.406
77 1HB LEU 18 1HB LEU 18 -9.901 -4.496 -2.804
78 2HB LEU 18 2HB LEU 18 -9.638 -5.403 -1.319
79 HG LEU 18 HG LEU 18 -11.230 -2.849 -1.488
80 1HD1 LEU 18 1HD1 LEU 18 -12.334 -4.675 -2.716
81 2HD1 LEU 18 2HD1 LEU 18 -13.193 -4.306 -1.218
82 3HD1 LEU 18 3HD1 LEU 18 -12.150 -5.723 -1.310
83 1HD2 LEU 18 1HD2 LEU 18 -10.262 -3.234 0.694
84 2HD2 LEU 18 2HD2 LEU 18 -10.870 -4.889 0.693
85 3HD2 LEU 18 3HD2 LEU 18 -11.999 -3.540 0.750
86 H VAL 19 H VAL 19 -6.490 -4.034 -0.229
87 HA VAL 19 HA VAL 19 -5.104 -5.063 -2.622
88 HB VAL 19 HB VAL 19 -3.846 -3.882 -0.137
89 1HG1 VAL 19 1HG1 VAL 19 -2.596 -4.607 -2.781
90 2HG1 VAL 19 2HG1 VAL 19 -2.368 -5.452 -1.253
91 3HG1 VAL 19 3HG1 VAL 19 -1.780 -3.799 -1.444
92 1HG2 VAL 19 1HG2 VAL 19 -5.077 -2.183 -1.324
93 2HG2 VAL 19 2HG2 VAL 19 -4.306 -2.643 -2.840
94 3HG2 VAL 19 3HG2 VAL 19 -3.344 -1.926 -1.545
95 HA PRO 20 HA PRO 20 -5.018 -9.110 -0.757
96 1HB PRO 20 1HB PRO 20 -2.465 -9.256 -2.299
97 2HB PRO 20 2HB PRO 20 -3.811 -10.410 -2.261
98 1HG PRO 20 1HG PRO 20 -3.454 -8.777 -4.338
99 2HG PRO 20 2HG PRO 20 -5.084 -9.164 -3.738
100 1HD PRO 20 1HD PRO 20 -3.487 -6.663 -3.423
101 2HD PRO 20 2HD PRO 20 -5.244 -6.893 -3.577
102 H VAL 21 H VAL 21 -4.314 -9.583 1.142
103 HA VAL 21 HA VAL 21 -2.732 -8.107 2.753
104 HB VAL 21 HB VAL 21 -4.417 -9.929 3.254
105 1HG1 VAL 21 1HG1 VAL 21 -3.640 -12.157 3.824
106 2HG1 VAL 21 2HG1 VAL 21 -2.068 -11.751 3.137
107 3HG1 VAL 21 3HG1 VAL 21 -3.489 -11.778 2.104
108 1HG2 VAL 21 1HG2 VAL 21 -1.974 -9.839 5.004
109 2HG2 VAL 21 2HG2 VAL 21 -3.604 -10.419 5.441
110 3HG2 VAL 21 3HG2 VAL 21 -3.360 -8.727 5.025
111 H TRP 22 H TRP 22 -1.612 -10.855 0.807
112 HA TRP 22 HA TRP 22 1.009 -10.844 1.896
113 1HB TRP 22 1HB TRP 22 1.559 -12.355 -0.049
114 2HB TRP 22 2HB TRP 22 0.220 -12.892 0.971
115 HD1 TRP 22 HD1 TRP 22 0.921 -11.440 -2.518
116 HE1 TRP 22 HE1 TRP 22 -1.111 -11.921 -4.001
117 HE3 TRP 22 HE3 TRP 22 -2.190 -13.387 0.989
118 HZ2 TRP 22 HZ2 TRP 22 -3.713 -13.003 -3.729
119 HZ3 TRP 22 HZ3 TRP 22 -4.451 -14.126 0.287
120 HH2 TRP 22 HH2 TRP 22 -5.168 -13.931 -2.019
121 H ASP 23 H ASP 23 -0.455 -8.783 -0.436
122 HA ASP 23 HA ASP 23 2.170 -7.967 -1.484
123 1HB ASP 23 1HB ASP 23 -0.643 -7.481 -2.432
124 2HB ASP 23 2HB ASP 23 0.678 -6.403 -2.908
125 H MET 24 H MET 24 0.227 -7.323 1.055
126 HA MET 24 HA MET 24 0.114 -4.587 1.112
127 1HB MET 24 1HB MET 24 0.065 -6.611 3.234
128 2HB MET 24 2HB MET 24 0.418 -4.948 3.729
129 1HG MET 24 1HG MET 24 -1.962 -5.915 2.177
130 2HG MET 24 2HG MET 24 -1.946 -5.347 3.860
131 1HE MET 24 1HE MET 24 -3.858 -2.564 1.895
132 2HE MET 24 2HE MET 24 -3.837 -3.521 3.371
133 3HE MET 24 3HE MET 24 -3.896 -4.335 1.799
134 HA PRO 25 HA PRO 25 4.510 -4.302 3.236
135 1HB PRO 25 1HB PRO 25 6.218 -6.187 2.031
136 2HB PRO 25 2HB PRO 25 5.666 -6.217 3.714
137 1HG PRO 25 1HG PRO 25 4.698 -7.751 1.363
138 2HG PRO 25 2HG PRO 25 4.725 -8.212 3.070
139 1HD PRO 25 1HD PRO 25 2.473 -7.482 1.764
140 2HD PRO 25 2HD PRO 25 2.674 -7.165 3.496
141 H GLU 26 H GLU 26 4.463 -5.860 0.085
142 HA GLU 26 HA GLU 26 6.206 -4.227 -1.338
143 1HB GLU 26 1HB GLU 26 3.842 -5.888 -2.077
144 2HB GLU 26 2HB GLU 26 4.866 -5.216 -3.329
145 1HG GLU 26 1HG GLU 26 5.546 -7.217 -1.190
146 2HG GLU 26 2HG GLU 26 5.558 -7.443 -2.949
147 H HIS 27 H HIS 27 2.731 -4.007 -1.133
148 HA HIS 27 HA HIS 27 2.469 -1.748 -2.779
149 1HB HIS 27 1HB HIS 27 0.738 -3.376 -2.434
150 2HB HIS 27 2HB HIS 27 0.622 -2.956 -0.730
151 HD1 HIS 27 HD1 HIS 27 -0.906 -2.097 -3.982
152 HD2 HIS 27 HD2 HIS 27 -0.339 -0.331 -0.293
153 HE1 HIS 27 HE1 HIS 27 -2.537 -0.180 -3.882
154 H MET 28 H MET 28 2.578 -2.125 0.745
155 HA MET 28 HA MET 28 2.208 0.617 1.275
156 1HB MET 28 1HB MET 28 3.332 -1.594 2.965
157 2HB MET 28 2HB MET 28 3.280 0.079 3.545
158 1HG MET 28 1HG MET 28 0.935 -1.611 2.697
159 2HG MET 28 2HG MET 28 1.365 -1.154 4.348
160 1HE MET 28 1HE MET 28 1.289 1.314 5.277
161 2HE MET 28 2HE MET 28 0.777 2.713 4.340
162 3HE MET 28 3HE MET 28 2.299 1.912 3.956
163 H ASP 29 H ASP 29 4.997 -1.293 0.537
164 HA ASP 29 HA ASP 29 6.966 0.695 1.209
165 1HB ASP 29 1HB ASP 29 7.549 -1.682 0.983
166 2HB ASP 29 2HB ASP 29 7.037 -1.643 -0.710
167 H TYR 30 H TYR 30 4.972 0.029 -1.562
168 HA TYR 30 HA TYR 30 6.328 1.847 -3.210
169 1HB TYR 30 1HB TYR 30 4.725 0.108 -4.056
170 2HB TYR 30 2HB TYR 30 3.403 1.118 -3.442
171 HD1 TYR 30 HD1 TYR 30 2.372 2.514 -5.021
172 HD2 TYR 30 HD2 TYR 30 6.466 1.489 -5.524
173 HE1 TYR 30 HE1 TYR 30 2.439 3.805 -7.120
174 HE2 TYR 30 HE2 TYR 30 6.539 2.767 -7.615
175 HH TYR 30 HH TYR 30 3.995 4.851 -8.588
176 H HIS 31 H HIS 31 3.629 2.198 -0.959
177 HA HIS 31 HA HIS 31 3.236 4.998 -1.529
178 1HB HIS 31 1HB HIS 31 2.484 3.420 0.944
179 2HB HIS 31 2HB HIS 31 2.290 5.168 0.865
180 HD1 HIS 31 HD1 HIS 31 0.448 6.002 -0.920
181 HD2 HIS 31 HD2 HIS 31 0.459 2.005 0.055
182 HE1 HIS 31 HE1 HIS 31 -1.827 5.116 -1.648
183 H PHE 32 H PHE 32 5.452 3.235 0.610
184 HA PHE 32 HA PHE 32 6.364 5.396 2.045
185 1HB PHE 32 1HB PHE 32 7.369 2.722 1.332
186 2HB PHE 32 2HB PHE 32 8.567 3.887 1.886
187 HD1 PHE 32 HD1 PHE 32 8.152 4.994 4.132
188 HD2 PHE 32 HD2 PHE 32 6.023 1.551 2.838
189 HE1 PHE 32 HE1 PHE 32 7.549 4.497 6.454
190 HE2 PHE 32 HE2 PHE 32 5.410 1.052 5.157
191 HZ PHE 32 HZ PHE 32 6.173 2.527 6.973
192 H ALA 33 H ALA 33 7.701 3.940 -0.882
193 HA ALA 33 HA ALA 33 9.697 5.870 -1.246
194 1HB ALA 33 1HB ALA 33 9.913 4.981 -3.527
195 2HB ALA 33 2HB ALA 33 8.387 4.118 -3.323
196 3HB ALA 33 3HB ALA 33 9.776 3.704 -2.322
197 H LEU 34 H LEU 34 6.507 5.539 -2.705
198 HA LEU 34 HA LEU 34 6.584 7.699 -4.478
199 1HB LEU 34 1HB LEU 34 4.921 5.876 -4.518
200 2HB LEU 34 2HB LEU 34 4.199 6.534 -3.055
201 HG LEU 34 HG LEU 34 3.592 8.576 -4.339
202 1HD1 LEU 34 1HD1 LEU 34 3.718 8.505 -6.774
203 2HD1 LEU 34 2HD1 LEU 34 4.578 6.966 -6.670
204 3HD1 LEU 34 3HD1 LEU 34 5.326 8.436 -6.043
205 1HD2 LEU 34 1HD2 LEU 34 1.779 7.539 -5.583
206 2HD2 LEU 34 2HD2 LEU 34 2.014 6.732 -4.029
207 3HD2 LEU 34 3HD2 LEU 34 2.602 5.983 -5.510
208 H GLU 35 H GLU 35 5.404 7.537 -1.132
209 HA GLU 35 HA GLU 35 4.772 10.349 -1.225
210 1HB GLU 35 1HB GLU 35 4.438 8.277 0.919
211 2HB GLU 35 2HB GLU 35 3.971 9.964 1.120
212 1HG GLU 35 1HG GLU 35 2.353 9.772 -0.647
213 2HG GLU 35 2HG GLU 35 2.910 8.134 -1.026
214 H LEU 36 H LEU 36 7.546 8.536 -0.424
215 HA LEU 36 HA LEU 36 8.553 10.513 1.388
216 1HB LEU 36 1HB LEU 36 9.348 8.149 1.416
217 2HB LEU 36 2HB LEU 36 10.045 8.383 -0.181
218 HG LEU 36 HG LEU 36 11.647 8.320 1.787
219 1HD1 LEU 36 1HD1 LEU 36 11.748 10.785 0.060
220 2HD1 LEU 36 2HD1 LEU 36 12.390 9.193 -0.348
221 3HD1 LEU 36 3HD1 LEU 36 13.095 10.114 0.978
222 1HD2 LEU 36 1HD2 LEU 36 10.473 11.043 2.325
223 2HD2 LEU 36 2HD2 LEU 36 11.922 10.393 3.080
224 3HD2 LEU 36 3HD2 LEU 36 10.357 9.624 3.367
225 H GLN 37 H GLN 37 8.621 9.972 -2.005
226 HA GLN 37 HA GLN 37 10.629 11.887 -2.590
227 1HB GLN 37 1HB GLN 37 8.545 10.619 -4.345
228 2HB GLN 37 2HB GLN 37 9.777 11.735 -4.945
229 1HG GLN 37 1HG GLN 37 10.361 9.144 -3.526
230 2HG GLN 37 2HG GLN 37 10.306 9.338 -5.284
231 1HE2 GLN 37 1HE2 GLN 37 12.411 8.728 -5.493
232 2HE2 GLN 37 2HE2 GLN 37 13.764 9.723 -5.054
233 H LYS 38 H LYS 38 7.598 12.457 -1.434
234 HA LYS 38 HA LYS 38 7.453 15.029 -2.839
235 1HB LYS 38 1HB LYS 38 5.155 15.236 -2.113
236 2HB LYS 38 2HB LYS 38 5.390 13.662 -2.884
237 1HG LYS 38 1HG LYS 38 5.426 12.580 -0.731
238 2HG LYS 38 2HG LYS 38 5.295 14.150 0.085
239 1HD LYS 38 1HD LYS 38 3.132 14.504 -1.028
240 2HD LYS 38 2HD LYS 38 3.263 12.910 -1.761
241 1HE LYS 38 1HE LYS 38 3.278 11.887 0.460
242 2HE LYS 38 2HE LYS 38 3.168 13.483 1.200
243 1HZ LYS 38 1HZ LYS 38 1.127 12.268 -0.581
244 2HZ LYS 38 2HZ LYS 38 1.033 13.790 0.124
245 3HZ LYS 38 3HZ LYS 38 0.989 12.419 1.090
246 H SER 39 H SER 39 8.781 13.778 -0.144
247 HA SER 39 HA SER 39 8.196 16.112 1.510
248 1HB SER 39 1HB SER 39 9.464 13.467 2.266
249 2HB SER 39 2HB SER 39 8.964 14.750 3.371
250 HG SER 39 HG SER 39 6.854 14.348 2.078
Start of MODEL 2
1 H ALA 6 H ALA 6 -10.241 -15.494 1.446
2 HA ALA 6 HA ALA 6 -12.483 -14.162 0.114
3 1HB ALA 6 1HB ALA 6 -12.670 -16.064 2.435
4 2HB ALA 6 2HB ALA 6 -13.175 -16.408 0.777
5 3HB ALA 6 3HB ALA 6 -14.010 -15.165 1.722
6 H GLU 7 H GLU 7 -12.058 -12.197 0.571
7 HA GLU 7 HA GLU 7 -11.928 -10.252 1.645
8 1HB GLU 7 1HB GLU 7 -12.602 -11.847 4.119
9 2HB GLU 7 2HB GLU 7 -12.573 -10.077 4.036
10 1HG GLU 7 1HG GLU 7 -14.413 -11.948 2.563
11 2HG GLU 7 2HG GLU 7 -14.838 -10.857 3.882
12 H ASP 8 H ASP 8 -9.692 -12.136 1.337
13 HA ASP 8 HA ASP 8 -7.827 -11.128 3.416
14 1HB ASP 8 1HB ASP 8 -7.269 -13.146 1.195
15 2HB ASP 8 2HB ASP 8 -6.188 -12.691 2.508
16 H GLN 9 H GLN 9 -9.140 -9.731 1.080
17 HA GLN 9 HA GLN 9 -6.681 -8.391 0.331
18 1HB GLN 9 1HB GLN 9 -9.486 -8.133 -0.812
19 2HB GLN 9 2HB GLN 9 -8.059 -7.253 -1.368
20 1HG GLN 9 1HG GLN 9 -7.086 -9.335 -2.117
21 2HG GLN 9 2HG GLN 9 -8.513 -10.213 -1.542
22 1HE2 GLN 9 1HE2 GLN 9 -7.493 -10.123 -4.187
23 2HE2 GLN 9 2HE2 GLN 9 -8.725 -9.418 -5.191
24 H VAL 10 H VAL 10 -6.346 -6.824 1.765
25 HA VAL 10 HA VAL 10 -8.665 -5.885 3.223
26 HB VAL 10 HB VAL 10 -7.034 -5.108 4.976
27 1HG1 VAL 10 1HG1 VAL 10 -6.561 -7.329 5.885
28 2HG1 VAL 10 2HG1 VAL 10 -6.854 -8.040 4.299
29 3HG1 VAL 10 3HG1 VAL 10 -8.174 -7.267 5.169
30 1HG2 VAL 10 1HG2 VAL 10 -4.739 -5.966 4.936
31 2HG2 VAL 10 2HG2 VAL 10 -5.049 -4.906 3.561
32 3HG2 VAL 10 3HG2 VAL 10 -5.022 -6.655 3.336
33 HA PRO 11 HA PRO 11 -8.309 -2.138 1.107
34 1HB PRO 11 1HB PRO 11 -9.268 -0.424 2.892
35 2HB PRO 11 2HB PRO 11 -10.326 -1.477 1.935
36 1HG PRO 11 1HG PRO 11 -9.434 -1.771 4.783
37 2HG PRO 11 2HG PRO 11 -11.004 -2.178 4.050
38 1HD PRO 11 1HD PRO 11 -9.112 -4.040 4.623
39 2HD PRO 11 2HD PRO 11 -10.254 -4.201 3.269
40 H CYS 12 H CYS 12 -6.690 -0.906 0.815
41 HA CYS 12 HA CYS 12 -4.584 -0.610 2.695
42 1HB CYS 12 1HB CYS 12 -4.071 -0.771 0.390
43 2HB CYS 12 2HB CYS 12 -5.150 0.573 0.004
44 H GLU 13 H GLU 13 -4.484 0.855 4.197
45 HA GLU 13 HA GLU 13 -6.407 2.824 4.800
46 1HB GLU 13 1HB GLU 13 -3.495 2.787 5.587
47 2HB GLU 13 2HB GLU 13 -4.773 3.695 6.365
48 1HG GLU 13 1HG GLU 13 -4.268 1.853 7.754
49 2HG GLU 13 2HG GLU 13 -5.818 1.506 7.001
50 H LYS 14 H LYS 14 -3.547 3.001 2.918
51 HA LYS 14 HA LYS 14 -3.699 5.822 2.890
52 1HB LYS 14 1HB LYS 14 -1.728 3.928 1.773
53 2HB LYS 14 2HB LYS 14 -1.653 5.591 1.204
54 1HG LYS 14 1HG LYS 14 -1.453 6.318 3.559
55 2HG LYS 14 2HG LYS 14 -1.437 4.619 4.042
56 1HD LYS 14 1HD LYS 14 0.564 4.229 2.772
57 2HD LYS 14 2HD LYS 14 0.505 5.870 2.120
58 1HE LYS 14 1HE LYS 14 0.811 5.227 5.049
59 2HE LYS 14 2HE LYS 14 2.156 5.579 3.968
60 1HZ LYS 14 1HZ LYS 14 1.179 7.749 3.525
61 2HZ LYS 14 2HZ LYS 14 1.490 7.565 5.167
62 3HZ LYS 14 3HZ LYS 14 -0.089 7.440 4.601
63 H CYS 15 H CYS 15 -5.179 3.632 1.085
64 HA CYS 15 HA CYS 15 -5.826 5.696 -0.886
65 1HB CYS 15 1HB CYS 15 -5.508 4.406 -2.953
66 2HB CYS 15 2HB CYS 15 -4.008 4.656 -2.055
67 H GLY 16 H GLY 16 -6.975 2.835 0.603
68 1HA GLY 16 1HA GLY 16 -9.204 2.345 0.910
69 2HA GLY 16 2HA GLY 16 -9.616 3.452 -0.408
70 H SER 17 H SER 17 -7.191 1.623 -1.564
71 HA SER 17 HA SER 17 -8.944 -0.010 -3.174
72 1HB SER 17 1HB SER 17 -5.935 0.092 -3.005
73 2HB SER 17 2HB SER 17 -6.846 -0.620 -4.338
74 HG SER 17 HG SER 17 -7.781 1.750 -4.227
75 H LEU 18 H LEU 18 -9.239 -2.198 -2.933
76 HA LEU 18 HA LEU 18 -8.385 -3.482 -0.489
77 1HB LEU 18 1HB LEU 18 -9.799 -4.565 -2.914
78 2HB LEU 18 2HB LEU 18 -9.574 -5.424 -1.390
79 HG LEU 18 HG LEU 18 -11.187 -2.901 -1.724
80 1HD1 LEU 18 1HD1 LEU 18 -12.228 -4.824 -2.847
81 2HD1 LEU 18 2HD1 LEU 18 -13.135 -4.361 -1.405
82 3HD1 LEU 18 3HD1 LEU 18 -12.071 -5.769 -1.365
83 1HD2 LEU 18 1HD2 LEU 18 -10.257 -3.128 0.497
84 2HD2 LEU 18 2HD2 LEU 18 -10.850 -4.781 0.602
85 3HD2 LEU 18 3HD2 LEU 18 -11.992 -3.439 0.540
86 H VAL 19 H VAL 19 -6.460 -4.130 -0.256
87 HA VAL 19 HA VAL 19 -5.041 -5.182 -2.617
88 HB VAL 19 HB VAL 19 -3.784 -4.014 -0.130
89 1HG1 VAL 19 1HG1 VAL 19 -2.543 -4.757 -2.768
90 2HG1 VAL 19 2HG1 VAL 19 -2.344 -5.611 -1.238
91 3HG1 VAL 19 3HG1 VAL 19 -1.716 -3.973 -1.421
92 1HG2 VAL 19 1HG2 VAL 19 -4.983 -2.279 -1.334
93 2HG2 VAL 19 2HG2 VAL 19 -4.162 -2.731 -2.828
94 3HG2 VAL 19 3HG2 VAL 19 -3.240 -2.054 -1.486
95 HA PRO 20 HA PRO 20 -5.172 -9.203 -0.668
96 1HB PRO 20 1HB PRO 20 -2.625 -9.410 -2.206
97 2HB PRO 20 2HB PRO 20 -3.983 -10.550 -2.121
98 1HG PRO 20 1HG PRO 20 -3.647 -8.995 -4.237
99 2HG PRO 20 2HG PRO 20 -5.278 -9.302 -3.589
100 1HD PRO 20 1HD PRO 20 -3.571 -6.861 -3.375
101 2HD PRO 20 2HD PRO 20 -5.339 -7.016 -3.505
102 H VAL 21 H VAL 21 -4.440 -9.799 1.160
103 HA VAL 21 HA VAL 21 -2.818 -8.398 2.829
104 HB VAL 21 HB VAL 21 -4.449 -10.115 3.500
105 1HG1 VAL 21 1HG1 VAL 21 -3.947 -11.897 1.993
106 2HG1 VAL 21 2HG1 VAL 21 -3.842 -12.474 3.657
107 3HG1 VAL 21 3HG1 VAL 21 -2.371 -12.140 2.745
108 1HG2 VAL 21 1HG2 VAL 21 -3.300 -10.999 5.422
109 2HG2 VAL 21 2HG2 VAL 21 -2.925 -9.290 5.169
110 3HG2 VAL 21 3HG2 VAL 21 -1.739 -10.537 4.738
111 H TRP 22 H TRP 22 -1.733 -10.970 0.677
112 HA TRP 22 HA TRP 22 0.896 -10.971 1.750
113 1HB TRP 22 1HB TRP 22 1.440 -12.527 -0.113
114 2HB TRP 22 2HB TRP 22 0.040 -13.008 0.843
115 HD1 TRP 22 HD1 TRP 22 1.025 -11.809 -2.640
116 HE1 TRP 22 HE1 TRP 22 -0.913 -12.253 -4.233
117 HE3 TRP 22 HE3 TRP 22 -2.449 -13.234 0.762
118 HZ2 TRP 22 HZ2 TRP 22 -3.621 -13.119 -4.065
119 HZ3 TRP 22 HZ3 TRP 22 -4.719 -13.866 -0.037
120 HH2 TRP 22 HH2 TRP 22 -5.261 -13.802 -2.400
121 H ASP 23 H ASP 23 -0.601 -8.815 -0.474
122 HA ASP 23 HA ASP 23 2.028 -8.048 -1.575
123 1HB ASP 23 1HB ASP 23 -0.774 -7.605 -2.559
124 2HB ASP 23 2HB ASP 23 0.479 -6.425 -2.954
125 H MET 24 H MET 24 0.029 -7.375 0.909
126 HA MET 24 HA MET 24 -0.099 -4.650 1.002
127 1HB MET 24 1HB MET 24 -0.204 -6.683 3.084
128 2HB MET 24 2HB MET 24 0.222 -5.051 3.634
129 1HG MET 24 1HG MET 24 -2.199 -5.855 2.059
130 2HG MET 24 2HG MET 24 -2.150 -5.300 3.747
131 1HE MET 24 1HE MET 24 -3.848 -2.347 1.839
132 2HE MET 24 2HE MET 24 -3.867 -3.260 3.346
133 3HE MET 24 3HE MET 24 -4.064 -4.106 1.806
134 HA PRO 25 HA PRO 25 4.241 -4.187 3.278
135 1HB PRO 25 1HB PRO 25 5.557 -6.461 1.849
136 2HB PRO 25 2HB PRO 25 5.879 -5.807 3.470
137 1HG PRO 25 1HG PRO 25 4.562 -8.093 3.176
138 2HG PRO 25 2HG PRO 25 4.078 -6.918 4.411
139 1HD PRO 25 1HD PRO 25 2.787 -7.544 1.785
140 2HD PRO 25 2HD PRO 25 2.052 -7.083 3.338
141 H GLU 26 H GLU 26 4.259 -5.803 0.172
142 HA GLU 26 HA GLU 26 6.020 -4.214 -1.277
143 1HB GLU 26 1HB GLU 26 3.663 -5.895 -1.996
144 2HB GLU 26 2HB GLU 26 4.648 -5.181 -3.261
145 1HG GLU 26 1HG GLU 26 5.526 -7.099 -1.113
146 2HG GLU 26 2HG GLU 26 5.325 -7.449 -2.843
147 H HIS 27 H HIS 27 2.520 -3.976 -1.157
148 HA HIS 27 HA HIS 27 2.340 -1.704 -2.799
149 1HB HIS 27 1HB HIS 27 0.574 -3.313 -2.517
150 2HB HIS 27 2HB HIS 27 0.423 -2.912 -0.805
151 HD1 HIS 27 HD1 HIS 27 -0.973 -2.018 -4.090
152 HD2 HIS 27 HD2 HIS 27 -0.520 -0.268 -0.383
153 HE1 HIS 27 HE1 HIS 27 -2.656 -0.121 -4.008
154 H MET 28 H MET 28 2.319 -2.017 0.730
155 HA MET 28 HA MET 28 2.014 0.786 1.175
156 1HB MET 28 1HB MET 28 3.121 -1.291 3.073
157 2HB MET 28 2HB MET 28 2.747 0.379 3.482
158 1HG MET 28 1HG MET 28 0.740 -1.618 2.473
159 2HG MET 28 2HG MET 28 0.951 -1.130 4.157
160 1HE MET 28 1HE MET 28 -0.217 2.553 4.225
161 2HE MET 28 2HE MET 28 1.432 1.944 4.112
162 3HE MET 28 3HE MET 28 0.264 1.139 5.163
163 H ASP 29 H ASP 29 4.772 -1.204 0.507
164 HA ASP 29 HA ASP 29 6.788 0.688 1.267
165 1HB ASP 29 1HB ASP 29 7.290 -1.686 0.925
166 2HB ASP 29 2HB ASP 29 6.730 -1.567 -0.747
167 H TYR 30 H TYR 30 4.920 0.064 -1.600
168 HA TYR 30 HA TYR 30 6.265 1.860 -3.297
169 1HB TYR 30 1HB TYR 30 4.646 0.101 -4.045
170 2HB TYR 30 2HB TYR 30 3.343 1.079 -3.363
171 HD1 TYR 30 HD1 TYR 30 2.436 2.911 -4.586
172 HD2 TYR 30 HD2 TYR 30 5.946 0.967 -5.962
173 HE1 TYR 30 HE1 TYR 30 2.242 4.097 -6.733
174 HE2 TYR 30 HE2 TYR 30 5.760 2.142 -8.107
175 HH TYR 30 HH TYR 30 3.680 4.769 -8.574
176 H HIS 31 H HIS 31 3.455 2.298 -1.176
177 HA HIS 31 HA HIS 31 3.110 5.117 -1.785
178 1HB HIS 31 1HB HIS 31 2.301 3.559 0.670
179 2HB HIS 31 2HB HIS 31 2.095 5.301 0.540
180 HD1 HIS 31 HD1 HIS 31 0.334 6.042 -1.377
181 HD2 HIS 31 HD2 HIS 31 0.306 2.126 -0.136
182 HE1 HIS 31 HE1 HIS 31 -1.935 5.144 -2.072
183 H PHE 32 H PHE 32 5.060 3.331 0.540
184 HA PHE 32 HA PHE 32 5.714 5.394 2.258
185 1HB PHE 32 1HB PHE 32 6.136 2.858 2.418
186 2HB PHE 32 2HB PHE 32 7.584 3.181 1.455
187 HD1 PHE 32 HD1 PHE 32 6.105 3.157 4.676
188 HD2 PHE 32 HD2 PHE 32 9.302 4.791 2.411
189 HE1 PHE 32 HE1 PHE 32 7.286 3.732 6.768
190 HE2 PHE 32 HE2 PHE 32 10.498 5.359 4.486
191 HZ PHE 32 HZ PHE 32 9.489 4.831 6.665
192 H ALA 33 H ALA 33 7.500 4.094 -0.467
193 HA ALA 33 HA ALA 33 9.549 6.099 -0.454
194 1HB ALA 33 1HB ALA 33 8.722 4.273 -2.708
195 2HB ALA 33 2HB ALA 33 9.862 3.860 -1.436
196 3HB ALA 33 3HB ALA 33 10.247 5.147 -2.583
197 H LEU 34 H LEU 34 6.558 5.762 -2.215
198 HA LEU 34 HA LEU 34 6.939 7.868 -4.079
199 1HB LEU 34 1HB LEU 34 5.265 6.097 -4.338
200 2HB LEU 34 2HB LEU 34 4.379 6.739 -2.959
201 HG LEU 34 HG LEU 34 3.923 8.791 -4.259
202 1HD1 LEU 34 1HD1 LEU 34 5.220 7.269 -6.512
203 2HD1 LEU 34 2HD1 LEU 34 5.839 8.741 -5.750
204 3HD1 LEU 34 3HD1 LEU 34 4.328 8.782 -6.661
205 1HD2 LEU 34 1HD2 LEU 34 2.297 7.779 -5.762
206 2HD2 LEU 34 2HD2 LEU 34 2.312 6.971 -4.196
207 3HD2 LEU 34 3HD2 LEU 34 3.093 6.216 -5.587
208 H GLU 35 H GLU 35 5.385 7.773 -0.908
209 HA GLU 35 HA GLU 35 4.687 10.586 -0.955
210 1HB GLU 35 1HB GLU 35 4.420 8.432 1.138
211 2HB GLU 35 2HB GLU 35 3.801 10.074 1.300
212 1HG GLU 35 1HG GLU 35 2.243 9.745 -0.469
213 2HG GLU 35 2HG GLU 35 2.999 8.205 -0.905
214 H LEU 36 H LEU 36 7.361 8.648 0.074
215 HA LEU 36 HA LEU 36 8.308 10.371 2.094
216 1HB LEU 36 1HB LEU 36 9.042 8.068 1.966
217 2HB LEU 36 2HB LEU 36 9.655 8.319 0.337
218 HG LEU 36 HG LEU 36 11.415 9.724 1.224
219 1HD1 LEU 36 1HD1 LEU 36 11.839 9.789 3.647
220 2HD1 LEU 36 2HD1 LEU 36 10.322 8.934 3.930
221 3HD1 LEU 36 3HD1 LEU 36 10.306 10.560 3.242
222 1HD2 LEU 36 1HD2 LEU 36 11.217 7.014 2.506
223 2HD2 LEU 36 2HD2 LEU 36 12.703 7.944 2.311
224 3HD2 LEU 36 3HD2 LEU 36 11.827 7.375 0.889
225 H GLN 37 H GLN 37 8.527 10.296 -1.319
226 HA GLN 37 HA GLN 37 10.701 12.003 -1.790
227 1HB GLN 37 1HB GLN 37 8.187 11.587 -3.383
228 2HB GLN 37 2HB GLN 37 9.588 12.499 -3.962
229 1HG GLN 37 1HG GLN 37 10.947 10.514 -3.850
230 2HG GLN 37 2HG GLN 37 9.592 9.601 -3.162
231 1HE2 GLN 37 1HE2 GLN 37 11.142 9.193 -5.608
232 2HE2 GLN 37 2HE2 GLN 37 9.972 9.195 -6.897
233 H LYS 38 H LYS 38 7.345 12.722 -1.086
234 HA LYS 38 HA LYS 38 7.954 15.571 -1.325
235 1HB LYS 38 1HB LYS 38 5.528 15.934 -1.237
236 2HB LYS 38 2HB LYS 38 5.995 14.863 -2.564
237 1HG LYS 38 1HG LYS 38 5.285 12.931 -1.212
238 2HG LYS 38 2HG LYS 38 4.781 14.043 0.073
239 1HD LYS 38 1HD LYS 38 3.676 13.981 -2.737
240 2HD LYS 38 2HD LYS 38 2.882 13.295 -1.324
241 1HE LYS 38 1HE LYS 38 2.789 15.544 -0.308
242 2HE LYS 38 2HE LYS 38 3.583 16.203 -1.733
243 1HZ LYS 38 1HZ LYS 38 1.703 15.536 -3.069
244 2HZ LYS 38 2HZ LYS 38 1.207 16.533 -1.794
245 3HZ LYS 38 3HZ LYS 38 0.933 14.876 -1.716
246 H SER 39 H SER 39 8.106 13.293 0.990
247 HA SER 39 HA SER 39 7.388 15.211 3.074
248 1HB SER 39 1HB SER 39 7.201 12.194 3.257
249 2HB SER 39 2HB SER 39 6.675 13.360 4.473
250 HG SER 39 HG SER 39 5.574 12.702 1.999
Start of MODEL 3
1 H ALA 6 H ALA 6 -13.468 -16.161 -0.253
2 HA ALA 6 HA ALA 6 -10.727 -15.452 0.306
3 1HB ALA 6 1HB ALA 6 -10.731 -14.449 -1.911
4 2HB ALA 6 2HB ALA 6 -12.467 -14.731 -2.041
5 3HB ALA 6 3HB ALA 6 -11.357 -16.097 -1.964
6 H GLU 7 H GLU 7 -10.829 -14.119 2.039
7 HA GLU 7 HA GLU 7 -11.951 -11.437 1.523
8 1HB GLU 7 1HB GLU 7 -11.689 -12.881 4.158
9 2HB GLU 7 2HB GLU 7 -12.193 -11.203 3.951
10 1HG GLU 7 1HG GLU 7 -14.170 -11.974 2.753
11 2HG GLU 7 2HG GLU 7 -13.656 -13.645 2.998
12 H ASP 8 H ASP 8 -9.307 -12.660 0.985
13 HA ASP 8 HA ASP 8 -7.650 -11.397 3.050
14 1HB ASP 8 1HB ASP 8 -6.753 -13.386 0.921
15 2HB ASP 8 2HB ASP 8 -5.777 -12.723 2.225
16 H GLN 9 H GLN 9 -9.058 -10.077 0.648
17 HA GLN 9 HA GLN 9 -6.686 -8.565 0.073
18 1HB GLN 9 1HB GLN 9 -9.463 -8.504 -1.128
19 2HB GLN 9 2HB GLN 9 -8.211 -7.327 -1.520
20 1HG GLN 9 1HG GLN 9 -6.855 -9.159 -2.430
21 2HG GLN 9 2HG GLN 9 -8.191 -10.277 -2.112
22 1HE2 GLN 9 1HE2 GLN 9 -10.220 -8.272 -2.846
23 2HE2 GLN 9 2HE2 GLN 9 -10.159 -8.161 -4.573
24 H VAL 10 H VAL 10 -6.424 -7.035 1.511
25 HA VAL 10 HA VAL 10 -8.763 -6.146 2.996
26 HB VAL 10 HB VAL 10 -7.135 -5.415 4.791
27 1HG1 VAL 10 1HG1 VAL 10 -8.375 -7.499 4.991
28 2HG1 VAL 10 2HG1 VAL 10 -6.752 -7.688 5.656
29 3HG1 VAL 10 3HG1 VAL 10 -7.134 -8.343 4.064
30 1HG2 VAL 10 1HG2 VAL 10 -5.118 -5.288 3.418
31 2HG2 VAL 10 2HG2 VAL 10 -5.173 -7.032 3.159
32 3HG2 VAL 10 3HG2 VAL 10 -4.881 -6.391 4.774
33 HA PRO 11 HA PRO 11 -8.388 -2.280 1.100
34 1HB PRO 11 1HB PRO 11 -9.481 -0.683 2.901
35 2HB PRO 11 2HB PRO 11 -10.451 -1.783 1.909
36 1HG PRO 11 1HG PRO 11 -9.538 -2.118 4.754
37 2HG PRO 11 2HG PRO 11 -11.115 -2.520 4.035
38 1HD PRO 11 1HD PRO 11 -9.210 -4.377 4.506
39 2HD PRO 11 2HD PRO 11 -10.333 -4.489 3.134
40 H CYS 12 H CYS 12 -6.656 -1.127 0.892
41 HA CYS 12 HA CYS 12 -4.593 -0.805 2.797
42 1HB CYS 12 1HB CYS 12 -4.070 -0.865 0.484
43 2HB CYS 12 2HB CYS 12 -5.217 0.425 0.129
44 H GLU 13 H GLU 13 -4.579 0.577 4.396
45 HA GLU 13 HA GLU 13 -6.579 2.469 4.874
46 1HB GLU 13 1HB GLU 13 -5.002 3.308 6.698
47 2HB GLU 13 2HB GLU 13 -5.526 1.638 6.793
48 1HG GLU 13 1HG GLU 13 -2.919 2.290 5.477
49 2HG GLU 13 2HG GLU 13 -3.037 2.286 7.232
50 H LYS 14 H LYS 14 -3.682 2.817 3.065
51 HA LYS 14 HA LYS 14 -4.012 5.655 3.184
52 1HB LYS 14 1HB LYS 14 -1.823 3.985 2.061
53 2HB LYS 14 2HB LYS 14 -1.934 5.688 1.605
54 1HG LYS 14 1HG LYS 14 -1.893 6.247 4.049
55 2HG LYS 14 2HG LYS 14 -1.577 4.542 4.372
56 1HD LYS 14 1HD LYS 14 0.473 4.649 3.079
57 2HD LYS 14 2HD LYS 14 0.136 6.334 2.649
58 1HE LYS 14 1HE LYS 14 0.277 6.954 5.023
59 2HE LYS 14 2HE LYS 14 0.630 5.280 5.440
60 1HZ LYS 14 1HZ LYS 14 2.651 6.603 5.344
61 2HZ LYS 14 2HZ LYS 14 2.353 7.043 3.756
62 3HZ LYS 14 3HZ LYS 14 2.685 5.450 4.125
63 H CYS 15 H CYS 15 -5.228 3.378 1.267
64 HA CYS 15 HA CYS 15 -6.007 5.494 -0.628
65 1HB CYS 15 1HB CYS 15 -5.565 4.379 -2.745
66 2HB CYS 15 2HB CYS 15 -4.095 4.582 -1.788
67 H GLY 16 H GLY 16 -7.107 2.806 0.928
68 1HA GLY 16 1HA GLY 16 -9.327 2.180 1.192
69 2HA GLY 16 2HA GLY 16 -9.755 3.267 -0.133
70 H SER 17 H SER 17 -7.360 1.491 -1.326
71 HA SER 17 HA SER 17 -9.144 -0.111 -2.910
72 1HB SER 17 1HB SER 17 -6.153 0.196 -2.882
73 2HB SER 17 2HB SER 17 -7.017 -0.656 -4.157
74 HG SER 17 HG SER 17 -8.256 1.499 -4.118
75 H LEU 18 H LEU 18 -9.366 -2.281 -2.833
76 HA LEU 18 HA LEU 18 -8.527 -3.675 -0.452
77 1HB LEU 18 1HB LEU 18 -9.994 -4.607 -2.900
78 2HB LEU 18 2HB LEU 18 -9.794 -5.540 -1.415
79 HG LEU 18 HG LEU 18 -11.261 -2.909 -1.556
80 1HD1 LEU 18 1HD1 LEU 18 -12.330 -5.725 -1.583
81 2HD1 LEU 18 2HD1 LEU 18 -12.477 -4.522 -2.872
82 3HD1 LEU 18 3HD1 LEU 18 -13.300 -4.277 -1.335
83 1HD2 LEU 18 1HD2 LEU 18 -11.153 -5.041 0.567
84 2HD2 LEU 18 2HD2 LEU 18 -12.098 -3.550 0.632
85 3HD2 LEU 18 3HD2 LEU 18 -10.338 -3.480 0.623
86 H VAL 19 H VAL 19 -6.541 -4.158 -0.363
87 HA VAL 19 HA VAL 19 -5.144 -5.081 -2.780
88 HB VAL 19 HB VAL 19 -4.000 -3.993 -0.203
89 1HG1 VAL 19 1HG1 VAL 19 -2.434 -5.497 -1.267
90 2HG1 VAL 19 2HG1 VAL 19 -1.878 -3.828 -1.430
91 3HG1 VAL 19 3HG1 VAL 19 -2.632 -4.650 -2.797
92 1HG2 VAL 19 1HG2 VAL 19 -5.198 -2.280 -1.402
93 2HG2 VAL 19 2HG2 VAL 19 -4.332 -2.681 -2.884
94 3HG2 VAL 19 3HG2 VAL 19 -3.463 -1.989 -1.515
95 HA PRO 20 HA PRO 20 -5.065 -9.173 -0.994
96 1HB PRO 20 1HB PRO 20 -2.465 -9.308 -2.454
97 2HB PRO 20 2HB PRO 20 -3.830 -10.441 -2.493
98 1HG PRO 20 1HG PRO 20 -3.368 -8.772 -4.525
99 2HG PRO 20 2HG PRO 20 -5.025 -9.153 -4.001
100 1HD PRO 20 1HD PRO 20 -3.405 -6.682 -3.537
101 2HD PRO 20 2HD PRO 20 -5.151 -6.871 -3.803
102 H VAL 21 H VAL 21 -4.397 -9.649 0.913
103 HA VAL 21 HA VAL 21 -2.838 -8.130 2.546
104 HB VAL 21 HB VAL 21 -4.479 -9.796 3.287
105 1HG1 VAL 21 1HG1 VAL 21 -3.885 -12.139 3.600
106 2HG1 VAL 21 2HG1 VAL 21 -2.398 -11.854 2.689
107 3HG1 VAL 21 3HG1 VAL 21 -3.961 -11.651 1.905
108 1HG2 VAL 21 1HG2 VAL 21 -1.793 -10.118 4.602
109 2HG2 VAL 21 2HG2 VAL 21 -3.356 -10.590 5.286
110 3HG2 VAL 21 3HG2 VAL 21 -3.018 -8.887 4.960
111 H TRP 22 H TRP 22 -1.729 -10.823 0.581
112 HA TRP 22 HA TRP 22 0.893 -10.850 1.659
113 1HB TRP 22 1HB TRP 22 1.371 -12.336 -0.386
114 2HB TRP 22 2HB TRP 22 0.198 -12.896 0.813
115 HD1 TRP 22 HD1 TRP 22 0.333 -11.442 -2.750
116 HE1 TRP 22 HE1 TRP 22 -1.833 -12.086 -3.960
117 HE3 TRP 22 HE3 TRP 22 -2.115 -13.627 1.134
118 HZ2 TRP 22 HZ2 TRP 22 -4.298 -13.380 -3.325
119 HZ3 TRP 22 HZ3 TRP 22 -4.378 -14.546 0.744
120 HH2 TRP 22 HH2 TRP 22 -5.421 -14.416 -1.441
121 H ASP 23 H ASP 23 -0.554 -8.682 -0.470
122 HA ASP 23 HA ASP 23 2.006 -7.879 -1.705
123 1HB ASP 23 1HB ASP 23 -0.881 -7.328 -2.349
124 2HB ASP 23 2HB ASP 23 0.383 -6.210 -2.871
125 H MET 24 H MET 24 0.094 -7.277 0.944
126 HA MET 24 HA MET 24 -0.050 -4.548 1.088
127 1HB MET 24 1HB MET 24 -0.079 -6.620 3.160
128 2HB MET 24 2HB MET 24 0.215 -4.959 3.698
129 1HG MET 24 1HG MET 24 -2.108 -5.950 2.083
130 2HG MET 24 2HG MET 24 -2.133 -5.407 3.777
131 1HE MET 24 1HE MET 24 -4.040 -2.596 1.858
132 2HE MET 24 2HE MET 24 -4.017 -3.565 3.329
133 3HE MET 24 3HE MET 24 -4.075 -4.364 1.750
134 HA PRO 25 HA PRO 25 4.248 -4.176 3.437
135 1HB PRO 25 1HB PRO 25 5.620 -6.387 1.974
136 2HB PRO 25 2HB PRO 25 5.875 -5.810 3.632
137 1HG PRO 25 1HG PRO 25 4.566 -8.081 3.179
138 2HG PRO 25 2HG PRO 25 4.035 -6.963 4.449
139 1HD PRO 25 1HD PRO 25 2.863 -7.458 1.744
140 2HD PRO 25 2HD PRO 25 2.062 -7.091 3.289
141 H GLU 26 H GLU 26 4.427 -5.679 0.267
142 HA GLU 26 HA GLU 26 6.231 -3.920 -0.923
143 1HB GLU 26 1HB GLU 26 4.342 -5.988 -1.709
144 2HB GLU 26 2HB GLU 26 4.890 -5.023 -3.056
145 1HG GLU 26 1HG GLU 26 6.238 -7.036 -2.801
146 2HG GLU 26 2HG GLU 26 7.234 -5.635 -2.390
147 H HIS 27 H HIS 27 2.703 -3.932 -1.076
148 HA HIS 27 HA HIS 27 2.441 -1.704 -2.760
149 1HB HIS 27 1HB HIS 27 0.703 -3.329 -2.472
150 2HB HIS 27 2HB HIS 27 0.552 -2.959 -0.758
151 HD1 HIS 27 HD1 HIS 27 -1.031 -2.193 -3.934
152 HD2 HIS 27 HD2 HIS 27 -0.398 -0.229 -0.362
153 HE1 HIS 27 HE1 HIS 27 -2.794 -0.362 -3.821
154 H MET 28 H MET 28 2.287 -1.945 0.774
155 HA MET 28 HA MET 28 1.922 0.869 1.171
156 1HB MET 28 1HB MET 28 3.042 -1.153 3.120
157 2HB MET 28 2HB MET 28 2.549 0.494 3.500
158 1HG MET 28 1HG MET 28 0.712 -1.650 2.454
159 2HG MET 28 2HG MET 28 0.815 -1.108 4.129
160 1HE MET 28 1HE MET 28 -0.615 2.482 4.038
161 2HE MET 28 2HE MET 28 1.065 1.948 4.087
162 3HE MET 28 3HE MET 28 -0.155 1.113 5.047
163 H ASP 29 H ASP 29 4.749 -1.105 0.677
164 HA ASP 29 HA ASP 29 6.642 0.892 1.377
165 1HB ASP 29 1HB ASP 29 7.280 -1.426 1.178
166 2HB ASP 29 2HB ASP 29 6.769 -1.456 -0.516
167 H TYR 30 H TYR 30 4.773 0.189 -1.457
168 HA TYR 30 HA TYR 30 6.181 1.917 -3.186
169 1HB TYR 30 1HB TYR 30 4.506 0.072 -3.810
170 2HB TYR 30 2HB TYR 30 3.253 1.261 -3.421
171 HD1 TYR 30 HD1 TYR 30 3.219 3.426 -4.747
172 HD2 TYR 30 HD2 TYR 30 5.586 0.082 -5.866
173 HE1 TYR 30 HE1 TYR 30 3.411 4.328 -7.014
174 HE2 TYR 30 HE2 TYR 30 5.787 0.973 -8.139
175 HH TYR 30 HH TYR 30 4.952 4.134 -8.929
176 H HIS 31 H HIS 31 3.311 2.431 -1.128
177 HA HIS 31 HA HIS 31 3.035 5.248 -1.875
178 1HB HIS 31 1HB HIS 31 2.138 3.907 0.692
179 2HB HIS 31 2HB HIS 31 1.871 5.609 0.327
180 HD1 HIS 31 HD1 HIS 31 0.200 5.936 -1.883
181 HD2 HIS 31 HD2 HIS 31 0.172 2.349 0.170
182 HE1 HIS 31 HE1 HIS 31 -2.007 4.861 -2.429
183 H PHE 32 H PHE 32 4.947 3.481 0.447
184 HA PHE 32 HA PHE 32 5.670 5.561 2.153
185 1HB PHE 32 1HB PHE 32 5.906 3.004 2.383
186 2HB PHE 32 2HB PHE 32 7.358 3.184 1.397
187 HD1 PHE 32 HD1 PHE 32 9.262 4.570 2.311
188 HD2 PHE 32 HD2 PHE 32 5.899 3.416 4.643
189 HE1 PHE 32 HE1 PHE 32 10.545 5.010 4.365
190 HE2 PHE 32 HE2 PHE 32 7.171 3.870 6.707
191 HZ PHE 32 HZ PHE 32 9.495 4.665 6.566
192 H ALA 33 H ALA 33 7.423 3.969 -0.537
193 HA ALA 33 HA ALA 33 9.543 5.830 -0.611
194 1HB ALA 33 1HB ALA 33 10.208 4.669 -2.642
195 2HB ALA 33 2HB ALA 33 8.629 3.892 -2.735
196 3HB ALA 33 3HB ALA 33 9.724 3.508 -1.404
197 H LEU 34 H LEU 34 6.439 5.717 -2.192
198 HA LEU 34 HA LEU 34 7.013 7.593 -4.249
199 1HB LEU 34 1HB LEU 34 5.080 6.089 -4.315
200 2HB LEU 34 2HB LEU 34 4.392 6.920 -2.930
201 HG LEU 34 HG LEU 34 4.064 8.942 -4.265
202 1HD1 LEU 34 1HD1 LEU 34 5.182 7.325 -6.552
203 2HD1 LEU 34 2HD1 LEU 34 5.943 8.729 -5.802
204 3HD1 LEU 34 3HD1 LEU 34 4.429 8.913 -6.686
205 1HD2 LEU 34 1HD2 LEU 34 2.988 6.463 -5.600
206 2HD2 LEU 34 2HD2 LEU 34 2.316 8.087 -5.740
207 3HD2 LEU 34 3HD2 LEU 34 2.301 7.256 -4.185
208 H GLU 35 H GLU 35 5.705 7.929 -0.971
209 HA GLU 35 HA GLU 35 5.641 10.738 -1.471
210 1HB GLU 35 1HB GLU 35 4.408 9.145 0.735
211 2HB GLU 35 2HB GLU 35 4.392 10.905 0.711
212 1HG GLU 35 1HG GLU 35 3.283 10.840 -1.485
213 2HG GLU 35 2HG GLU 35 3.224 9.073 -1.363
214 H LEU 36 H LEU 36 7.741 8.567 -0.274
215 HA LEU 36 HA LEU 36 8.722 9.516 2.050
216 1HB LEU 36 1HB LEU 36 9.306 7.416 0.882
217 2HB LEU 36 2HB LEU 36 10.357 8.337 -0.191
218 HG LEU 36 HG LEU 36 11.805 8.856 1.670
219 1HD1 LEU 36 1HD1 LEU 36 10.137 8.893 3.480
220 2HD1 LEU 36 2HD1 LEU 36 11.423 7.754 3.864
221 3HD1 LEU 36 3HD1 LEU 36 9.873 7.163 3.279
222 1HD2 LEU 36 1HD2 LEU 36 11.137 5.928 1.452
223 2HD2 LEU 36 2HD2 LEU 36 12.644 6.590 2.083
224 3HD2 LEU 36 3HD2 LEU 36 12.212 6.840 0.392
225 H GLN 37 H GLN 37 9.014 10.830 -1.072
226 HA GLN 37 HA GLN 37 11.300 12.493 -0.735
227 1HB GLN 37 1HB GLN 37 9.084 12.464 -2.771
228 2HB GLN 37 2HB GLN 37 10.333 13.709 -2.770
229 1HG GLN 37 1HG GLN 37 10.783 11.930 -4.393
230 2HG GLN 37 2HG GLN 37 12.040 12.032 -3.152
231 1HE2 GLN 37 1HE2 GLN 37 9.424 10.159 -4.459
232 2HE2 GLN 37 2HE2 GLN 37 9.785 8.713 -3.569
233 H LYS 38 H LYS 38 8.035 12.811 0.322
234 HA LYS 38 HA LYS 38 8.388 15.715 0.662
235 1HB LYS 38 1HB LYS 38 6.003 15.884 1.047
236 2HB LYS 38 2HB LYS 38 6.233 14.879 -0.387
237 1HG LYS 38 1HG LYS 38 5.863 12.879 0.968
238 2HG LYS 38 2HG LYS 38 5.644 13.894 2.398
239 1HD LYS 38 1HD LYS 38 3.483 13.225 1.594
240 2HD LYS 38 2HD LYS 38 3.692 14.939 1.247
241 1HE LYS 38 1HE LYS 38 4.174 14.458 -1.070
242 2HE LYS 38 2HE LYS 38 4.191 12.733 -0.735
243 1HZ LYS 38 1HZ LYS 38 2.101 13.469 -1.735
244 2HZ LYS 38 2HZ LYS 38 1.809 14.476 -0.418
245 3HZ LYS 38 3HZ LYS 38 1.884 12.793 -0.206
246 H SER 39 H SER 39 9.391 13.195 2.234
247 HA SER 39 HA SER 39 8.407 14.010 4.856
248 1HB SER 39 1HB SER 39 9.772 11.433 4.048
249 2HB SER 39 2HB SER 39 9.035 11.783 5.615
250 HG SER 39 HG SER 39 7.488 12.124 3.333
Start of MODEL 4
1 H ALA 6 H ALA 6 -11.529 -12.584 -0.010
2 HA ALA 6 HA ALA 6 -13.355 -12.120 2.252
3 1HB ALA 6 1HB ALA 6 -13.814 -14.225 1.057
4 2HB ALA 6 2HB ALA 6 -13.322 -14.481 2.728
5 3HB ALA 6 3HB ALA 6 -12.176 -14.758 1.421
6 H GLU 7 H GLU 7 -12.032 -10.854 3.500
7 HA GLU 7 HA GLU 7 -10.766 -10.476 5.278
8 1HB GLU 7 1HB GLU 7 -10.437 -13.449 5.286
9 2HB GLU 7 2HB GLU 7 -9.638 -12.419 6.477
10 1HG GLU 7 1HG GLU 7 -11.657 -13.347 7.402
11 2HG GLU 7 2HG GLU 7 -11.835 -11.611 7.203
12 H ASP 8 H ASP 8 -9.127 -12.314 2.926
13 HA ASP 8 HA ASP 8 -6.521 -11.285 3.848
14 1HB ASP 8 1HB ASP 8 -7.124 -13.332 1.696
15 2HB ASP 8 2HB ASP 8 -5.514 -12.822 2.194
16 H GLN 9 H GLN 9 -8.697 -9.866 2.342
17 HA GLN 9 HA GLN 9 -6.734 -8.490 0.835
18 1HB GLN 9 1HB GLN 9 -9.530 -9.028 -0.158
19 2HB GLN 9 2HB GLN 9 -8.513 -7.769 -0.873
20 1HG GLN 9 1HG GLN 9 -6.875 -9.482 -1.453
21 2HG GLN 9 2HG GLN 9 -7.960 -10.707 -0.763
22 1HE2 GLN 9 1HE2 GLN 9 -8.080 -11.733 -2.721
23 2HE2 GLN 9 2HE2 GLN 9 -9.035 -11.095 -4.041
24 H VAL 10 H VAL 10 -6.623 -6.635 1.882
25 HA VAL 10 HA VAL 10 -9.033 -5.576 3.170
26 HB VAL 10 HB VAL 10 -7.539 -4.608 4.954
27 1HG1 VAL 10 1HG1 VAL 10 -8.776 -6.672 5.352
28 2HG1 VAL 10 2HG1 VAL 10 -7.192 -6.731 6.137
29 3HG1 VAL 10 3HG1 VAL 10 -7.458 -7.596 4.626
30 1HG2 VAL 10 1HG2 VAL 10 -5.449 -4.635 3.716
31 2HG2 VAL 10 2HG2 VAL 10 -5.468 -6.399 3.687
32 3HG2 VAL 10 3HG2 VAL 10 -5.285 -5.546 5.219
33 HA PRO 11 HA PRO 11 -8.430 -1.892 0.911
34 1HB PRO 11 1HB PRO 11 -9.339 -0.067 2.662
35 2HB PRO 11 2HB PRO 11 -10.416 -1.051 1.655
36 1HG PRO 11 1HG PRO 11 -9.681 -1.378 4.538
37 2HG PRO 11 2HG PRO 11 -11.235 -1.693 3.732
38 1HD PRO 11 1HD PRO 11 -9.513 -3.667 4.421
39 2HD PRO 11 2HD PRO 11 -10.573 -3.770 2.999
40 H CYS 12 H CYS 12 -6.617 -0.923 0.633
41 HA CYS 12 HA CYS 12 -4.640 -0.607 2.634
42 1HB CYS 12 1HB CYS 12 -3.958 -0.981 0.404
43 2HB CYS 12 2HB CYS 12 -4.949 0.360 -0.183
44 H GLU 13 H GLU 13 -4.673 0.962 4.102
45 HA GLU 13 HA GLU 13 -6.588 2.932 4.225
46 1HB GLU 13 1HB GLU 13 -3.945 2.791 5.647
47 2HB GLU 13 2HB GLU 13 -5.276 3.850 6.092
48 1HG GLU 13 1HG GLU 13 -6.698 1.912 6.494
49 2HG GLU 13 2HG GLU 13 -5.369 0.844 6.044
50 H LYS 14 H LYS 14 -3.393 3.075 2.823
51 HA LYS 14 HA LYS 14 -3.426 5.873 2.716
52 1HB LYS 14 1HB LYS 14 -1.530 3.875 1.559
53 2HB LYS 14 2HB LYS 14 -1.307 5.584 1.211
54 1HG LYS 14 1HG LYS 14 -1.124 6.017 3.633
55 2HG LYS 14 2HG LYS 14 -1.300 4.282 3.929
56 1HD LYS 14 1HD LYS 14 0.704 3.823 2.672
57 2HD LYS 14 2HD LYS 14 0.855 5.535 2.259
58 1HE LYS 14 1HE LYS 14 0.900 4.530 5.104
59 2HE LYS 14 2HE LYS 14 2.358 4.746 4.138
60 1HZ LYS 14 1HZ LYS 14 0.403 6.886 4.790
61 2HZ LYS 14 2HZ LYS 14 1.800 7.062 3.870
62 3HZ LYS 14 3HZ LYS 14 1.922 6.698 5.509
63 H CYS 15 H CYS 15 -4.908 3.771 0.908
64 HA CYS 15 HA CYS 15 -5.374 5.737 -1.265
65 1HB CYS 15 1HB CYS 15 -5.072 4.282 -3.207
66 2HB CYS 15 2HB CYS 15 -3.597 4.461 -2.248
67 H GLY 16 H GLY 16 -6.746 2.990 0.280
68 1HA GLY 16 1HA GLY 16 -9.024 2.691 0.531
69 2HA GLY 16 2HA GLY 16 -9.306 3.706 -0.890
70 H SER 17 H SER 17 -7.006 1.755 -1.970
71 HA SER 17 HA SER 17 -8.831 0.131 -3.452
72 1HB SER 17 1HB SER 17 -5.827 0.072 -3.232
73 2HB SER 17 2HB SER 17 -6.747 -0.678 -4.538
74 HG SER 17 HG SER 17 -7.560 1.793 -4.506
75 H LEU 18 H LEU 18 -9.263 -2.051 -3.141
76 HA LEU 18 HA LEU 18 -8.594 -3.257 -0.587
77 1HB LEU 18 1HB LEU 18 -10.041 -4.348 -2.988
78 2HB LEU 18 2HB LEU 18 -9.936 -5.142 -1.419
79 HG LEU 18 HG LEU 18 -11.291 -2.483 -1.880
80 1HD1 LEU 18 1HD1 LEU 18 -13.395 -3.717 -1.639
81 2HD1 LEU 18 2HD1 LEU 18 -12.503 -5.232 -1.531
82 3HD1 LEU 18 3HD1 LEU 18 -12.488 -4.311 -3.030
83 1HD2 LEU 18 1HD2 LEU 18 -11.289 -4.363 0.473
84 2HD2 LEU 18 2HD2 LEU 18 -12.243 -2.888 0.339
85 3HD2 LEU 18 3HD2 LEU 18 -10.481 -2.799 0.388
86 H VAL 19 H VAL 19 -6.663 -3.933 -0.347
87 HA VAL 19 HA VAL 19 -5.278 -5.108 -2.656
88 HB VAL 19 HB VAL 19 -4.044 -3.808 -0.220
89 1HG1 VAL 19 1HG1 VAL 19 -2.724 -4.758 -2.753
90 2HG1 VAL 19 2HG1 VAL 19 -2.567 -5.491 -1.156
91 3HG1 VAL 19 3HG1 VAL 19 -1.934 -3.870 -1.450
92 1HG2 VAL 19 1HG2 VAL 19 -5.188 -2.177 -1.598
93 2HG2 VAL 19 2HG2 VAL 19 -4.341 -2.771 -3.028
94 3HG2 VAL 19 3HG2 VAL 19 -3.441 -1.979 -1.736
95 HA PRO 20 HA PRO 20 -5.191 -9.068 -0.550
96 1HB PRO 20 1HB PRO 20 -2.741 -9.368 -2.194
97 2HB PRO 20 2HB PRO 20 -4.150 -10.437 -2.061
98 1HG PRO 20 1HG PRO 20 -3.777 -8.939 -4.221
99 2HG PRO 20 2HG PRO 20 -5.405 -9.171 -3.538
100 1HD PRO 20 1HD PRO 20 -3.588 -6.797 -3.324
101 2HD PRO 20 2HD PRO 20 -5.356 -6.881 -3.523
102 H VAL 21 H VAL 21 -4.311 -9.662 1.176
103 HA VAL 21 HA VAL 21 -2.554 -8.271 2.752
104 HB VAL 21 HB VAL 21 -4.088 -9.987 3.590
105 1HG1 VAL 21 1HG1 VAL 21 -3.539 -12.365 3.522
106 2HG1 VAL 21 2HG1 VAL 21 -2.177 -12.001 2.451
107 3HG1 VAL 21 3HG1 VAL 21 -3.818 -11.680 1.918
108 1HG2 VAL 21 1HG2 VAL 21 -2.325 -9.291 5.085
109 2HG2 VAL 21 2HG2 VAL 21 -1.235 -10.504 4.399
110 3HG2 VAL 21 3HG2 VAL 21 -2.674 -11.010 5.292
111 H TRP 22 H TRP 22 -1.684 -10.827 0.459
112 HA TRP 22 HA TRP 22 1.007 -10.921 1.292
113 1HB TRP 22 1HB TRP 22 1.403 -12.187 -0.861
114 2HB TRP 22 2HB TRP 22 0.214 -12.878 0.249
115 HD1 TRP 22 HD1 TRP 22 0.368 -10.912 -3.079
116 HE1 TRP 22 HE1 TRP 22 -1.721 -11.509 -4.440
117 HE3 TRP 22 HE3 TRP 22 -2.025 -13.834 0.362
118 HZ2 TRP 22 HZ2 TRP 22 -4.086 -13.056 -4.100
119 HZ3 TRP 22 HZ3 TRP 22 -4.190 -14.839 -0.259
120 HH2 TRP 22 HH2 TRP 22 -5.173 -14.447 -2.438
121 H ASP 23 H ASP 23 -0.612 -8.656 -0.774
122 HA ASP 23 HA ASP 23 1.892 -7.794 -2.007
123 1HB ASP 23 1HB ASP 23 -0.991 -6.986 -2.297
124 2HB ASP 23 2HB ASP 23 0.325 -6.004 -2.945
125 H MET 24 H MET 24 0.222 -7.313 0.857
126 HA MET 24 HA MET 24 0.131 -4.595 1.064
127 1HB MET 24 1HB MET 24 0.140 -6.708 3.101
128 2HB MET 24 2HB MET 24 0.440 -5.045 3.644
129 1HG MET 24 1HG MET 24 -1.963 -6.083 2.153
130 2HG MET 24 2HG MET 24 -1.883 -5.419 3.793
131 1HE MET 24 1HE MET 24 -3.918 -4.479 1.715
132 2HE MET 24 2HE MET 24 -3.856 -2.711 1.785
133 3HE MET 24 3HE MET 24 -3.814 -3.658 3.281
134 HA PRO 25 HA PRO 25 4.522 -4.289 3.225
135 1HB PRO 25 1HB PRO 25 5.811 -6.488 1.674
136 2HB PRO 25 2HB PRO 25 6.134 -5.938 3.331
137 1HG PRO 25 1HG PRO 25 4.803 -8.194 2.893
138 2HG PRO 25 2HG PRO 25 4.333 -7.101 4.204
139 1HD PRO 25 1HD PRO 25 3.022 -7.543 1.554
140 2HD PRO 25 2HD PRO 25 2.307 -7.191 3.142
141 H GLU 26 H GLU 26 4.654 -5.815 0.036
142 HA GLU 26 HA GLU 26 6.380 -4.092 -1.313
143 1HB GLU 26 1HB GLU 26 4.245 -5.982 -2.022
144 2HB GLU 26 2HB GLU 26 4.809 -4.991 -3.346
145 1HG GLU 26 1HG GLU 26 5.958 -7.085 -3.362
146 2HG GLU 26 2HG GLU 26 7.109 -5.857 -2.822
147 H HIS 27 H HIS 27 2.896 -4.002 -1.202
148 HA HIS 27 HA HIS 27 2.584 -1.746 -2.854
149 1HB HIS 27 1HB HIS 27 0.920 -3.452 -2.515
150 2HB HIS 27 2HB HIS 27 0.748 -3.013 -0.820
151 HD1 HIS 27 HD1 HIS 27 -0.816 -2.332 -4.073
152 HD2 HIS 27 HD2 HIS 27 -0.256 -0.356 -0.496
153 HE1 HIS 27 HE1 HIS 27 -2.546 -0.475 -4.025
154 H MET 28 H MET 28 2.594 -2.072 0.697
155 HA MET 28 HA MET 28 2.094 0.666 1.148
156 1HB MET 28 1HB MET 28 3.427 -1.326 2.985
157 2HB MET 28 2HB MET 28 3.004 0.326 3.449
158 1HG MET 28 1HG MET 28 0.631 -0.272 2.827
159 2HG MET 28 2HG MET 28 1.178 -1.938 2.723
160 1HE MET 28 1HE MET 28 1.180 0.579 6.602
161 2HE MET 28 2HE MET 28 0.757 1.202 5.000
162 3HE MET 28 3HE MET 28 2.421 0.791 5.377
163 H ASP 29 H ASP 29 5.002 -1.127 0.580
164 HA ASP 29 HA ASP 29 6.775 1.003 1.372
165 1HB ASP 29 1HB ASP 29 7.545 -1.313 1.442
166 2HB ASP 29 2HB ASP 29 7.245 -1.476 -0.296
167 H TYR 30 H TYR 30 5.206 0.044 -1.578
168 HA TYR 30 HA TYR 30 6.570 1.848 -3.257
169 1HB TYR 30 1HB TYR 30 5.167 0.091 -4.237
170 2HB TYR 30 2HB TYR 30 3.726 0.802 -3.493
171 HD1 TYR 30 HD1 TYR 30 2.539 2.510 -4.587
172 HD2 TYR 30 HD2 TYR 30 6.394 1.436 -6.007
173 HE1 TYR 30 HE1 TYR 30 2.205 3.945 -6.543
174 HE2 TYR 30 HE2 TYR 30 6.063 2.869 -7.980
175 HH TYR 30 HH TYR 30 4.417 3.942 -9.201
176 H HIS 31 H HIS 31 3.730 2.200 -1.184
177 HA HIS 31 HA HIS 31 3.253 4.969 -1.845
178 1HB HIS 31 1HB HIS 31 2.519 3.425 0.634
179 2HB HIS 31 2HB HIS 31 2.254 5.161 0.509
180 HD1 HIS 31 HD1 HIS 31 0.551 5.789 -1.663
181 HD2 HIS 31 HD2 HIS 31 0.467 1.988 -0.025
182 HE1 HIS 31 HE1 HIS 31 -1.647 4.839 -2.326
183 H PHE 32 H PHE 32 5.369 3.412 0.568
184 HA PHE 32 HA PHE 32 6.079 5.692 1.878
185 1HB PHE 32 1HB PHE 32 7.220 3.019 1.452
186 2HB PHE 32 2HB PHE 32 8.333 4.240 2.058
187 HD1 PHE 32 HD1 PHE 32 5.459 2.124 2.802
188 HD2 PHE 32 HD2 PHE 32 7.921 5.267 4.260
189 HE1 PHE 32 HE1 PHE 32 4.582 1.755 5.065
190 HE2 PHE 32 HE2 PHE 32 7.047 4.904 6.530
191 HZ PHE 32 HZ PHE 32 5.371 3.148 6.936
192 H ALA 33 H ALA 33 7.612 4.185 -0.964
193 HA ALA 33 HA ALA 33 9.579 6.147 -1.294
194 1HB ALA 33 1HB ALA 33 9.726 4.000 -2.411
195 2HB ALA 33 2HB ALA 33 9.814 5.297 -3.602
196 3HB ALA 33 3HB ALA 33 8.317 4.385 -3.398
197 H LEU 34 H LEU 34 6.319 5.842 -2.536
198 HA LEU 34 HA LEU 34 6.319 7.984 -4.356
199 1HB LEU 34 1HB LEU 34 4.651 6.163 -4.273
200 2HB LEU 34 2HB LEU 34 4.017 6.854 -2.780
201 HG LEU 34 HG LEU 34 3.363 8.874 -4.037
202 1HD1 LEU 34 1HD1 LEU 34 4.262 7.284 -6.431
203 2HD1 LEU 34 2HD1 LEU 34 4.982 8.783 -5.836
204 3HD1 LEU 34 3HD1 LEU 34 3.340 8.783 -6.478
205 1HD2 LEU 34 1HD2 LEU 34 1.484 7.849 -5.212
206 2HD2 LEU 34 2HD2 LEU 34 1.762 7.080 -3.652
207 3HD2 LEU 34 3HD2 LEU 34 2.289 6.283 -5.136
208 H GLU 35 H GLU 35 5.467 7.810 -0.918
209 HA GLU 35 HA GLU 35 4.777 10.593 -0.783
210 1HB GLU 35 1HB GLU 35 5.134 8.552 1.419
211 2HB GLU 35 2HB GLU 35 4.515 10.180 1.643
212 1HG GLU 35 1HG GLU 35 2.622 9.631 0.163
213 2HG GLU 35 2HG GLU 35 3.242 7.975 0.038
214 H LEU 36 H LEU 36 7.703 8.766 -0.601
215 HA LEU 36 HA LEU 36 9.154 10.719 0.950
216 1HB LEU 36 1HB LEU 36 9.884 8.399 1.005
217 2HB LEU 36 2HB LEU 36 9.937 8.352 -0.754
218 HG LEU 36 HG LEU 36 11.851 9.848 -0.744
219 1HD1 LEU 36 1HD1 LEU 36 11.403 11.123 1.258
220 2HD1 LEU 36 2HD1 LEU 36 13.001 10.380 1.376
221 3HD1 LEU 36 3HD1 LEU 36 11.633 9.692 2.257
222 1HD2 LEU 36 1HD2 LEU 36 12.151 7.448 1.045
223 2HD2 LEU 36 2HD2 LEU 36 13.477 8.294 0.254
224 3HD2 LEU 36 3HD2 LEU 36 12.250 7.475 -0.718
225 H GLN 37 H GLN 37 8.790 9.805 -2.371
226 HA GLN 37 HA GLN 37 10.343 11.923 -3.480
227 1HB GLN 37 1HB GLN 37 8.074 10.335 -4.663
228 2HB GLN 37 2HB GLN 37 9.112 11.429 -5.583
229 1HG GLN 37 1HG GLN 37 11.033 10.030 -5.056
230 2HG GLN 37 2HG GLN 37 9.986 8.942 -4.128
231 1HE2 GLN 37 1HE2 GLN 37 7.810 9.230 -6.089
232 2HE2 GLN 37 2HE2 GLN 37 8.291 8.265 -7.450
233 H LYS 38 H LYS 38 7.289 11.701 -2.115
234 HA LYS 38 HA LYS 38 5.527 12.982 -1.750
235 1HB LYS 38 1HB LYS 38 5.908 15.319 -1.121
236 2HB LYS 38 2HB LYS 38 7.129 14.248 -0.438
237 1HG LYS 38 1HG LYS 38 8.695 15.036 -2.190
238 2HG LYS 38 2HG LYS 38 7.442 16.170 -2.737
239 1HD LYS 38 1HD LYS 38 7.398 17.174 -0.526
240 2HD LYS 38 2HD LYS 38 8.646 16.053 0.018
241 1HE LYS 38 1HE LYS 38 10.165 16.991 -1.712
242 2HE LYS 38 2HE LYS 38 8.912 18.169 -2.108
243 1HZ LYS 38 1HZ LYS 38 10.194 17.855 0.538
244 2HZ LYS 38 2HZ LYS 38 9.024 19.003 0.152
245 3HZ LYS 38 3HZ LYS 38 10.551 19.081 -0.563
246 H SER 39 H SER 39 5.843 12.259 -4.336
247 HA SER 39 HA SER 39 5.034 14.477 -5.972
248 1HB SER 39 1HB SER 39 5.059 12.634 -7.715
249 2HB SER 39 2HB SER 39 6.604 12.951 -6.913
250 HG SER 39 HG SER 39 4.773 11.040 -6.010
Start of MODEL 5
1 H ALA 6 H ALA 6 -11.150 -14.973 -3.454
2 HA ALA 6 HA ALA 6 -9.359 -15.272 -1.213
3 1HB ALA 6 1HB ALA 6 -8.374 -14.903 -3.426
4 2HB ALA 6 2HB ALA 6 -7.980 -13.568 -2.342
5 3HB ALA 6 3HB ALA 6 -9.235 -13.370 -3.564
6 H GLU 7 H GLU 7 -10.257 -14.458 0.596
7 HA GLU 7 HA GLU 7 -11.433 -11.785 0.402
8 1HB GLU 7 1HB GLU 7 -11.932 -13.850 2.552
9 2HB GLU 7 2HB GLU 7 -12.669 -12.249 2.452
10 1HG GLU 7 1HG GLU 7 -13.533 -12.973 0.183
11 2HG GLU 7 2HG GLU 7 -13.074 -14.602 0.654
12 H ASP 8 H ASP 8 -8.648 -13.016 1.020
13 HA ASP 8 HA ASP 8 -7.959 -11.373 3.372
14 1HB ASP 8 1HB ASP 8 -6.380 -13.424 1.800
15 2HB ASP 8 2HB ASP 8 -5.657 -12.352 3.006
16 H GLN 9 H GLN 9 -8.884 -9.838 1.719
17 HA GLN 9 HA GLN 9 -6.603 -8.547 0.514
18 1HB GLN 9 1HB GLN 9 -9.507 -8.440 -0.343
19 2HB GLN 9 2HB GLN 9 -8.216 -7.473 -1.061
20 1HG GLN 9 1HG GLN 9 -7.168 -9.512 -1.870
21 2HG GLN 9 2HG GLN 9 -8.469 -10.473 -1.144
22 1HE2 GLN 9 1HE2 GLN 9 -10.487 -8.482 -1.845
23 2HE2 GLN 9 2HE2 GLN 9 -10.754 -8.632 -3.547
24 H VAL 10 H VAL 10 -6.229 -6.843 1.837
25 HA VAL 10 HA VAL 10 -8.479 -5.855 3.412
26 HB VAL 10 HB VAL 10 -6.726 -4.990 5.038
27 1HG1 VAL 10 1HG1 VAL 10 -6.346 -7.175 6.089
28 2HG1 VAL 10 2HG1 VAL 10 -6.813 -7.973 4.589
29 3HG1 VAL 10 3HG1 VAL 10 -7.998 -7.024 5.490
30 1HG2 VAL 10 1HG2 VAL 10 -4.808 -5.052 3.502
31 2HG2 VAL 10 2HG2 VAL 10 -4.901 -6.812 3.460
32 3HG2 VAL 10 3HG2 VAL 10 -4.499 -5.986 4.964
33 HA PRO 11 HA PRO 11 -8.086 -2.123 1.282
34 1HB PRO 11 1HB PRO 11 -8.951 -0.348 3.059
35 2HB PRO 11 2HB PRO 11 -10.065 -1.418 2.189
36 1HG PRO 11 1HG PRO 11 -9.029 -1.636 4.992
37 2HG PRO 11 2HG PRO 11 -10.644 -2.039 4.359
38 1HD PRO 11 1HD PRO 11 -8.732 -3.911 4.886
39 2HD PRO 11 2HD PRO 11 -9.971 -4.110 3.632
40 H CYS 12 H CYS 12 -6.458 -0.898 0.921
41 HA CYS 12 HA CYS 12 -4.256 -0.605 2.706
42 1HB CYS 12 1HB CYS 12 -3.884 -0.791 0.349
43 2HB CYS 12 2HB CYS 12 -4.979 0.559 0.037
44 H GLU 13 H GLU 13 -4.305 0.815 4.356
45 HA GLU 13 HA GLU 13 -6.169 2.834 4.812
46 1HB GLU 13 1HB GLU 13 -3.352 2.550 5.826
47 2HB GLU 13 2HB GLU 13 -4.517 3.707 6.452
48 1HG GLU 13 1HG GLU 13 -4.849 0.719 6.477
49 2HG GLU 13 2HG GLU 13 -4.326 1.704 7.841
50 H LYS 14 H LYS 14 -3.283 3.005 2.907
51 HA LYS 14 HA LYS 14 -3.523 5.803 2.909
52 1HB LYS 14 1HB LYS 14 -1.536 3.952 1.933
53 2HB LYS 14 2HB LYS 14 -1.545 5.468 1.046
54 1HG LYS 14 1HG LYS 14 -1.404 6.620 3.300
55 2HG LYS 14 2HG LYS 14 -1.096 5.021 3.982
56 1HD LYS 14 1HD LYS 14 0.872 4.754 2.781
57 2HD LYS 14 2HD LYS 14 0.465 6.060 1.665
58 1HE LYS 14 1HE LYS 14 2.227 6.746 3.231
59 2HE LYS 14 2HE LYS 14 0.761 7.706 3.377
60 1HZ LYS 14 1HZ LYS 14 1.510 5.481 5.194
61 2HZ LYS 14 2HZ LYS 14 0.188 6.546 5.373
62 3HZ LYS 14 3HZ LYS 14 1.767 7.121 5.472
63 H CYS 15 H CYS 15 -4.995 3.550 1.120
64 HA CYS 15 HA CYS 15 -5.747 5.637 -0.784
65 1HB CYS 15 1HB CYS 15 -5.435 4.432 -2.898
66 2HB CYS 15 2HB CYS 15 -3.923 4.668 -2.018
67 H GLY 16 H GLY 16 -6.893 2.914 0.839
68 1HA GLY 16 1HA GLY 16 -9.108 2.383 1.151
69 2HA GLY 16 2HA GLY 16 -9.530 3.435 -0.208
70 H SER 17 H SER 17 -7.134 1.552 -1.285
71 HA SER 17 HA SER 17 -8.948 -0.059 -2.838
72 1HB SER 17 1HB SER 17 -5.960 0.128 -2.780
73 2HB SER 17 2HB SER 17 -6.848 -0.737 -4.032
74 HG SER 17 HG SER 17 -7.797 1.788 -3.714
75 H LEU 18 H LEU 18 -9.313 -2.171 -2.563
76 HA LEU 18 HA LEU 18 -8.394 -3.520 -0.188
77 1HB LEU 18 1HB LEU 18 -10.034 -4.493 -2.515
78 2HB LEU 18 2HB LEU 18 -9.784 -5.369 -1.007
79 HG LEU 18 HG LEU 18 -11.208 -2.717 -1.205
80 1HD1 LEU 18 1HD1 LEU 18 -12.317 -5.509 -0.959
81 2HD1 LEU 18 2HD1 LEU 18 -12.455 -4.460 -2.374
82 3HD1 LEU 18 3HD1 LEU 18 -13.252 -4.015 -0.860
83 1HD2 LEU 18 1HD2 LEU 18 -11.958 -3.253 1.056
84 2HD2 LEU 18 2HD2 LEU 18 -10.200 -3.168 0.972
85 3HD2 LEU 18 3HD2 LEU 18 -11.005 -4.734 1.026
86 H VAL 19 H VAL 19 -6.395 -4.072 -0.266
87 HA VAL 19 HA VAL 19 -5.305 -5.190 -2.762
88 HB VAL 19 HB VAL 19 -3.783 -4.013 -0.411
89 1HG1 VAL 19 1HG1 VAL 19 -2.455 -5.692 -1.572
90 2HG1 VAL 19 2HG1 VAL 19 -1.811 -4.074 -1.840
91 3HG1 VAL 19 3HG1 VAL 19 -2.745 -4.871 -3.107
92 1HG2 VAL 19 1HG2 VAL 19 -4.346 -2.858 -3.132
93 2HG2 VAL 19 2HG2 VAL 19 -3.300 -2.136 -1.913
94 3HG2 VAL 19 3HG2 VAL 19 -5.029 -2.312 -1.603
95 HA PRO 20 HA PRO 20 -5.150 -9.286 -0.957
96 1HB PRO 20 1HB PRO 20 -2.663 -9.352 -2.611
97 2HB PRO 20 2HB PRO 20 -3.966 -10.551 -2.500
98 1HG PRO 20 1HG PRO 20 -3.803 -8.932 -4.599
99 2HG PRO 20 2HG PRO 20 -5.380 -9.331 -3.873
100 1HD PRO 20 1HD PRO 20 -3.787 -6.813 -3.691
101 2HD PRO 20 2HD PRO 20 -5.548 -7.050 -3.717
102 H VAL 21 H VAL 21 -4.389 -9.772 0.882
103 HA VAL 21 HA VAL 21 -2.738 -8.338 2.496
104 HB VAL 21 HB VAL 21 -4.346 -10.168 3.098
105 1HG1 VAL 21 1HG1 VAL 21 -3.598 -11.979 1.800
106 2HG1 VAL 21 2HG1 VAL 21 -3.502 -12.427 3.506
107 3HG1 VAL 21 3HG1 VAL 21 -2.039 -11.993 2.618
108 1HG2 VAL 21 1HG2 VAL 21 -3.083 -9.058 4.803
109 2HG2 VAL 21 2HG2 VAL 21 -1.738 -10.199 4.604
110 3HG2 VAL 21 3HG2 VAL 21 -3.327 -10.755 5.175
111 H TRP 22 H TRP 22 -1.701 -10.908 0.318
112 HA TRP 22 HA TRP 22 0.940 -10.998 1.319
113 1HB TRP 22 1HB TRP 22 1.387 -12.410 -0.762
114 2HB TRP 22 2HB TRP 22 0.187 -12.994 0.391
115 HD1 TRP 22 HD1 TRP 22 0.443 -11.510 -3.158
116 HE1 TRP 22 HE1 TRP 22 -1.719 -12.122 -4.430
117 HE3 TRP 22 HE3 TRP 22 -2.195 -13.585 0.663
118 HZ2 TRP 22 HZ2 TRP 22 -4.218 -13.324 -3.877
119 HZ3 TRP 22 HZ3 TRP 22 -4.480 -14.450 0.201
120 HH2 TRP 22 HH2 TRP 22 -5.441 -14.307 -2.022
121 H ASP 23 H ASP 23 -0.543 -8.760 -0.828
122 HA ASP 23 HA ASP 23 2.049 -7.984 -2.007
123 1HB ASP 23 1HB ASP 23 -0.793 -7.137 -2.619
124 2HB ASP 23 2HB ASP 23 0.623 -6.316 -3.278
125 H MET 24 H MET 24 0.206 -7.382 0.655
126 HA MET 24 HA MET 24 0.126 -4.651 0.809
127 1HB MET 24 1HB MET 24 -0.030 -6.711 2.886
128 2HB MET 24 2HB MET 24 0.341 -5.066 3.423
129 1HG MET 24 1HG MET 24 -2.002 -5.950 1.781
130 2HG MET 24 2HG MET 24 -2.022 -5.378 3.460
131 1HE MET 24 1HE MET 24 -3.744 -3.399 3.068
132 2HE MET 24 2HE MET 24 -3.892 -4.270 1.547
133 3HE MET 24 3HE MET 24 -3.762 -2.504 1.536
134 HA PRO 25 HA PRO 25 4.442 -4.332 3.189
135 1HB PRO 25 1HB PRO 25 5.707 -6.552 1.623
136 2HB PRO 25 2HB PRO 25 6.086 -5.972 3.257
137 1HG PRO 25 1HG PRO 25 4.705 -8.220 2.908
138 2HG PRO 25 2HG PRO 25 4.293 -7.095 4.210
139 1HD PRO 25 1HD PRO 25 2.878 -7.609 1.637
140 2HD PRO 25 2HD PRO 25 2.226 -7.130 3.219
141 H GLU 26 H GLU 26 4.526 -5.798 -0.027
142 HA GLU 26 HA GLU 26 6.243 -4.105 -1.373
143 1HB GLU 26 1HB GLU 26 4.063 -5.948 -2.065
144 2HB GLU 26 2HB GLU 26 4.614 -4.913 -3.367
145 1HG GLU 26 1HG GLU 26 6.334 -6.734 -1.697
146 2HG GLU 26 2HG GLU 26 5.723 -7.091 -3.329
147 H HIS 27 H HIS 27 2.767 -3.951 -1.388
148 HA HIS 27 HA HIS 27 2.546 -1.637 -2.983
149 1HB HIS 27 1HB HIS 27 0.833 -3.285 -2.761
150 2HB HIS 27 2HB HIS 27 0.636 -2.941 -1.049
151 HD1 HIS 27 HD1 HIS 27 -0.943 -2.118 -4.218
152 HD2 HIS 27 HD2 HIS 27 -0.243 -0.192 -0.634
153 HE1 HIS 27 HE1 HIS 27 -2.632 -0.266 -4.094
154 H MET 28 H MET 28 2.373 -2.052 0.513
155 HA MET 28 HA MET 28 1.900 0.684 1.022
156 1HB MET 28 1HB MET 28 2.908 -1.504 2.811
157 2HB MET 28 2HB MET 28 2.673 0.157 3.376
158 1HG MET 28 1HG MET 28 0.568 -1.662 2.222
159 2HG MET 28 2HG MET 28 0.749 -1.223 3.922
160 1HE MET 28 1HE MET 28 -0.137 2.574 3.943
161 2HE MET 28 2HE MET 28 1.468 1.857 3.827
162 3HE MET 28 3HE MET 28 0.267 1.159 4.912
163 H ASP 29 H ASP 29 4.818 -1.153 0.607
164 HA ASP 29 HA ASP 29 6.548 0.965 1.558
165 1HB ASP 29 1HB ASP 29 7.329 -1.374 1.516
166 2HB ASP 29 2HB ASP 29 7.206 -1.372 -0.249
167 H TYR 30 H TYR 30 5.074 0.143 -1.440
168 HA TYR 30 HA TYR 30 6.550 1.906 -3.051
169 1HB TYR 30 1HB TYR 30 4.981 0.097 -3.895
170 2HB TYR 30 2HB TYR 30 3.642 1.163 -3.443
171 HD1 TYR 30 HD1 TYR 30 6.552 0.774 -5.668
172 HD2 TYR 30 HD2 TYR 30 3.031 3.014 -4.848
173 HE1 TYR 30 HE1 TYR 30 6.747 1.866 -7.860
174 HE2 TYR 30 HE2 TYR 30 3.219 4.116 -7.043
175 HH TYR 30 HH TYR 30 5.200 2.968 -9.471
176 H HIS 31 H HIS 31 3.611 2.333 -1.136
177 HA HIS 31 HA HIS 31 3.252 5.144 -1.794
178 1HB HIS 31 1HB HIS 31 2.355 3.610 0.640
179 2HB HIS 31 2HB HIS 31 2.153 5.352 0.487
180 HD1 HIS 31 HD1 HIS 31 0.353 6.127 -1.271
181 HD2 HIS 31 HD2 HIS 31 0.516 2.101 -0.423
182 HE1 HIS 31 HE1 HIS 31 -1.898 5.194 -1.990
183 H PHE 32 H PHE 32 5.097 3.450 0.790
184 HA PHE 32 HA PHE 32 5.664 5.638 2.294
185 1HB PHE 32 1HB PHE 32 6.870 2.987 1.844
186 2HB PHE 32 2HB PHE 32 7.848 4.168 2.706
187 HD1 PHE 32 HD1 PHE 32 5.340 1.674 3.003
188 HD2 PHE 32 HD2 PHE 32 6.674 5.318 4.721
189 HE1 PHE 32 HE1 PHE 32 4.128 1.136 5.059
190 HE2 PHE 32 HE2 PHE 32 5.459 4.787 6.791
191 HZ PHE 32 HZ PHE 32 4.185 2.697 6.963
192 H ALA 33 H ALA 33 7.638 4.175 -0.230
193 HA ALA 33 HA ALA 33 9.620 6.231 -0.174
194 1HB ALA 33 1HB ALA 33 10.082 3.961 -1.009
195 2HB ALA 33 2HB ALA 33 10.522 5.201 -2.180
196 3HB ALA 33 3HB ALA 33 9.035 4.273 -2.392
197 H LEU 34 H LEU 34 6.724 5.764 -2.085
198 HA LEU 34 HA LEU 34 7.230 7.766 -4.041
199 1HB LEU 34 1HB LEU 34 5.562 5.986 -4.340
200 2HB LEU 34 2HB LEU 34 4.589 6.695 -3.052
201 HG LEU 34 HG LEU 34 4.300 8.714 -4.477
202 1HD1 LEU 34 1HD1 LEU 34 6.273 8.500 -5.850
203 2HD1 LEU 34 2HD1 LEU 34 4.822 8.526 -6.860
204 3HD1 LEU 34 3HD1 LEU 34 5.645 6.997 -6.530
205 1HD2 LEU 34 1HD2 LEU 34 2.594 6.979 -4.392
206 2HD2 LEU 34 2HD2 LEU 34 3.412 6.102 -5.689
207 3HD2 LEU 34 3HD2 LEU 34 2.694 7.682 -6.008
208 H GLU 35 H GLU 35 5.360 7.809 -1.033
209 HA GLU 35 HA GLU 35 4.760 10.608 -1.397
210 1HB GLU 35 1HB GLU 35 3.997 8.644 0.746
211 2HB GLU 35 2HB GLU 35 3.474 10.327 0.695
212 1HG GLU 35 1HG GLU 35 2.388 9.935 -1.446
213 2HG GLU 35 2HG GLU 35 2.913 8.245 -1.402
214 H LEU 36 H LEU 36 7.269 8.810 0.017
215 HA LEU 36 HA LEU 36 8.030 10.707 1.981
216 1HB LEU 36 1HB LEU 36 8.818 8.399 2.025
217 2HB LEU 36 2HB LEU 36 9.527 8.580 0.429
218 HG LEU 36 HG LEU 36 11.190 10.078 1.357
219 1HD1 LEU 36 1HD1 LEU 36 9.935 10.981 3.256
220 2HD1 LEU 36 2HD1 LEU 36 11.445 10.266 3.819
221 3HD1 LEU 36 3HD1 LEU 36 9.924 9.395 4.027
222 1HD2 LEU 36 1HD2 LEU 36 11.704 7.739 1.165
223 2HD2 LEU 36 2HD2 LEU 36 10.985 7.418 2.743
224 3HD2 LEU 36 3HD2 LEU 36 12.454 8.387 2.624
225 H GLN 37 H GLN 37 7.951 10.748 -1.387
226 HA GLN 37 HA GLN 37 10.231 12.445 -1.821
227 1HB GLN 37 1HB GLN 37 7.954 11.706 -3.663
228 2HB GLN 37 2HB GLN 37 9.448 12.522 -4.140
229 1HG GLN 37 1HG GLN 37 10.737 10.578 -3.628
230 2HG GLN 37 2HG GLN 37 9.322 9.778 -2.924
231 1HE2 GLN 37 1HE2 GLN 37 9.474 8.057 -4.283
232 2HE2 GLN 37 2HE2 GLN 37 9.078 8.143 -5.975
233 H LYS 38 H LYS 38 7.109 12.972 -0.642
234 HA LYS 38 HA LYS 38 7.393 15.804 -1.233
235 1HB LYS 38 1HB LYS 38 5.014 16.075 -1.862
236 2HB LYS 38 2HB LYS 38 5.977 15.127 -3.001
237 1HG LYS 38 1HG LYS 38 4.991 13.070 -2.101
238 2HG LYS 38 2HG LYS 38 4.027 14.045 -0.974
239 1HD LYS 38 1HD LYS 38 2.713 13.369 -2.946
240 2HD LYS 38 2HD LYS 38 2.906 15.122 -2.869
241 1HE LYS 38 1HE LYS 38 4.659 15.035 -4.540
242 2HE LYS 38 2HE LYS 38 4.611 13.275 -4.531
243 1HZ LYS 38 1HZ LYS 38 2.363 13.397 -5.416
244 2HZ LYS 38 2HZ LYS 38 3.447 14.182 -6.423
245 3HZ LYS 38 3HZ LYS 38 2.434 15.077 -5.433
246 H SER 39 H SER 39 5.846 13.380 0.840
247 HA SER 39 HA SER 39 5.485 15.580 2.699
248 1HB SER 39 1HB SER 39 3.587 14.216 3.669
249 2HB SER 39 2HB SER 39 3.281 14.847 2.052
250 HG SER 39 HG SER 39 4.403 12.315 2.420
Start of MODEL 6
1 H ALA 6 H ALA 6 -13.593 -11.525 -0.269
2 HA ALA 6 HA ALA 6 -10.875 -10.439 -0.550
3 1HB ALA 6 1HB ALA 6 -12.545 -8.775 -1.180
4 2HB ALA 6 2HB ALA 6 -11.683 -8.301 0.287
5 3HB ALA 6 3HB ALA 6 -13.312 -8.959 0.398
6 H GLU 7 H GLU 7 -11.709 -12.712 1.080
7 HA GLU 7 HA GLU 7 -11.877 -11.905 3.800
8 1HB GLU 7 1HB GLU 7 -10.790 -14.510 2.683
9 2HB GLU 7 2HB GLU 7 -11.127 -14.201 4.387
10 1HG GLU 7 1HG GLU 7 -12.893 -15.514 3.585
11 2HG GLU 7 2HG GLU 7 -13.535 -13.878 3.698
12 H ASP 8 H ASP 8 -9.353 -12.404 1.595
13 HA ASP 8 HA ASP 8 -7.399 -11.355 3.557
14 1HB ASP 8 1HB ASP 8 -6.912 -13.515 1.490
15 2HB ASP 8 2HB ASP 8 -5.620 -12.588 2.251
16 H GLN 9 H GLN 9 -9.076 -9.910 1.821
17 HA GLN 9 HA GLN 9 -6.878 -8.563 0.567
18 1HB GLN 9 1HB GLN 9 -9.721 -8.656 -0.473
19 2HB GLN 9 2HB GLN 9 -8.503 -7.516 -1.050
20 1HG GLN 9 1HG GLN 9 -7.149 -9.469 -1.760
21 2HG GLN 9 2HG GLN 9 -8.532 -10.504 -1.350
22 1HE2 GLN 9 1HE2 GLN 9 -10.371 -10.414 -2.627
23 2HE2 GLN 9 2HE2 GLN 9 -10.407 -9.597 -4.144
24 H VAL 10 H VAL 10 -6.552 -6.801 1.711
25 HA VAL 10 HA VAL 10 -8.809 -5.776 3.223
26 HB VAL 10 HB VAL 10 -7.111 -4.919 4.895
27 1HG1 VAL 10 1HG1 VAL 10 -6.789 -7.077 5.991
28 2HG1 VAL 10 2HG1 VAL 10 -7.143 -7.907 4.478
29 3HG1 VAL 10 3HG1 VAL 10 -8.405 -6.981 5.286
30 1HG2 VAL 10 1HG2 VAL 10 -4.884 -5.940 4.913
31 2HG2 VAL 10 2HG2 VAL 10 -5.132 -4.994 3.445
32 3HG2 VAL 10 3HG2 VAL 10 -5.239 -6.752 3.388
33 HA PRO 11 HA PRO 11 -8.325 -2.102 0.925
34 1HB PRO 11 1HB PRO 11 -9.357 -0.354 2.705
35 2HB PRO 11 2HB PRO 11 -10.346 -1.332 1.605
36 1HG PRO 11 1HG PRO 11 -9.781 -1.732 4.510
37 2HG PRO 11 2HG PRO 11 -11.252 -2.105 3.585
38 1HD PRO 11 1HD PRO 11 -9.459 -4.006 4.335
39 2HD PRO 11 2HD PRO 11 -10.439 -4.116 2.861
40 H CYS 12 H CYS 12 -6.659 -0.897 0.724
41 HA CYS 12 HA CYS 12 -4.640 -0.596 2.707
42 1HB CYS 12 1HB CYS 12 -4.052 -0.821 0.417
43 2HB CYS 12 2HB CYS 12 -5.095 0.528 -0.034
44 H GLU 13 H GLU 13 -4.562 0.964 4.177
45 HA GLU 13 HA GLU 13 -6.599 2.897 4.657
46 1HB GLU 13 1HB GLU 13 -3.757 3.139 5.633
47 2HB GLU 13 2HB GLU 13 -5.199 3.802 6.357
48 1HG GLU 13 1HG GLU 13 -4.513 2.026 7.739
49 2HG GLU 13 2HG GLU 13 -5.904 1.426 6.843
50 H LYS 14 H LYS 14 -3.630 3.076 2.948
51 HA LYS 14 HA LYS 14 -3.795 5.867 2.890
52 1HB LYS 14 1HB LYS 14 -1.768 3.961 1.928
53 2HB LYS 14 2HB LYS 14 -1.600 5.616 1.369
54 1HG LYS 14 1HG LYS 14 -1.675 6.317 3.788
55 2HG LYS 14 2HG LYS 14 -1.661 4.610 4.216
56 1HD LYS 14 1HD LYS 14 0.481 4.324 3.146
57 2HD LYS 14 2HD LYS 14 0.445 6.003 2.584
58 1HE LYS 14 1HE LYS 14 1.885 5.781 4.563
59 2HE LYS 14 2HE LYS 14 0.488 6.799 4.894
60 1HZ LYS 14 1HZ LYS 14 0.772 3.946 5.699
61 2HZ LYS 14 2HZ LYS 14 -0.549 4.914 6.057
62 3HZ LYS 14 3HZ LYS 14 0.963 5.271 6.702
63 H CYS 15 H CYS 15 -5.176 3.703 1.032
64 HA CYS 15 HA CYS 15 -5.728 5.736 -1.012
65 1HB CYS 15 1HB CYS 15 -5.365 4.383 -3.024
66 2HB CYS 15 2HB CYS 15 -3.893 4.601 -2.072
67 H GLY 16 H GLY 16 -6.974 3.008 0.589
68 1HA GLY 16 1HA GLY 16 -9.175 2.483 0.862
69 2HA GLY 16 2HA GLY 16 -9.583 3.617 -0.434
70 H SER 17 H SER 17 -7.195 1.738 -1.618
71 HA SER 17 HA SER 17 -9.028 0.146 -3.153
72 1HB SER 17 1HB SER 17 -6.038 0.465 -3.186
73 2HB SER 17 2HB SER 17 -6.918 -0.409 -4.436
74 HG SER 17 HG SER 17 -7.825 1.430 -5.097
75 H LEU 18 H LEU 18 -9.223 -2.050 -3.050
76 HA LEU 18 HA LEU 18 -8.451 -3.407 -0.615
77 1HB LEU 18 1HB LEU 18 -9.811 -4.414 -3.103
78 2HB LEU 18 2HB LEU 18 -9.597 -5.342 -1.621
79 HG LEU 18 HG LEU 18 -11.194 -2.800 -1.812
80 1HD1 LEU 18 1HD1 LEU 18 -12.106 -5.678 -1.763
81 2HD1 LEU 18 2HD1 LEU 18 -12.232 -4.576 -3.138
82 3HD1 LEU 18 3HD1 LEU 18 -13.162 -4.270 -1.669
83 1HD2 LEU 18 1HD2 LEU 18 -12.075 -3.504 0.360
84 2HD2 LEU 18 2HD2 LEU 18 -10.332 -3.253 0.411
85 3HD2 LEU 18 3HD2 LEU 18 -10.985 -4.890 0.347
86 H VAL 19 H VAL 19 -6.544 -4.090 -0.353
87 HA VAL 19 HA VAL 19 -5.081 -5.137 -2.689
88 HB VAL 19 HB VAL 19 -3.902 -4.076 -0.116
89 1HG1 VAL 19 1HG1 VAL 19 -2.435 -5.681 -1.180
90 2HG1 VAL 19 2HG1 VAL 19 -1.767 -4.056 -1.318
91 3HG1 VAL 19 3HG1 VAL 19 -2.554 -4.807 -2.707
92 1HG2 VAL 19 1HG2 VAL 19 -3.228 -2.109 -1.426
93 2HG2 VAL 19 2HG2 VAL 19 -4.981 -2.282 -1.323
94 3HG2 VAL 19 3HG2 VAL 19 -4.138 -2.738 -2.802
95 HA PRO 20 HA PRO 20 -5.212 -9.228 -0.781
96 1HB PRO 20 1HB PRO 20 -2.655 -9.420 -2.310
97 2HB PRO 20 2HB PRO 20 -4.030 -10.545 -2.277
98 1HG PRO 20 1HG PRO 20 -3.636 -8.959 -4.370
99 2HG PRO 20 2HG PRO 20 -5.277 -9.260 -3.750
100 1HD PRO 20 1HD PRO 20 -3.543 -6.836 -3.427
101 2HD PRO 20 2HD PRO 20 -5.304 -6.963 -3.641
102 H VAL 21 H VAL 21 -4.472 -9.687 1.111
103 HA VAL 21 HA VAL 21 -2.873 -8.188 2.687
104 HB VAL 21 HB VAL 21 -4.389 -9.946 3.480
105 1HG1 VAL 21 1HG1 VAL 21 -3.752 -11.759 2.017
106 2HG1 VAL 21 2HG1 VAL 21 -3.691 -12.248 3.710
107 3HG1 VAL 21 3HG1 VAL 21 -2.199 -11.888 2.839
108 1HG2 VAL 21 1HG2 VAL 21 -1.623 -10.108 4.631
109 2HG2 VAL 21 2HG2 VAL 21 -3.102 -10.665 5.419
110 3HG2 VAL 21 3HG2 VAL 21 -2.885 -8.946 5.066
111 H TRP 22 H TRP 22 -1.679 -10.803 0.629
112 HA TRP 22 HA TRP 22 0.913 -10.726 1.773
113 1HB TRP 22 1HB TRP 22 1.520 -12.287 -0.147
114 2HB TRP 22 2HB TRP 22 0.288 -12.824 1.001
115 HD1 TRP 22 HD1 TRP 22 0.638 -11.561 -2.611
116 HE1 TRP 22 HE1 TRP 22 -1.417 -12.361 -3.935
117 HE3 TRP 22 HE3 TRP 22 -2.027 -13.594 1.206
118 HZ2 TRP 22 HZ2 TRP 22 -3.857 -13.701 -3.418
119 HZ3 TRP 22 HZ3 TRP 22 -4.216 -14.621 0.703
120 HH2 TRP 22 HH2 TRP 22 -5.090 -14.659 -1.555
121 H ASP 23 H ASP 23 -0.608 -8.719 -0.522
122 HA ASP 23 HA ASP 23 1.928 -7.962 -1.780
123 1HB ASP 23 1HB ASP 23 -0.965 -7.417 -2.433
124 2HB ASP 23 2HB ASP 23 0.305 -6.343 -3.026
125 H MET 24 H MET 24 0.090 -7.290 0.859
126 HA MET 24 HA MET 24 0.063 -4.562 0.984
127 1HB MET 24 1HB MET 24 0.031 -6.598 3.103
128 2HB MET 24 2HB MET 24 0.417 -4.937 3.590
129 1HG MET 24 1HG MET 24 -2.010 -5.864 2.093
130 2HG MET 24 2HG MET 24 -1.944 -5.300 3.776
131 1HE MET 24 1HE MET 24 -3.930 -4.194 1.821
132 2HE MET 24 2HE MET 24 -3.808 -2.435 1.904
133 3HE MET 24 3HE MET 24 -3.786 -3.394 3.395
134 HA PRO 25 HA PRO 25 4.496 -4.318 3.112
135 1HB PRO 25 1HB PRO 25 5.695 -6.580 1.570
136 2HB PRO 25 2HB PRO 25 6.090 -6.001 3.201
137 1HG PRO 25 1HG PRO 25 4.684 -8.235 2.851
138 2HG PRO 25 2HG PRO 25 4.300 -7.114 4.167
139 1HD PRO 25 1HD PRO 25 2.865 -7.583 1.598
140 2HD PRO 25 2HD PRO 25 2.223 -7.143 3.197
141 H GLU 26 H GLU 26 4.402 -5.883 0.008
142 HA GLU 26 HA GLU 26 6.106 -4.354 -1.608
143 1HB GLU 26 1HB GLU 26 3.484 -5.691 -2.218
144 2HB GLU 26 2HB GLU 26 4.629 -5.185 -3.450
145 1HG GLU 26 1HG GLU 26 5.101 -7.253 -1.319
146 2HG GLU 26 2HG GLU 26 4.700 -7.565 -3.019
147 H HIS 27 H HIS 27 2.641 -3.999 -1.350
148 HA HIS 27 HA HIS 27 2.461 -1.686 -2.964
149 1HB HIS 27 1HB HIS 27 0.686 -3.340 -2.674
150 2HB HIS 27 2HB HIS 27 0.566 -2.935 -0.973
151 HD1 HIS 27 HD1 HIS 27 -0.960 -2.095 -4.180
152 HD2 HIS 27 HD2 HIS 27 -0.369 -0.285 -0.522
153 HE1 HIS 27 HE1 HIS 27 -2.695 -0.238 -4.041
154 H MET 28 H MET 28 2.471 -2.087 0.526
155 HA MET 28 HA MET 28 2.104 0.690 0.984
156 1HB MET 28 1HB MET 28 3.183 -1.368 2.913
157 2HB MET 28 2HB MET 28 2.695 0.276 3.336
158 1HG MET 28 1HG MET 28 0.927 -1.929 2.299
159 2HG MET 28 2HG MET 28 0.922 -1.225 3.914
160 1HE MET 28 1HE MET 28 -0.519 2.334 3.323
161 2HE MET 28 2HE MET 28 1.184 1.894 3.337
162 3HE MET 28 3HE MET 28 0.076 1.153 4.493
163 H ASP 29 H ASP 29 4.907 -1.246 0.336
164 HA ASP 29 HA ASP 29 6.825 0.711 1.219
165 1HB ASP 29 1HB ASP 29 7.473 -1.637 0.953
166 2HB ASP 29 2HB ASP 29 7.015 -1.584 -0.753
167 H TYR 30 H TYR 30 5.117 0.058 -1.755
168 HA TYR 30 HA TYR 30 6.489 1.958 -3.312
169 1HB TYR 30 1HB TYR 30 5.018 0.237 -4.336
170 2HB TYR 30 2HB TYR 30 3.612 1.048 -3.629
171 HD1 TYR 30 HD1 TYR 30 6.424 1.532 -6.018
172 HD2 TYR 30 HD2 TYR 30 2.565 2.808 -4.790
173 HE1 TYR 30 HE1 TYR 30 6.282 2.972 -8.007
174 HE2 TYR 30 HE2 TYR 30 2.404 4.262 -6.784
175 HH TYR 30 HH TYR 30 4.609 4.023 -9.386
176 H HIS 31 H HIS 31 3.589 2.259 -1.288
177 HA HIS 31 HA HIS 31 3.170 5.080 -1.833
178 1HB HIS 31 1HB HIS 31 2.371 3.469 0.598
179 2HB HIS 31 2HB HIS 31 2.165 5.213 0.515
180 HD1 HIS 31 HD1 HIS 31 0.419 5.946 -1.565
181 HD2 HIS 31 HD2 HIS 31 0.309 2.111 -0.059
182 HE1 HIS 31 HE1 HIS 31 -1.855 5.043 -2.183
183 H PHE 32 H PHE 32 5.151 3.318 0.515
184 HA PHE 32 HA PHE 32 5.703 5.456 2.189
185 1HB PHE 32 1HB PHE 32 6.208 2.917 2.416
186 2HB PHE 32 2HB PHE 32 7.708 3.314 1.565
187 HD1 PHE 32 HD1 PHE 32 9.043 5.353 2.618
188 HD2 PHE 32 HD2 PHE 32 6.180 2.974 4.663
189 HE1 PHE 32 HE1 PHE 32 10.018 6.046 4.768
190 HE2 PHE 32 HE2 PHE 32 7.147 3.665 6.825
191 HZ PHE 32 HZ PHE 32 9.060 5.206 6.874
192 H ALA 33 H ALA 33 7.620 4.097 -0.453
193 HA ALA 33 HA ALA 33 9.625 6.095 -0.460
194 1HB ALA 33 1HB ALA 33 9.931 3.883 -1.478
195 2HB ALA 33 2HB ALA 33 10.282 5.178 -2.626
196 3HB ALA 33 3HB ALA 33 8.754 4.301 -2.717
197 H LEU 34 H LEU 34 6.632 5.782 -2.209
198 HA LEU 34 HA LEU 34 6.977 7.965 -4.002
199 1HB LEU 34 1HB LEU 34 5.309 6.222 -4.357
200 2HB LEU 34 2HB LEU 34 4.452 6.744 -2.913
201 HG LEU 34 HG LEU 34 3.888 8.865 -4.012
202 1HD1 LEU 34 1HD1 LEU 34 5.817 9.040 -5.493
203 2HD1 LEU 34 2HD1 LEU 34 4.299 9.168 -6.382
204 3HD1 LEU 34 3HD1 LEU 34 5.220 7.662 -6.424
205 1HD2 LEU 34 1HD2 LEU 34 2.299 7.955 -5.612
206 2HD2 LEU 34 2HD2 LEU 34 2.376 6.968 -4.150
207 3HD2 LEU 34 3HD2 LEU 34 3.177 6.426 -5.624
208 H GLU 35 H GLU 35 5.563 7.719 -0.816
209 HA GLU 35 HA GLU 35 4.906 10.526 -0.816
210 1HB GLU 35 1HB GLU 35 4.504 8.376 1.263
211 2HB GLU 35 2HB GLU 35 3.936 10.037 1.421
212 1HG GLU 35 1HG GLU 35 2.536 9.776 -0.545
213 2HG GLU 35 2HG GLU 35 3.136 8.128 -0.765
214 H LEU 36 H LEU 36 7.561 8.662 -0.111
215 HA LEU 36 HA LEU 36 8.700 10.456 1.842
216 1HB LEU 36 1HB LEU 36 9.185 8.018 1.820
217 2HB LEU 36 2HB LEU 36 9.914 8.202 0.228
218 HG LEU 36 HG LEU 36 11.690 9.565 1.233
219 1HD1 LEU 36 1HD1 LEU 36 11.933 9.624 3.676
220 2HD1 LEU 36 2HD1 LEU 36 10.363 8.836 3.846
221 3HD1 LEU 36 3HD1 LEU 36 10.468 10.453 3.151
222 1HD2 LEU 36 1HD2 LEU 36 11.280 6.867 2.504
223 2HD2 LEU 36 2HD2 LEU 36 12.815 7.729 2.400
224 3HD2 LEU 36 3HD2 LEU 36 12.006 7.185 0.930
225 H GLN 37 H GLN 37 8.207 10.502 -1.471
226 HA GLN 37 HA GLN 37 10.596 11.726 -2.391
227 1HB GLN 37 1HB GLN 37 7.804 11.972 -3.510
228 2HB GLN 37 2HB GLN 37 9.279 12.474 -4.338
229 1HG GLN 37 1HG GLN 37 8.579 9.659 -3.529
230 2HG GLN 37 2HG GLN 37 8.400 10.336 -5.153
231 1HE2 GLN 37 1HE2 GLN 37 10.919 11.820 -5.028
232 2HE2 GLN 37 2HE2 GLN 37 12.161 10.626 -5.150
233 H LYS 38 H LYS 38 7.706 12.954 -1.009
234 HA LYS 38 HA LYS 38 8.973 15.417 -0.339
235 1HB LYS 38 1HB LYS 38 7.276 16.883 -1.459
236 2HB LYS 38 2HB LYS 38 8.300 16.025 -2.610
237 1HG LYS 38 1HG LYS 38 6.472 14.421 -2.998
238 2HG LYS 38 2HG LYS 38 5.463 15.324 -1.858
239 1HD LYS 38 1HD LYS 38 5.677 17.309 -3.336
240 2HD LYS 38 2HD LYS 38 6.572 16.310 -4.488
241 1HE LYS 38 1HE LYS 38 4.625 14.783 -4.620
242 2HE LYS 38 2HE LYS 38 3.753 15.865 -3.539
243 1HZ LYS 38 1HZ LYS 38 3.967 17.620 -5.224
244 2HZ LYS 38 2HZ LYS 38 3.140 16.288 -5.808
245 3HZ LYS 38 3HZ LYS 38 4.733 16.531 -6.262
246 H SER 39 H SER 39 5.948 13.693 -0.719
247 HA SER 39 HA SER 39 5.170 13.175 1.773
248 1HB SER 39 1HB SER 39 4.012 15.838 0.799
249 2HB SER 39 2HB SER 39 3.250 14.853 2.042
250 HG SER 39 HG SER 39 5.900 15.735 2.216
Start of MODEL 7
1 H ALA 6 H ALA 6 -8.101 -14.973 4.996
2 HA ALA 6 HA ALA 6 -9.445 -15.023 7.639
3 1HB ALA 6 1HB ALA 6 -7.170 -15.918 7.769
4 2HB ALA 6 2HB ALA 6 -7.230 -14.317 8.530
5 3HB ALA 6 3HB ALA 6 -6.583 -14.499 6.896
6 H GLU 7 H GLU 7 -10.179 -13.554 5.321
7 HA GLU 7 HA GLU 7 -10.489 -11.585 4.354
8 1HB GLU 7 1HB GLU 7 -9.863 -10.508 7.123
9 2HB GLU 7 2HB GLU 7 -10.422 -9.493 5.786
10 1HG GLU 7 1HG GLU 7 -11.944 -11.811 6.962
11 2HG GLU 7 2HG GLU 7 -12.213 -10.121 7.367
12 H ASP 8 H ASP 8 -8.687 -12.350 3.238
13 HA ASP 8 HA ASP 8 -6.168 -11.161 3.906
14 1HB ASP 8 1HB ASP 8 -6.854 -13.211 1.805
15 2HB ASP 8 2HB ASP 8 -5.219 -12.625 2.120
16 H GLN 9 H GLN 9 -8.601 -10.015 2.496
17 HA GLN 9 HA GLN 9 -7.050 -8.623 0.491
18 1HB GLN 9 1HB GLN 9 -10.022 -9.062 0.549
19 2HB GLN 9 2HB GLN 9 -9.221 -7.984 -0.597
20 1HG GLN 9 1HG GLN 9 -7.966 -9.886 -1.468
21 2HG GLN 9 2HG GLN 9 -8.835 -10.960 -0.356
22 1HE2 GLN 9 1HE2 GLN 9 -8.745 -10.963 -3.269
23 2HE2 GLN 9 2HE2 GLN 9 -10.396 -10.804 -3.780
24 H VAL 10 H VAL 10 -6.531 -6.743 1.577
25 HA VAL 10 HA VAL 10 -8.564 -5.636 3.343
26 HB VAL 10 HB VAL 10 -6.664 -4.724 4.766
27 1HG1 VAL 10 1HG1 VAL 10 -7.947 -6.686 5.465
28 2HG1 VAL 10 2HG1 VAL 10 -6.255 -6.850 5.931
29 3HG1 VAL 10 3HG1 VAL 10 -6.874 -7.728 4.532
30 1HG2 VAL 10 1HG2 VAL 10 -4.866 -4.952 3.122
31 2HG2 VAL 10 2HG2 VAL 10 -5.028 -6.707 3.174
32 3HG2 VAL 10 3HG2 VAL 10 -4.482 -5.826 4.603
33 HA PRO 11 HA PRO 11 -8.240 -2.063 0.805
34 1HB PRO 11 1HB PRO 11 -9.225 -0.272 2.536
35 2HB PRO 11 2HB PRO 11 -10.269 -1.310 1.554
36 1HG PRO 11 1HG PRO 11 -9.485 -1.558 4.437
37 2HG PRO 11 2HG PRO 11 -11.028 -1.972 3.656
38 1HD PRO 11 1HD PRO 11 -9.184 -3.837 4.360
39 2HD PRO 11 2HD PRO 11 -10.257 -4.030 2.957
40 H CYS 12 H CYS 12 -6.565 -0.874 0.528
41 HA CYS 12 HA CYS 12 -4.559 -0.526 2.508
42 1HB CYS 12 1HB CYS 12 -3.911 -0.795 0.246
43 2HB CYS 12 2HB CYS 12 -4.959 0.531 -0.268
44 H GLU 13 H GLU 13 -4.769 0.911 4.093
45 HA GLU 13 HA GLU 13 -6.627 2.942 4.394
46 1HB GLU 13 1HB GLU 13 -5.080 1.899 6.112
47 2HB GLU 13 2HB GLU 13 -3.826 2.970 5.508
48 1HG GLU 13 1HG GLU 13 -4.772 3.918 7.480
49 2HG GLU 13 2HG GLU 13 -5.264 4.894 6.096
50 H LYS 14 H LYS 14 -3.558 3.073 2.778
51 HA LYS 14 HA LYS 14 -3.586 5.884 2.731
52 1HB LYS 14 1HB LYS 14 -1.688 3.883 1.609
53 2HB LYS 14 2HB LYS 14 -1.455 5.578 1.204
54 1HG LYS 14 1HG LYS 14 -1.322 6.093 3.593
55 2HG LYS 14 2HG LYS 14 -1.507 4.376 3.964
56 1HD LYS 14 1HD LYS 14 0.535 3.887 2.742
57 2HD LYS 14 2HD LYS 14 0.690 5.595 2.310
58 1HE LYS 14 1HE LYS 14 0.696 4.565 5.155
59 2HE LYS 14 2HE LYS 14 2.155 4.899 4.227
60 1HZ LYS 14 1HZ LYS 14 1.512 7.212 4.064
61 2HZ LYS 14 2HZ LYS 14 1.533 6.753 5.683
62 3HZ LYS 14 3HZ LYS 14 0.067 6.924 4.895
63 H CYS 15 H CYS 15 -5.041 3.737 0.865
64 HA CYS 15 HA CYS 15 -5.594 5.791 -1.168
65 1HB CYS 15 1HB CYS 15 -5.212 4.500 -3.211
66 2HB CYS 15 2HB CYS 15 -3.750 4.708 -2.238
67 H GLY 16 H GLY 16 -6.879 3.015 0.301
68 1HA GLY 16 1HA GLY 16 -9.121 2.569 0.547
69 2HA GLY 16 2HA GLY 16 -9.485 3.620 -0.824
70 H SER 17 H SER 17 -7.056 1.730 -1.871
71 HA SER 17 HA SER 17 -8.821 0.111 -3.484
72 1HB SER 17 1HB SER 17 -5.826 0.164 -3.246
73 2HB SER 17 2HB SER 17 -6.717 -0.571 -4.580
74 HG SER 17 HG SER 17 -7.610 1.847 -4.505
75 H LEU 18 H LEU 18 -9.087 -2.139 -3.289
76 HA LEU 18 HA LEU 18 -8.320 -3.365 -0.789
77 1HB LEU 18 1HB LEU 18 -9.682 -4.496 -3.226
78 2HB LEU 18 2HB LEU 18 -9.456 -5.347 -1.700
79 HG LEU 18 HG LEU 18 -11.074 -2.831 -2.027
80 1HD1 LEU 18 1HD1 LEU 18 -13.021 -4.328 -1.748
81 2HD1 LEU 18 2HD1 LEU 18 -11.940 -5.719 -1.773
82 3HD1 LEU 18 3HD1 LEU 18 -12.112 -4.710 -3.210
83 1HD2 LEU 18 1HD2 LEU 18 -10.175 -3.120 0.210
84 2HD2 LEU 18 2HD2 LEU 18 -10.817 -4.763 0.273
85 3HD2 LEU 18 3HD2 LEU 18 -11.917 -3.387 0.198
86 H VAL 19 H VAL 19 -6.466 -4.116 -0.439
87 HA VAL 19 HA VAL 19 -4.925 -5.173 -2.711
88 HB VAL 19 HB VAL 19 -3.855 -3.956 -0.155
89 1HG1 VAL 19 1HG1 VAL 19 -1.675 -3.965 -1.257
90 2HG1 VAL 19 2HG1 VAL 19 -2.384 -4.795 -2.640
91 3HG1 VAL 19 3HG1 VAL 19 -2.321 -5.596 -1.067
92 1HG2 VAL 19 1HG2 VAL 19 -3.151 -2.064 -1.550
93 2HG2 VAL 19 2HG2 VAL 19 -4.905 -2.258 -1.519
94 3HG2 VAL 19 3HG2 VAL 19 -3.984 -2.789 -2.924
95 HA PRO 20 HA PRO 20 -5.056 -9.141 -0.598
96 1HB PRO 20 1HB PRO 20 -2.500 -9.527 -2.070
97 2HB PRO 20 2HB PRO 20 -3.947 -10.552 -2.044
98 1HG PRO 20 1HG PRO 20 -3.345 -9.047 -4.166
99 2HG PRO 20 2HG PRO 20 -5.027 -9.295 -3.642
100 1HD PRO 20 1HD PRO 20 -3.269 -6.896 -3.288
101 2HD PRO 20 2HD PRO 20 -5.017 -7.009 -3.594
102 H VAL 21 H VAL 21 -4.243 -9.625 1.229
103 HA VAL 21 HA VAL 21 -2.555 -8.140 2.799
104 HB VAL 21 HB VAL 21 -4.071 -9.961 3.610
105 1HG1 VAL 21 1HG1 VAL 21 -3.358 -11.765 2.182
106 2HG1 VAL 21 2HG1 VAL 21 -3.248 -12.223 3.881
107 3HG1 VAL 21 3HG1 VAL 21 -1.790 -11.802 2.981
108 1HG2 VAL 21 1HG2 VAL 21 -2.721 -10.588 5.563
109 2HG2 VAL 21 2HG2 VAL 21 -2.651 -8.871 5.176
110 3HG2 VAL 21 3HG2 VAL 21 -1.293 -9.927 4.758
111 H TRP 22 H TRP 22 -1.548 -10.702 0.614
112 HA TRP 22 HA TRP 22 1.114 -10.658 1.577
113 1HB TRP 22 1HB TRP 22 1.573 -12.178 -0.428
114 2HB TRP 22 2HB TRP 22 0.468 -12.720 0.843
115 HD1 TRP 22 HD1 TRP 22 0.404 -11.448 -2.800
116 HE1 TRP 22 HE1 TRP 22 -1.755 -12.313 -3.894
117 HE3 TRP 22 HE3 TRP 22 -1.778 -13.549 1.292
118 HZ2 TRP 22 HZ2 TRP 22 -4.094 -13.726 -3.100
119 HZ3 TRP 22 HZ3 TRP 22 -3.973 -14.639 1.036
120 HH2 TRP 22 HH2 TRP 22 -5.088 -14.715 -1.113
121 H ASP 23 H ASP 23 -0.557 -8.552 -0.488
122 HA ASP 23 HA ASP 23 1.800 -7.838 -2.048
123 1HB ASP 23 1HB ASP 23 -1.146 -7.296 -2.246
124 2HB ASP 23 2HB ASP 23 -0.000 -6.150 -2.950
125 H MET 24 H MET 24 0.122 -7.167 0.778
126 HA MET 24 HA MET 24 0.166 -4.437 0.928
127 1HB MET 24 1HB MET 24 0.086 -6.510 2.996
128 2HB MET 24 2HB MET 24 0.556 -4.884 3.522
129 1HG MET 24 1HG MET 24 -1.942 -5.657 2.051
130 2HG MET 24 2HG MET 24 -1.812 -5.116 3.739
131 1HE MET 24 1HE MET 24 -3.771 -3.859 1.790
132 2HE MET 24 2HE MET 24 -3.549 -2.121 1.954
133 3HE MET 24 3HE MET 24 -3.584 -3.150 3.402
134 HA PRO 25 HA PRO 25 4.640 -4.332 2.898
135 1HB PRO 25 1HB PRO 25 5.691 -6.680 1.365
136 2HB PRO 25 2HB PRO 25 6.179 -6.078 2.965
137 1HG PRO 25 1HG PRO 25 4.681 -8.249 2.757
138 2HG PRO 25 2HG PRO 25 4.343 -7.047 4.014
139 1HD PRO 25 1HD PRO 25 2.889 -7.553 1.445
140 2HD PRO 25 2HD PRO 25 2.262 -7.089 3.044
141 H GLU 26 H GLU 26 4.422 -5.909 -0.231
142 HA GLU 26 HA GLU 26 6.144 -4.408 -1.858
143 1HB GLU 26 1HB GLU 26 3.479 -5.657 -2.510
144 2HB GLU 26 2HB GLU 26 4.649 -5.207 -3.737
145 1HG GLU 26 1HG GLU 26 4.952 -7.309 -1.602
146 2HG GLU 26 2HG GLU 26 4.664 -7.576 -3.330
147 H HIS 27 H HIS 27 2.711 -3.942 -1.471
148 HA HIS 27 HA HIS 27 2.509 -1.601 -3.061
149 1HB HIS 27 1HB HIS 27 0.786 -3.280 -2.722
150 2HB HIS 27 2HB HIS 27 0.665 -2.842 -1.024
151 HD1 HIS 27 HD1 HIS 27 -0.852 -2.054 -4.263
152 HD2 HIS 27 HD2 HIS 27 -0.265 -0.183 -0.639
153 HE1 HIS 27 HE1 HIS 27 -2.526 -0.161 -4.190
154 H MET 28 H MET 28 2.633 -2.072 0.438
155 HA MET 28 HA MET 28 2.363 0.683 0.903
156 1HB MET 28 1HB MET 28 3.348 -1.502 2.695
157 2HB MET 28 2HB MET 28 3.422 0.195 3.191
158 1HG MET 28 1HG MET 28 0.975 -1.412 2.502
159 2HG MET 28 2HG MET 28 1.440 -0.788 4.085
160 1HE MET 28 1HE MET 28 -1.425 -0.271 3.224
161 2HE MET 28 2HE MET 28 -1.611 1.468 3.478
162 3HE MET 28 3HE MET 28 -0.705 0.502 4.644
163 H ASP 29 H ASP 29 5.149 -1.315 0.230
164 HA ASP 29 HA ASP 29 7.101 0.682 0.890
165 1HB ASP 29 1HB ASP 29 7.827 -1.611 0.586
166 2HB ASP 29 2HB ASP 29 7.154 -1.644 -1.051
167 H TYR 30 H TYR 30 5.137 0.061 -1.912
168 HA TYR 30 HA TYR 30 6.372 1.971 -3.577
169 1HB TYR 30 1HB TYR 30 4.721 0.308 -4.433
170 2HB TYR 30 2HB TYR 30 3.441 1.171 -3.560
171 HD1 TYR 30 HD1 TYR 30 2.804 3.448 -4.288
172 HD2 TYR 30 HD2 TYR 30 5.535 1.098 -6.503
173 HE1 TYR 30 HE1 TYR 30 2.530 4.977 -6.205
174 HE2 TYR 30 HE2 TYR 30 5.281 2.614 -8.441
175 HH TYR 30 HH TYR 30 3.519 4.220 -9.273
176 H HIS 31 H HIS 31 3.663 2.286 -1.277
177 HA HIS 31 HA HIS 31 3.306 5.096 -1.791
178 1HB HIS 31 1HB HIS 31 2.467 3.478 0.606
179 2HB HIS 31 2HB HIS 31 2.266 5.227 0.556
180 HD1 HIS 31 HD1 HIS 31 0.550 6.040 -1.502
181 HD2 HIS 31 HD2 HIS 31 0.456 2.111 -0.230
182 HE1 HIS 31 HE1 HIS 31 -1.695 5.157 -2.216
183 H PHE 32 H PHE 32 5.266 3.297 0.585
184 HA PHE 32 HA PHE 32 6.008 5.431 2.120
185 1HB PHE 32 1HB PHE 32 7.064 2.730 1.502
186 2HB PHE 32 2HB PHE 32 8.092 3.833 2.410
187 HD1 PHE 32 HD1 PHE 32 4.351 3.315 2.621
188 HD2 PHE 32 HD2 PHE 32 8.133 2.921 4.551
189 HE1 PHE 32 HE1 PHE 32 3.231 2.603 4.668
190 HE2 PHE 32 HE2 PHE 32 6.996 2.202 6.603
191 HZ PHE 32 HZ PHE 32 4.549 2.040 6.665
192 H ALA 33 H ALA 33 7.589 4.010 -0.725
193 HA ALA 33 HA ALA 33 9.737 5.884 -0.838
194 1HB ALA 33 1HB ALA 33 9.801 3.721 -2.014
195 2HB ALA 33 2HB ALA 33 10.082 5.066 -3.122
196 3HB ALA 33 3HB ALA 33 8.509 4.268 -3.082
197 H LEU 34 H LEU 34 6.542 5.844 -2.168
198 HA LEU 34 HA LEU 34 6.726 8.124 -3.860
199 1HB LEU 34 1HB LEU 34 4.931 6.458 -4.005
200 2HB LEU 34 2HB LEU 34 4.333 6.980 -2.434
201 HG LEU 34 HG LEU 34 3.789 9.185 -3.409
202 1HD1 LEU 34 1HD1 LEU 34 5.395 9.261 -5.205
203 2HD1 LEU 34 2HD1 LEU 34 3.759 9.420 -5.849
204 3HD1 LEU 34 3HD1 LEU 34 4.619 7.886 -5.990
205 1HD2 LEU 34 1HD2 LEU 34 1.865 8.423 -4.706
206 2HD2 LEU 34 2HD2 LEU 34 2.092 7.454 -3.248
207 3HD2 LEU 34 3HD2 LEU 34 2.578 6.813 -4.819
208 H GLU 35 H GLU 35 5.829 7.723 -0.482
209 HA GLU 35 HA GLU 35 5.122 10.474 -0.069
210 1HB GLU 35 1HB GLU 35 5.611 8.216 1.886
211 2HB GLU 35 2HB GLU 35 4.990 9.792 2.335
212 1HG GLU 35 1HG GLU 35 2.992 9.406 1.008
213 2HG GLU 35 2HG GLU 35 3.637 7.839 0.482
214 H LEU 36 H LEU 36 7.970 8.522 0.040
215 HA LEU 36 HA LEU 36 9.480 10.241 1.812
216 1HB LEU 36 1HB LEU 36 9.781 7.768 1.768
217 2HB LEU 36 2HB LEU 36 10.285 7.883 0.086
218 HG LEU 36 HG LEU 36 12.287 9.076 0.783
219 1HD1 LEU 36 1HD1 LEU 36 12.901 9.174 3.173
220 2HD1 LEU 36 2HD1 LEU 36 11.302 8.561 3.596
221 3HD1 LEU 36 3HD1 LEU 36 11.465 10.138 2.827
222 1HD2 LEU 36 1HD2 LEU 36 12.357 6.670 0.538
223 2HD2 LEU 36 2HD2 LEU 36 11.841 6.462 2.210
224 3HD2 LEU 36 3HD2 LEU 36 13.413 7.177 1.857
225 H GLN 37 H GLN 37 8.440 10.580 -1.206
226 HA GLN 37 HA GLN 37 10.793 11.872 -2.317
227 1HB GLN 37 1HB GLN 37 7.937 11.737 -3.256
228 2HB GLN 37 2HB GLN 37 9.251 12.493 -4.161
229 1HG GLN 37 1HG GLN 37 10.359 10.332 -4.325
230 2HG GLN 37 2HG GLN 37 9.040 9.589 -3.406
231 1HE2 GLN 37 1HE2 GLN 37 7.034 11.229 -4.729
232 2HE2 GLN 37 2HE2 GLN 37 6.855 10.567 -6.323
233 H LYS 38 H LYS 38 8.182 12.652 -0.285
234 HA LYS 38 HA LYS 38 8.761 15.495 -0.588
235 1HB LYS 38 1HB LYS 38 6.333 16.018 -0.451
236 2HB LYS 38 2HB LYS 38 6.798 15.156 -1.921
237 1HG LYS 38 1HG LYS 38 5.887 13.093 -1.016
238 2HG LYS 38 2HG LYS 38 5.487 13.924 0.498
239 1HD LYS 38 1HD LYS 38 3.504 13.728 -0.871
240 2HD LYS 38 2HD LYS 38 3.979 15.422 -0.771
241 1HE LYS 38 1HE LYS 38 5.061 15.188 -3.009
242 2HE LYS 38 2HE LYS 38 4.470 13.531 -3.071
243 1HZ LYS 38 1HZ LYS 38 3.040 15.074 -4.282
244 2HZ LYS 38 2HZ LYS 38 2.759 15.941 -2.879
245 3HZ LYS 38 3HZ LYS 38 2.213 14.346 -3.013
246 H SER 39 H SER 39 9.613 13.616 1.326
247 HA SER 39 HA SER 39 8.137 13.736 3.707
248 1HB SER 39 1HB SER 39 11.053 13.197 3.182
249 2HB SER 39 2HB SER 39 10.215 12.893 4.707
250 HG SER 39 HG SER 39 9.268 11.230 3.890
Start of MODEL 8
1 H ALA 6 H ALA 6 -9.844 -15.918 1.073
2 HA ALA 6 HA ALA 6 -11.872 -16.773 3.007
3 1HB ALA 6 1HB ALA 6 -8.911 -16.524 3.527
4 2HB ALA 6 2HB ALA 6 -9.818 -18.035 3.418
5 3HB ALA 6 3HB ALA 6 -10.147 -16.900 4.729
6 H GLU 7 H GLU 7 -11.262 -14.430 1.257
7 HA GLU 7 HA GLU 7 -11.481 -12.181 1.240
8 1HB GLU 7 1HB GLU 7 -12.252 -12.525 4.153
9 2HB GLU 7 2HB GLU 7 -12.440 -11.029 3.231
10 1HG GLU 7 1HG GLU 7 -14.040 -12.132 1.766
11 2HG GLU 7 2HG GLU 7 -13.808 -13.647 2.633
12 H ASP 8 H ASP 8 -8.972 -13.060 1.362
13 HA ASP 8 HA ASP 8 -7.515 -11.575 3.461
14 1HB ASP 8 1HB ASP 8 -6.469 -13.399 1.269
15 2HB ASP 8 2HB ASP 8 -5.504 -12.689 2.565
16 H GLN 9 H GLN 9 -8.946 -9.985 1.711
17 HA GLN 9 HA GLN 9 -6.760 -8.687 0.418
18 1HB GLN 9 1HB GLN 9 -9.604 -8.938 -0.562
19 2HB GLN 9 2HB GLN 9 -8.482 -7.740 -1.218
20 1HG GLN 9 1HG GLN 9 -7.084 -9.426 -2.096
21 2HG GLN 9 2HG GLN 9 -7.978 -10.705 -1.258
22 1HE2 GLN 9 1HE2 GLN 9 -8.020 -8.433 -3.940
23 2HE2 GLN 9 2HE2 GLN 9 -9.337 -9.200 -4.755
24 H VAL 10 H VAL 10 -6.473 -6.989 1.676
25 HA VAL 10 HA VAL 10 -8.749 -5.977 3.195
26 HB VAL 10 HB VAL 10 -7.029 -5.169 4.875
27 1HG1 VAL 10 1HG1 VAL 10 -7.165 -8.141 4.361
28 2HG1 VAL 10 2HG1 VAL 10 -8.328 -7.189 5.284
29 3HG1 VAL 10 3HG1 VAL 10 -6.682 -7.394 5.883
30 1HG2 VAL 10 1HG2 VAL 10 -5.065 -5.228 3.414
31 2HG2 VAL 10 2HG2 VAL 10 -5.192 -6.982 3.306
32 3HG2 VAL 10 3HG2 VAL 10 -4.819 -6.221 4.852
33 HA PRO 11 HA PRO 11 -8.253 -2.159 1.132
34 1HB PRO 11 1HB PRO 11 -9.113 -0.457 2.984
35 2HB PRO 11 2HB PRO 11 -10.224 -1.441 2.015
36 1HG PRO 11 1HG PRO 11 -9.297 -1.852 4.841
37 2HG PRO 11 2HG PRO 11 -10.895 -2.175 4.129
38 1HD PRO 11 1HD PRO 11 -9.070 -4.122 4.622
39 2HD PRO 11 2HD PRO 11 -10.243 -4.205 3.292
40 H CYS 12 H CYS 12 -6.542 -0.975 0.851
41 HA CYS 12 HA CYS 12 -4.410 -0.784 2.735
42 1HB CYS 12 1HB CYS 12 -3.864 -0.919 0.431
43 2HB CYS 12 2HB CYS 12 -4.949 0.416 0.037
44 H GLU 13 H GLU 13 -4.458 0.630 4.399
45 HA GLU 13 HA GLU 13 -6.278 2.675 4.860
46 1HB GLU 13 1HB GLU 13 -3.433 2.751 5.850
47 2HB GLU 13 2HB GLU 13 -4.823 3.523 6.577
48 1HG GLU 13 1HG GLU 13 -4.548 1.733 7.967
49 2HG GLU 13 2HG GLU 13 -5.678 1.056 6.797
50 H LYS 14 H LYS 14 -3.350 2.888 3.043
51 HA LYS 14 HA LYS 14 -3.408 5.705 3.146
52 1HB LYS 14 1HB LYS 14 -1.553 3.840 1.745
53 2HB LYS 14 2HB LYS 14 -1.409 5.581 1.521
54 1HG LYS 14 1HG LYS 14 -1.124 5.824 3.958
55 2HG LYS 14 2HG LYS 14 -1.198 4.069 4.119
56 1HD LYS 14 1HD LYS 14 0.758 3.848 2.675
57 2HD LYS 14 2HD LYS 14 0.812 5.610 2.493
58 1HE LYS 14 1HE LYS 14 1.073 4.138 5.108
59 2HE LYS 14 2HE LYS 14 2.441 4.708 4.159
60 1HZ LYS 14 1HZ LYS 14 0.319 6.478 5.286
61 2HZ LYS 14 2HZ LYS 14 1.695 6.972 4.471
62 3HZ LYS 14 3HZ LYS 14 1.833 6.213 5.962
63 H CYS 15 H CYS 15 -4.956 3.629 1.303
64 HA CYS 15 HA CYS 15 -5.619 5.741 -0.619
65 1HB CYS 15 1HB CYS 15 -5.386 4.488 -2.724
66 2HB CYS 15 2HB CYS 15 -3.860 4.672 -1.854
67 H GLY 16 H GLY 16 -6.827 2.849 0.819
68 1HA GLY 16 1HA GLY 16 -9.081 2.469 1.206
69 2HA GLY 16 2HA GLY 16 -9.487 3.595 -0.097
70 H SER 17 H SER 17 -7.192 1.789 -1.379
71 HA SER 17 HA SER 17 -9.036 0.251 -2.950
72 1HB SER 17 1HB SER 17 -6.049 0.493 -2.912
73 2HB SER 17 2HB SER 17 -6.925 -0.302 -4.218
74 HG SER 17 HG SER 17 -8.065 1.807 -4.369
75 H LEU 18 H LEU 18 -9.282 -1.931 -2.876
76 HA LEU 18 HA LEU 18 -8.417 -3.358 -0.508
77 1HB LEU 18 1HB LEU 18 -9.931 -4.256 -2.954
78 2HB LEU 18 2HB LEU 18 -9.660 -5.239 -1.515
79 HG LEU 18 HG LEU 18 -11.227 -2.662 -1.555
80 1HD1 LEU 18 1HD1 LEU 18 -13.210 -4.103 -1.333
81 2HD1 LEU 18 2HD1 LEU 18 -12.186 -5.526 -1.538
82 3HD1 LEU 18 3HD1 LEU 18 -12.371 -4.373 -2.860
83 1HD2 LEU 18 1HD2 LEU 18 -12.000 -3.397 0.651
84 2HD2 LEU 18 2HD2 LEU 18 -10.252 -3.175 0.615
85 3HD2 LEU 18 3HD2 LEU 18 -10.937 -4.799 0.554
86 H VAL 19 H VAL 19 -6.553 -4.180 -0.336
87 HA VAL 19 HA VAL 19 -5.210 -5.178 -2.769
88 HB VAL 19 HB VAL 19 -3.874 -3.897 -0.361
89 1HG1 VAL 19 1HG1 VAL 19 -1.818 -3.929 -1.682
90 2HG1 VAL 19 2HG1 VAL 19 -2.659 -4.787 -2.968
91 3HG1 VAL 19 3HG1 VAL 19 -2.432 -5.557 -1.398
92 1HG2 VAL 19 1HG2 VAL 19 -3.347 -2.033 -1.859
93 2HG2 VAL 19 2HG2 VAL 19 -5.085 -2.245 -1.653
94 3HG2 VAL 19 3HG2 VAL 19 -4.296 -2.799 -3.130
95 HA PRO 20 HA PRO 20 -5.096 -9.165 -0.724
96 1HB PRO 20 1HB PRO 20 -2.530 -9.352 -2.237
97 2HB PRO 20 2HB PRO 20 -3.871 -10.513 -2.152
98 1HG PRO 20 1HG PRO 20 -3.531 -9.005 -4.301
99 2HG PRO 20 2HG PRO 20 -5.162 -9.321 -3.664
100 1HD PRO 20 1HD PRO 20 -3.493 -6.854 -3.468
101 2HD PRO 20 2HD PRO 20 -5.254 -7.042 -3.646
102 H VAL 21 H VAL 21 -4.395 -9.608 1.154
103 HA VAL 21 HA VAL 21 -2.817 -8.045 2.750
104 HB VAL 21 HB VAL 21 -4.424 -9.753 3.539
105 1HG1 VAL 21 1HG1 VAL 21 -2.228 -11.746 3.093
106 2HG1 VAL 21 2HG1 VAL 21 -3.753 -11.638 2.220
107 3HG1 VAL 21 3HG1 VAL 21 -3.751 -12.051 3.939
108 1HG2 VAL 21 1HG2 VAL 21 -2.964 -8.670 5.140
109 2HG2 VAL 21 2HG2 VAL 21 -1.737 -9.923 4.882
110 3HG2 VAL 21 3HG2 VAL 21 -3.297 -10.341 5.596
111 H TRP 22 H TRP 22 -1.689 -10.755 0.816
112 HA TRP 22 HA TRP 22 0.917 -10.794 1.943
113 1HB TRP 22 1HB TRP 22 1.433 -12.439 0.136
114 2HB TRP 22 2HB TRP 22 -0.009 -12.817 1.079
115 HD1 TRP 22 HD1 TRP 22 1.094 -11.797 -2.432
116 HE1 TRP 22 HE1 TRP 22 -0.863 -12.199 -4.038
117 HE3 TRP 22 HE3 TRP 22 -2.485 -12.944 0.962
118 HZ2 TRP 22 HZ2 TRP 22 -3.587 -12.926 -3.877
119 HZ3 TRP 22 HZ3 TRP 22 -4.771 -13.491 0.148
120 HH2 TRP 22 HH2 TRP 22 -5.281 -13.476 -2.222
121 H ASP 23 H ASP 23 -0.515 -8.812 -0.489
122 HA ASP 23 HA ASP 23 2.130 -8.046 -1.569
123 1HB ASP 23 1HB ASP 23 -0.685 -7.450 -2.546
124 2HB ASP 23 2HB ASP 23 0.772 -6.699 -3.213
125 H MET 24 H MET 24 0.078 -7.287 0.832
126 HA MET 24 HA MET 24 -0.113 -4.571 0.857
127 1HB MET 24 1HB MET 24 -0.096 -6.526 3.036
128 2HB MET 24 2HB MET 24 0.173 -4.835 3.487
129 1HG MET 24 1HG MET 24 -2.136 -5.952 1.944
130 2HG MET 24 2HG MET 24 -2.156 -5.316 3.604
131 1HE MET 24 1HE MET 24 -4.125 -2.649 1.579
132 2HE MET 24 2HE MET 24 -4.049 -3.531 3.100
133 3HE MET 24 3HE MET 24 -4.136 -4.421 1.569
134 HA PRO 25 HA PRO 25 4.123 -3.835 3.192
135 1HB PRO 25 1HB PRO 25 5.596 -6.175 2.073
136 2HB PRO 25 2HB PRO 25 5.790 -5.381 3.651
137 1HG PRO 25 1HG PRO 25 4.553 -7.709 3.514
138 2HG PRO 25 2HG PRO 25 3.906 -6.409 4.532
139 1HD PRO 25 1HD PRO 25 2.949 -7.341 1.843
140 2HD PRO 25 2HD PRO 25 2.023 -6.854 3.280
141 H GLU 26 H GLU 26 4.284 -5.663 0.229
142 HA GLU 26 HA GLU 26 6.114 -4.201 -1.331
143 1HB GLU 26 1HB GLU 26 3.605 -5.675 -2.092
144 2HB GLU 26 2HB GLU 26 4.888 -5.299 -3.231
145 1HG GLU 26 1HG GLU 26 5.081 -7.084 -0.820
146 2HG GLU 26 2HG GLU 26 4.952 -7.606 -2.507
147 H HIS 27 H HIS 27 2.632 -3.939 -1.330
148 HA HIS 27 HA HIS 27 2.450 -1.722 -3.047
149 1HB HIS 27 1HB HIS 27 0.711 -3.304 -2.726
150 2HB HIS 27 2HB HIS 27 0.578 -2.926 -1.015
151 HD1 HIS 27 HD1 HIS 27 -0.994 -2.067 -4.203
152 HD2 HIS 27 HD2 HIS 27 -0.337 -0.272 -0.561
153 HE1 HIS 27 HE1 HIS 27 -2.669 -0.144 -4.045
154 H MET 28 H MET 28 2.349 -1.938 0.480
155 HA MET 28 HA MET 28 2.044 0.830 0.957
156 1HB MET 28 1HB MET 28 3.016 -1.410 2.668
157 2HB MET 28 2HB MET 28 3.219 0.266 3.197
158 1HG MET 28 1HG MET 28 0.650 -1.156 2.565
159 2HG MET 28 2HG MET 28 1.214 -0.607 4.146
160 1HE MET 28 1HE MET 28 -1.594 1.951 3.786
161 2HE MET 28 2HE MET 28 -0.703 0.875 4.866
162 3HE MET 28 3HE MET 28 -1.608 0.209 3.495
163 H ASP 29 H ASP 29 4.874 -1.107 0.352
164 HA ASP 29 HA ASP 29 6.747 0.904 1.142
165 1HB ASP 29 1HB ASP 29 7.384 -1.459 0.954
166 2HB ASP 29 2HB ASP 29 7.025 -1.412 -0.778
167 H TYR 30 H TYR 30 5.027 0.152 -1.788
168 HA TYR 30 HA TYR 30 6.387 1.959 -3.450
169 1HB TYR 30 1HB TYR 30 4.827 0.242 -4.339
170 2HB TYR 30 2HB TYR 30 3.476 1.133 -3.616
171 HD1 TYR 30 HD1 TYR 30 2.403 2.802 -4.860
172 HD2 TYR 30 HD2 TYR 30 6.265 1.503 -6.024
173 HE1 TYR 30 HE1 TYR 30 2.256 4.213 -6.883
174 HE2 TYR 30 HE2 TYR 30 6.138 2.881 -8.041
175 HH TYR 30 HH TYR 30 4.588 3.954 -9.425
176 H HIS 31 H HIS 31 3.567 2.387 -1.346
177 HA HIS 31 HA HIS 31 3.188 5.225 -1.923
178 1HB HIS 31 1HB HIS 31 2.450 3.675 0.569
179 2HB HIS 31 2HB HIS 31 2.185 5.405 0.418
180 HD1 HIS 31 HD1 HIS 31 0.370 6.020 -1.598
181 HD2 HIS 31 HD2 HIS 31 0.455 2.179 -0.078
182 HE1 HIS 31 HE1 HIS 31 -1.869 5.022 -2.163
183 H PHE 32 H PHE 32 5.184 3.529 0.485
184 HA PHE 32 HA PHE 32 5.934 5.752 1.884
185 1HB PHE 32 1HB PHE 32 6.890 2.999 1.522
186 2HB PHE 32 2HB PHE 32 8.043 4.129 2.231
187 HD1 PHE 32 HD1 PHE 32 4.679 2.563 2.659
188 HD2 PHE 32 HD2 PHE 32 7.785 4.838 4.490
189 HE1 PHE 32 HE1 PHE 32 3.621 2.250 4.835
190 HE2 PHE 32 HE2 PHE 32 6.711 4.523 6.677
191 HZ PHE 32 HZ PHE 32 4.628 3.228 6.851
192 H ALA 33 H ALA 33 7.731 4.036 -0.693
193 HA ALA 33 HA ALA 33 9.788 5.945 -0.820
194 1HB ALA 33 1HB ALA 33 10.465 4.810 -2.887
195 2HB ALA 33 2HB ALA 33 8.923 3.954 -2.913
196 3HB ALA 33 3HB ALA 33 10.072 3.656 -1.612
197 H LEU 34 H LEU 34 6.674 5.761 -2.361
198 HA LEU 34 HA LEU 34 7.111 7.723 -4.366
199 1HB LEU 34 1HB LEU 34 5.259 6.122 -4.433
200 2HB LEU 34 2HB LEU 34 4.574 6.858 -2.989
201 HG LEU 34 HG LEU 34 4.108 8.898 -4.253
202 1HD1 LEU 34 1HD1 LEU 34 5.941 8.786 -5.856
203 2HD1 LEU 34 2HD1 LEU 34 4.387 8.915 -6.685
204 3HD1 LEU 34 3HD1 LEU 34 5.210 7.359 -6.592
205 1HD2 LEU 34 1HD2 LEU 34 2.347 7.994 -5.680
206 2HD2 LEU 34 2HD2 LEU 34 2.425 7.126 -4.143
207 3HD2 LEU 34 3HD2 LEU 34 3.094 6.400 -5.602
208 H GLU 35 H GLU 35 5.835 7.866 -1.056
209 HA GLU 35 HA GLU 35 5.519 10.724 -1.293
210 1HB GLU 35 1HB GLU 35 4.904 8.850 0.963
211 2HB GLU 35 2HB GLU 35 4.592 10.578 0.998
212 1HG GLU 35 1HG GLU 35 3.169 10.251 -1.039
213 2HG GLU 35 2HG GLU 35 3.344 8.505 -0.766
214 H LEU 36 H LEU 36 7.977 8.701 -0.594
215 HA LEU 36 HA LEU 36 9.378 10.315 1.330
216 1HB LEU 36 1HB LEU 36 9.765 7.872 0.958
217 2HB LEU 36 2HB LEU 36 10.268 8.233 -0.687
218 HG LEU 36 HG LEU 36 12.211 9.441 0.235
219 1HD1 LEU 36 1HD1 LEU 36 12.808 9.131 2.580
220 2HD1 LEU 36 2HD1 LEU 36 11.301 8.262 2.856
221 3HD1 LEU 36 3HD1 LEU 36 11.262 9.973 2.440
222 1HD2 LEU 36 1HD2 LEU 36 12.372 7.137 -0.516
223 2HD2 LEU 36 2HD2 LEU 36 11.911 6.566 1.087
224 3HD2 LEU 36 3HD2 LEU 36 13.435 7.420 0.860
225 H GLN 37 H GLN 37 8.610 10.482 -1.933
226 HA GLN 37 HA GLN 37 10.816 12.170 -2.761
227 1HB GLN 37 1HB GLN 37 8.254 11.399 -4.135
228 2HB GLN 37 2HB GLN 37 9.610 12.250 -4.885
229 1HG GLN 37 1HG GLN 37 10.997 10.356 -4.683
230 2HG GLN 37 2HG GLN 37 9.808 9.519 -3.665
231 1HE2 GLN 37 1HE2 GLN 37 9.726 7.818 -5.017
232 2HE2 GLN 37 2HE2 GLN 37 8.952 7.845 -6.577
233 H LYS 38 H LYS 38 7.622 12.548 -1.434
234 HA LYS 38 HA LYS 38 7.221 15.161 -2.614
235 1HB LYS 38 1HB LYS 38 5.091 15.240 -1.519
236 2HB LYS 38 2HB LYS 38 5.310 13.602 -2.138
237 1HG LYS 38 1HG LYS 38 5.891 12.842 0.097
238 2HG LYS 38 2HG LYS 38 5.682 14.492 0.712
239 1HD LYS 38 1HD LYS 38 3.327 14.414 -0.059
240 2HD LYS 38 2HD LYS 38 3.567 12.728 -0.522
241 1HE LYS 38 1HE LYS 38 4.174 12.224 1.843
242 2HE LYS 38 2HE LYS 38 3.835 13.897 2.231
243 1HZ LYS 38 1HZ LYS 38 1.535 13.563 1.527
244 2HZ LYS 38 2HZ LYS 38 1.955 12.505 2.758
245 3HZ LYS 38 3HZ LYS 38 1.847 11.945 1.191
246 H SER 39 H SER 39 8.764 13.974 0.117
247 HA SER 39 HA SER 39 9.451 16.603 0.955
248 1HB SER 39 1HB SER 39 8.030 14.699 2.860
249 2HB SER 39 2HB SER 39 8.824 16.196 3.341
250 HG SER 39 HG SER 39 7.045 16.519 1.294
Start of MODEL 9
1 H ALA 6 H ALA 6 -10.902 -15.791 3.985
2 HA ALA 6 HA ALA 6 -12.083 -13.948 2.048
3 1HB ALA 6 1HB ALA 6 -13.162 -14.801 4.727
4 2HB ALA 6 2HB ALA 6 -13.756 -15.343 3.158
5 3HB ALA 6 3HB ALA 6 -13.910 -13.646 3.626
6 H GLU 7 H GLU 7 -11.879 -11.852 2.407
7 HA GLU 7 HA GLU 7 -11.112 -9.910 3.143
8 1HB GLU 7 1HB GLU 7 -11.142 -11.267 5.840
9 2HB GLU 7 2HB GLU 7 -10.845 -9.538 5.600
10 1HG GLU 7 1HG GLU 7 -13.044 -9.322 4.570
11 2HG GLU 7 2HG GLU 7 -13.334 -11.040 4.822
12 H ASP 8 H ASP 8 -9.388 -12.046 2.261
13 HA ASP 8 HA ASP 8 -6.842 -11.240 3.478
14 1HB ASP 8 1HB ASP 8 -7.489 -13.414 1.462
15 2HB ASP 8 2HB ASP 8 -5.839 -12.923 1.838
16 H GLN 9 H GLN 9 -8.760 -9.805 1.707
17 HA GLN 9 HA GLN 9 -6.620 -8.542 0.273
18 1HB GLN 9 1HB GLN 9 -9.551 -8.546 -0.524
19 2HB GLN 9 2HB GLN 9 -8.289 -7.631 -1.349
20 1HG GLN 9 1HG GLN 9 -7.250 -9.724 -2.024
21 2HG GLN 9 2HG GLN 9 -8.542 -10.620 -1.202
22 1HE2 GLN 9 1HE2 GLN 9 -7.848 -10.659 -4.018
23 2HE2 GLN 9 2HE2 GLN 9 -9.252 -10.097 -4.866
24 H VAL 10 H VAL 10 -6.299 -6.825 1.642
25 HA VAL 10 HA VAL 10 -8.611 -5.864 3.132
26 HB VAL 10 HB VAL 10 -6.947 -4.968 4.825
27 1HG1 VAL 10 1HG1 VAL 10 -8.221 -7.002 5.216
28 2HG1 VAL 10 2HG1 VAL 10 -6.588 -7.158 5.868
29 3HG1 VAL 10 3HG1 VAL 10 -7.008 -7.946 4.348
30 1HG2 VAL 10 1HG2 VAL 10 -4.708 -5.965 4.855
31 2HG2 VAL 10 2HG2 VAL 10 -4.952 -5.008 3.392
32 3HG2 VAL 10 3HG2 VAL 10 -5.040 -6.766 3.320
33 HA PRO 11 HA PRO 11 -8.349 -2.089 1.082
34 1HB PRO 11 1HB PRO 11 -9.359 -0.484 2.940
35 2HB PRO 11 2HB PRO 11 -10.380 -1.437 1.855
36 1HG PRO 11 1HG PRO 11 -9.678 -1.883 4.727
37 2HG PRO 11 2HG PRO 11 -11.150 -2.372 3.856
38 1HD PRO 11 1HD PRO 11 -9.128 -4.087 4.536
39 2HD PRO 11 2HD PRO 11 -10.225 -4.332 3.162
40 H CYS 12 H CYS 12 -6.716 -0.916 0.828
41 HA CYS 12 HA CYS 12 -4.682 -0.502 2.746
42 1HB CYS 12 1HB CYS 12 -4.151 -0.736 0.438
43 2HB CYS 12 2HB CYS 12 -5.237 0.589 0.009
44 H GLU 13 H GLU 13 -4.871 0.935 4.286
45 HA GLU 13 HA GLU 13 -6.827 2.921 4.538
46 1HB GLU 13 1HB GLU 13 -5.419 1.939 6.370
47 2HB GLU 13 2HB GLU 13 -4.087 2.915 5.787
48 1HG GLU 13 1HG GLU 13 -5.250 4.939 6.334
49 2HG GLU 13 2HG GLU 13 -6.690 4.026 6.793
50 H LYS 14 H LYS 14 -3.723 3.016 3.006
51 HA LYS 14 HA LYS 14 -3.777 5.806 2.857
52 1HB LYS 14 1HB LYS 14 -1.835 3.810 1.856
53 2HB LYS 14 2HB LYS 14 -1.645 5.466 1.300
54 1HG LYS 14 1HG LYS 14 -1.544 6.168 3.693
55 2HG LYS 14 2HG LYS 14 -1.598 4.458 4.136
56 1HD LYS 14 1HD LYS 14 0.443 4.028 2.969
57 2HD LYS 14 2HD LYS 14 0.466 5.674 2.327
58 1HE LYS 14 1HE LYS 14 0.562 5.039 5.267
59 2HE LYS 14 2HE LYS 14 2.003 5.262 4.286
60 1HZ LYS 14 1HZ LYS 14 1.424 7.296 5.409
61 2HZ LYS 14 2HZ LYS 14 -0.128 7.288 4.772
62 3HZ LYS 14 3HZ LYS 14 1.202 7.516 3.749
63 H CYS 15 H CYS 15 -5.211 3.597 1.007
64 HA CYS 15 HA CYS 15 -5.784 5.630 -1.016
65 1HB CYS 15 1HB CYS 15 -5.398 4.364 -3.077
66 2HB CYS 15 2HB CYS 15 -3.930 4.594 -2.120
67 H GLY 16 H GLY 16 -7.041 2.858 0.467
68 1HA GLY 16 1HA GLY 16 -9.271 2.422 0.730
69 2HA GLY 16 2HA GLY 16 -9.659 3.469 -0.632
70 H SER 17 H SER 17 -7.259 1.531 -1.645
71 HA SER 17 HA SER 17 -9.013 -0.111 -3.222
72 1HB SER 17 1HB SER 17 -6.005 -0.025 -2.990
73 2HB SER 17 2HB SER 17 -6.905 -0.767 -4.318
74 HG SER 17 HG SER 17 -6.135 1.356 -4.780
75 H LEU 18 H LEU 18 -9.308 -2.326 -2.946
76 HA LEU 18 HA LEU 18 -8.475 -3.528 -0.433
77 1HB LEU 18 1HB LEU 18 -9.971 -4.655 -2.780
78 2HB LEU 18 2HB LEU 18 -9.732 -5.483 -1.243
79 HG LEU 18 HG LEU 18 -11.281 -2.907 -1.558
80 1HD1 LEU 18 1HD1 LEU 18 -12.261 -5.743 -1.255
81 2HD1 LEU 18 2HD1 LEU 18 -12.400 -4.754 -2.710
82 3HD1 LEU 18 3HD1 LEU 18 -13.269 -4.298 -1.241
83 1HD2 LEU 18 1HD2 LEU 18 -12.085 -3.426 0.687
84 2HD2 LEU 18 2HD2 LEU 18 -10.330 -3.247 0.655
85 3HD2 LEU 18 3HD2 LEU 18 -11.051 -4.854 0.729
86 H VAL 19 H VAL 19 -6.494 -4.055 -0.321
87 HA VAL 19 HA VAL 19 -5.102 -5.043 -2.723
88 HB VAL 19 HB VAL 19 -3.882 -4.138 -0.122
89 1HG1 VAL 19 1HG1 VAL 19 -1.810 -3.895 -1.408
90 2HG1 VAL 19 2HG1 VAL 19 -2.628 -4.562 -2.823
91 3HG1 VAL 19 3HG1 VAL 19 -2.401 -5.557 -1.386
92 1HG2 VAL 19 1HG2 VAL 19 -4.333 -2.557 -2.643
93 2HG2 VAL 19 2HG2 VAL 19 -3.356 -2.026 -1.278
94 3HG2 VAL 19 3HG2 VAL 19 -5.090 -2.281 -1.075
95 HA PRO 20 HA PRO 20 -5.069 -9.197 -1.018
96 1HB PRO 20 1HB PRO 20 -2.530 -9.275 -2.590
97 2HB PRO 20 2HB PRO 20 -3.874 -10.432 -2.580
98 1HG PRO 20 1HG PRO 20 -3.564 -8.768 -4.607
99 2HG PRO 20 2HG PRO 20 -5.186 -9.110 -3.959
100 1HD PRO 20 1HD PRO 20 -3.471 -6.688 -3.580
101 2HD PRO 20 2HD PRO 20 -5.236 -6.817 -3.776
102 H VAL 21 H VAL 21 -4.357 -9.701 0.839
103 HA VAL 21 HA VAL 21 -2.748 -8.248 2.502
104 HB VAL 21 HB VAL 21 -4.434 -9.951 3.132
105 1HG1 VAL 21 1HG1 VAL 21 -2.271 -11.953 2.657
106 2HG1 VAL 21 2HG1 VAL 21 -3.800 -11.798 1.794
107 3HG1 VAL 21 3HG1 VAL 21 -3.791 -12.263 3.497
108 1HG2 VAL 21 1HG2 VAL 21 -1.806 -10.155 4.570
109 2HG2 VAL 21 2HG2 VAL 21 -3.371 -10.702 5.184
110 3HG2 VAL 21 3HG2 VAL 21 -3.106 -8.984 4.868
111 H TRP 22 H TRP 22 -1.712 -10.903 0.435
112 HA TRP 22 HA TRP 22 0.904 -11.057 1.500
113 1HB TRP 22 1HB TRP 22 1.383 -12.449 -0.557
114 2HB TRP 22 2HB TRP 22 0.073 -13.002 0.492
115 HD1 TRP 22 HD1 TRP 22 0.663 -11.397 -2.951
116 HE1 TRP 22 HE1 TRP 22 -1.407 -11.836 -4.393
117 HE3 TRP 22 HE3 TRP 22 -2.325 -13.494 0.593
118 HZ2 TRP 22 HZ2 TRP 22 -4.010 -12.934 -4.051
119 HZ3 TRP 22 HZ3 TRP 22 -4.608 -14.217 -0.050
120 HH2 TRP 22 HH2 TRP 22 -5.406 -13.937 -2.321
121 H ASP 23 H ASP 23 -0.449 -8.904 -0.868
122 HA ASP 23 HA ASP 23 2.277 -8.053 -1.620
123 1HB ASP 23 1HB ASP 23 -0.399 -7.583 -2.926
124 2HB ASP 23 2HB ASP 23 1.005 -6.578 -3.298
125 H MET 24 H MET 24 0.083 -7.471 0.635
126 HA MET 24 HA MET 24 -0.222 -4.750 0.767
127 1HB MET 24 1HB MET 24 -0.488 -6.900 2.653
128 2HB MET 24 2HB MET 24 0.111 -5.424 3.425
129 1HG MET 24 1HG MET 24 -2.370 -5.742 1.772
130 2HG MET 24 2HG MET 24 -2.263 -5.418 3.515
131 1HE MET 24 1HE MET 24 -3.785 -3.245 3.420
132 2HE MET 24 2HE MET 24 -4.035 -3.797 1.767
133 3HE MET 24 3HE MET 24 -3.664 -2.094 2.075
134 HA PRO 25 HA PRO 25 3.891 -4.164 3.306
135 1HB PRO 25 1HB PRO 25 5.887 -5.932 2.503
136 2HB PRO 25 2HB PRO 25 5.002 -6.027 4.037
137 1HG PRO 25 1HG PRO 25 4.608 -7.559 1.505
138 2HG PRO 25 2HG PRO 25 4.409 -8.091 3.183
139 1HD PRO 25 1HD PRO 25 2.335 -7.502 1.566
140 2HD PRO 25 2HD PRO 25 2.251 -7.225 3.317
141 H GLU 26 H GLU 26 4.271 -5.780 0.233
142 HA GLU 26 HA GLU 26 6.095 -4.132 -1.073
143 1HB GLU 26 1HB GLU 26 3.830 -5.859 -1.975
144 2HB GLU 26 2HB GLU 26 4.885 -5.101 -3.160
145 1HG GLU 26 1HG GLU 26 5.742 -6.958 -0.954
146 2HG GLU 26 2HG GLU 26 5.491 -7.419 -2.651
147 H HIS 27 H HIS 27 2.594 -3.991 -1.095
148 HA HIS 27 HA HIS 27 2.372 -1.701 -2.705
149 1HB HIS 27 1HB HIS 27 0.618 -3.362 -2.378
150 2HB HIS 27 2HB HIS 27 0.482 -2.919 -0.684
151 HD1 HIS 27 HD1 HIS 27 -1.083 -2.210 -3.898
152 HD2 HIS 27 HD2 HIS 27 -0.411 -0.204 -0.354
153 HE1 HIS 27 HE1 HIS 27 -2.725 -0.296 -3.870
154 H MET 28 H MET 28 2.425 -2.062 0.806
155 HA MET 28 HA MET 28 2.075 0.725 1.263
156 1HB MET 28 1HB MET 28 3.408 -1.186 3.202
157 2HB MET 28 2HB MET 28 2.768 0.415 3.545
158 1HG MET 28 1HG MET 28 0.498 -0.464 2.815
159 2HG MET 28 2HG MET 28 1.222 -2.061 2.870
160 1HE MET 28 1HE MET 28 0.244 1.131 4.887
161 2HE MET 28 2HE MET 28 1.954 0.999 5.283
162 3HE MET 28 3HE MET 28 0.740 0.708 6.521
163 H ASP 29 H ASP 29 4.858 -1.215 0.546
164 HA ASP 29 HA ASP 29 6.848 0.691 1.347
165 1HB ASP 29 1HB ASP 29 7.377 -1.694 1.154
166 2HB ASP 29 2HB ASP 29 6.864 -1.687 -0.534
167 H TYR 30 H TYR 30 5.040 -0.006 -1.547
168 HA TYR 30 HA TYR 30 6.385 1.794 -3.254
169 1HB TYR 30 1HB TYR 30 4.840 -0.011 -4.040
170 2HB TYR 30 2HB TYR 30 3.487 0.909 -3.370
171 HD1 TYR 30 HD1 TYR 30 5.953 0.691 -6.071
172 HD2 TYR 30 HD2 TYR 30 2.695 2.917 -4.495
173 HE1 TYR 30 HE1 TYR 30 5.735 1.876 -8.215
174 HE2 TYR 30 HE2 TYR 30 2.463 4.108 -6.633
175 HH TYR 30 HH TYR 30 3.927 3.044 -9.435
176 H HIS 31 H HIS 31 3.514 2.218 -1.171
177 HA HIS 31 HA HIS 31 3.179 5.025 -1.818
178 1HB HIS 31 1HB HIS 31 2.307 3.497 0.628
179 2HB HIS 31 2HB HIS 31 2.123 5.242 0.505
180 HD1 HIS 31 HD1 HIS 31 0.367 5.996 -1.487
181 HD2 HIS 31 HD2 HIS 31 0.345 2.083 -0.217
182 HE1 HIS 31 HE1 HIS 31 -1.910 5.110 -2.100
183 H PHE 32 H PHE 32 5.162 3.268 0.460
184 HA PHE 32 HA PHE 32 5.799 5.379 2.140
185 1HB PHE 32 1HB PHE 32 6.273 2.876 2.419
186 2HB PHE 32 2HB PHE 32 7.687 3.156 1.394
187 HD1 PHE 32 HD1 PHE 32 9.462 4.745 2.200
188 HD2 PHE 32 HD2 PHE 32 6.277 3.394 4.647
189 HE1 PHE 32 HE1 PHE 32 10.729 5.446 4.197
190 HE2 PHE 32 HE2 PHE 32 7.525 4.100 6.669
191 HZ PHE 32 HZ PHE 32 9.753 5.123 6.433
192 H ALA 33 H ALA 33 7.561 4.046 -0.603
193 HA ALA 33 HA ALA 33 9.559 6.066 -0.665
194 1HB ALA 33 1HB ALA 33 8.634 4.280 -2.919
195 2HB ALA 33 2HB ALA 33 9.885 3.889 -1.740
196 3HB ALA 33 3HB ALA 33 10.136 5.200 -2.891
197 H LEU 34 H LEU 34 6.498 5.720 -2.334
198 HA LEU 34 HA LEU 34 6.742 7.933 -4.064
199 1HB LEU 34 1HB LEU 34 5.057 6.126 -4.275
200 2HB LEU 34 2HB LEU 34 4.218 6.796 -2.877
201 HG LEU 34 HG LEU 34 3.765 8.842 -4.153
202 1HD1 LEU 34 1HD1 LEU 34 5.021 7.348 -6.457
203 2HD1 LEU 34 2HD1 LEU 34 5.696 8.769 -5.654
204 3HD1 LEU 34 3HD1 LEU 34 4.191 8.900 -6.553
205 1HD2 LEU 34 1HD2 LEU 34 2.138 7.011 -4.124
206 2HD2 LEU 34 2HD2 LEU 34 2.906 6.312 -5.550
207 3HD2 LEU 34 3HD2 LEU 34 2.108 7.882 -5.657
208 H GLU 35 H GLU 35 5.429 7.677 -0.789
209 HA GLU 35 HA GLU 35 4.770 10.482 -0.679
210 1HB GLU 35 1HB GLU 35 4.559 8.237 1.319
211 2HB GLU 35 2HB GLU 35 4.113 9.901 1.693
212 1HG GLU 35 1HG GLU 35 2.377 9.888 0.086
213 2HG GLU 35 2HG GLU 35 2.947 8.357 -0.592
214 H LEU 36 H LEU 36 7.464 8.576 -0.199
215 HA LEU 36 HA LEU 36 8.923 10.310 1.624
216 1HB LEU 36 1HB LEU 36 9.409 7.849 1.326
217 2HB LEU 36 2HB LEU 36 9.705 8.153 -0.375
218 HG LEU 36 HG LEU 36 11.462 9.251 1.808
219 1HD1 LEU 36 1HD1 LEU 36 11.349 6.820 2.028
220 2HD1 LEU 36 2HD1 LEU 36 12.911 7.325 1.385
221 3HD1 LEU 36 3HD1 LEU 36 11.695 6.645 0.306
222 1HD2 LEU 36 1HD2 LEU 36 11.994 8.629 -1.101
223 2HD2 LEU 36 2HD2 LEU 36 13.133 9.351 0.034
224 3HD2 LEU 36 3HD2 LEU 36 11.686 10.238 -0.454
225 H GLN 37 H GLN 37 8.251 10.152 -1.740
226 HA GLN 37 HA GLN 37 10.126 12.234 -2.363
227 1HB GLN 37 1HB GLN 37 7.795 11.135 -3.949
228 2HB GLN 37 2HB GLN 37 9.073 12.184 -4.575
229 1HG GLN 37 1HG GLN 37 10.700 10.440 -4.236
230 2HG GLN 37 2HG GLN 37 9.467 9.406 -3.494
231 1HE2 GLN 37 1HE2 GLN 37 11.126 8.922 -5.764
232 2HE2 GLN 37 2HE2 GLN 37 10.081 8.597 -7.112
233 H LYS 38 H LYS 38 6.649 11.777 -2.141
234 HA LYS 38 HA LYS 38 4.897 13.067 -1.839
235 1HB LYS 38 1HB LYS 38 4.890 14.592 0.058
236 2HB LYS 38 2HB LYS 38 5.678 13.066 0.458
237 1HG LYS 38 1HG LYS 38 7.859 14.229 0.271
238 2HG LYS 38 2HG LYS 38 6.988 15.740 -0.045
239 1HD LYS 38 1HD LYS 38 6.788 14.053 2.460
240 2HD LYS 38 2HD LYS 38 7.640 15.585 2.315
241 1HE LYS 38 1HE LYS 38 5.540 16.735 1.829
242 2HE LYS 38 2HE LYS 38 4.665 15.212 1.904
243 1HZ LYS 38 1HZ LYS 38 6.102 16.467 4.181
244 2HZ LYS 38 2HZ LYS 38 5.253 15.025 4.226
245 3HZ LYS 38 3HZ LYS 38 4.433 16.460 3.938
246 H SER 39 H SER 39 6.368 13.777 -4.018
247 HA SER 39 HA SER 39 6.551 16.566 -4.363
248 1HB SER 39 1HB SER 39 6.101 14.424 -6.456
249 2HB SER 39 2HB SER 39 6.775 16.037 -6.725
250 HG SER 39 HG SER 39 8.371 15.281 -5.033
Start of MODEL 10
1 H ALA 6 H ALA 6 -10.352 -13.498 -2.974
2 HA ALA 6 HA ALA 6 -9.330 -16.044 -1.928
3 1HB ALA 6 1HB ALA 6 -8.057 -13.313 -1.966
4 2HB ALA 6 2HB ALA 6 -7.689 -14.647 -3.068
5 3HB ALA 6 3HB ALA 6 -7.340 -14.795 -1.340
6 H GLU 7 H GLU 7 -10.906 -13.106 -1.150
7 HA GLU 7 HA GLU 7 -11.826 -12.238 0.641
8 1HB GLU 7 1HB GLU 7 -11.424 -14.977 1.855
9 2HB GLU 7 2HB GLU 7 -12.421 -13.695 2.554
10 1HG GLU 7 1HG GLU 7 -13.798 -13.746 0.469
11 2HG GLU 7 2HG GLU 7 -12.868 -15.153 -0.039
12 H ASP 8 H ASP 8 -8.899 -12.334 0.259
13 HA ASP 8 HA ASP 8 -8.062 -11.446 2.971
14 1HB ASP 8 1HB ASP 8 -6.452 -12.946 0.913
15 2HB ASP 8 2HB ASP 8 -5.695 -11.980 2.182
16 H GLN 9 H GLN 9 -9.171 -9.963 0.510
17 HA GLN 9 HA GLN 9 -6.848 -8.312 0.188
18 1HB GLN 9 1HB GLN 9 -9.537 -8.232 -1.181
19 2HB GLN 9 2HB GLN 9 -8.207 -7.114 -1.506
20 1HG GLN 9 1HG GLN 9 -6.855 -8.978 -2.268
21 2HG GLN 9 2HG GLN 9 -8.215 -10.083 -2.006
22 1HE2 GLN 9 1HE2 GLN 9 -8.408 -10.646 -4.152
23 2HE2 GLN 9 2HE2 GLN 9 -8.936 -9.539 -5.380
24 H VAL 10 H VAL 10 -6.626 -6.814 1.618
25 HA VAL 10 HA VAL 10 -9.005 -5.861 2.990
26 HB VAL 10 HB VAL 10 -7.438 -5.118 4.822
27 1HG1 VAL 10 1HG1 VAL 10 -8.660 -7.213 5.030
28 2HG1 VAL 10 2HG1 VAL 10 -7.054 -7.372 5.741
29 3HG1 VAL 10 3HG1 VAL 10 -7.385 -8.058 4.153
30 1HG2 VAL 10 1HG2 VAL 10 -5.171 -6.053 4.893
31 2HG2 VAL 10 2HG2 VAL 10 -5.380 -4.991 3.499
32 3HG2 VAL 10 3HG2 VAL 10 -5.405 -6.741 3.286
33 HA PRO 11 HA PRO 11 -8.469 -2.082 0.954
34 1HB PRO 11 1HB PRO 11 -9.486 -0.363 2.644
35 2HB PRO 11 2HB PRO 11 -10.516 -1.465 1.712
36 1HG PRO 11 1HG PRO 11 -9.634 -1.678 4.579
37 2HG PRO 11 2HG PRO 11 -11.223 -2.061 3.875
38 1HD PRO 11 1HD PRO 11 -9.390 -3.968 4.457
39 2HD PRO 11 2HD PRO 11 -10.517 -4.101 3.090
40 H CYS 12 H CYS 12 -6.712 -0.981 0.735
41 HA CYS 12 HA CYS 12 -4.775 -0.703 2.781
42 1HB CYS 12 1HB CYS 12 -4.070 -1.007 0.544
43 2HB CYS 12 2HB CYS 12 -5.023 0.380 0.008
44 H GLU 13 H GLU 13 -4.826 0.795 4.273
45 HA GLU 13 HA GLU 13 -6.751 2.771 4.605
46 1HB GLU 13 1HB GLU 13 -4.014 2.716 5.854
47 2HB GLU 13 2HB GLU 13 -5.446 3.511 6.494
48 1HG GLU 13 1HG GLU 13 -6.526 1.318 6.756
49 2HG GLU 13 2HG GLU 13 -5.067 0.537 6.158
50 H LYS 14 H LYS 14 -3.728 3.037 2.959
51 HA LYS 14 HA LYS 14 -3.864 5.889 2.975
52 1HB LYS 14 1HB LYS 14 -1.883 3.963 1.918
53 2HB LYS 14 2HB LYS 14 -1.785 5.592 1.287
54 1HG LYS 14 1HG LYS 14 -1.502 6.434 3.579
55 2HG LYS 14 2HG LYS 14 -1.611 4.781 4.192
56 1HD LYS 14 1HD LYS 14 0.352 4.163 2.866
57 2HD LYS 14 2HD LYS 14 0.417 5.813 2.236
58 1HE LYS 14 1HE LYS 14 0.704 5.134 5.167
59 2HE LYS 14 2HE LYS 14 2.069 5.314 4.073
60 1HZ LYS 14 1HZ LYS 14 0.072 7.419 4.722
61 2HZ LYS 14 2HZ LYS 14 1.366 7.611 3.661
62 3HZ LYS 14 3HZ LYS 14 1.651 7.329 5.299
63 H CYS 15 H CYS 15 -5.255 3.668 1.162
64 HA CYS 15 HA CYS 15 -5.785 5.639 -0.968
65 1HB CYS 15 1HB CYS 15 -5.375 4.197 -2.900
66 2HB CYS 15 2HB CYS 15 -3.928 4.487 -1.926
67 H GLY 16 H GLY 16 -7.061 2.783 0.501
68 1HA GLY 16 1HA GLY 16 -9.334 2.354 0.721
69 2HA GLY 16 2HA GLY 16 -9.658 3.437 -0.640
70 H SER 17 H SER 17 -7.234 1.691 -1.723
71 HA SER 17 HA SER 17 -8.906 0.038 -3.367
72 1HB SER 17 1HB SER 17 -5.898 0.230 -3.128
73 2HB SER 17 2HB SER 17 -6.748 -0.537 -4.472
74 HG SER 17 HG SER 17 -7.800 1.764 -4.451
75 H LEU 18 H LEU 18 -9.162 -2.157 -3.160
76 HA LEU 18 HA LEU 18 -8.427 -3.420 -0.656
77 1HB LEU 18 1HB LEU 18 -9.760 -4.501 -3.129
78 2HB LEU 18 2HB LEU 18 -9.582 -5.360 -1.600
79 HG LEU 18 HG LEU 18 -11.172 -2.823 -1.948
80 1HD1 LEU 18 1HD1 LEU 18 -13.127 -4.276 -1.762
81 2HD1 LEU 18 2HD1 LEU 18 -12.079 -5.694 -1.751
82 3HD1 LEU 18 3HD1 LEU 18 -12.170 -4.672 -3.187
83 1HD2 LEU 18 1HD2 LEU 18 -10.313 -3.167 0.305
84 2HD2 LEU 18 2HD2 LEU 18 -10.987 -4.795 0.323
85 3HD2 LEU 18 3HD2 LEU 18 -12.059 -3.396 0.255
86 H VAL 19 H VAL 19 -6.535 -4.123 -0.337
87 HA VAL 19 HA VAL 19 -5.047 -5.131 -2.669
88 HB VAL 19 HB VAL 19 -3.863 -4.054 -0.110
89 1HG1 VAL 19 1HG1 VAL 19 -1.770 -3.933 -1.361
90 2HG1 VAL 19 2HG1 VAL 19 -2.565 -4.661 -2.756
91 3HG1 VAL 19 3HG1 VAL 19 -2.386 -5.584 -1.262
92 1HG2 VAL 19 1HG2 VAL 19 -4.252 -2.653 -2.741
93 2HG2 VAL 19 2HG2 VAL 19 -3.287 -2.036 -1.402
94 3HG2 VAL 19 3HG2 VAL 19 -5.027 -2.260 -1.211
95 HA PRO 20 HA PRO 20 -5.203 -9.140 -0.699
96 1HB PRO 20 1HB PRO 20 -2.644 -9.448 -2.204
97 2HB PRO 20 2HB PRO 20 -4.058 -10.522 -2.161
98 1HG PRO 20 1HG PRO 20 -3.575 -8.973 -4.273
99 2HG PRO 20 2HG PRO 20 -5.235 -9.242 -3.692
100 1HD PRO 20 1HD PRO 20 -3.475 -6.845 -3.379
101 2HD PRO 20 2HD PRO 20 -5.236 -6.948 -3.603
102 H VAL 21 H VAL 21 -4.524 -9.594 1.204
103 HA VAL 21 HA VAL 21 -2.948 -8.099 2.818
104 HB VAL 21 HB VAL 21 -4.637 -9.919 3.331
105 1HG1 VAL 21 1HG1 VAL 21 -3.663 -11.786 2.235
106 2HG1 VAL 21 2HG1 VAL 21 -3.861 -12.121 3.956
107 3HG1 VAL 21 3HG1 VAL 21 -2.266 -11.730 3.310
108 1HG2 VAL 21 1HG2 VAL 21 -2.217 -9.751 5.112
109 2HG2 VAL 21 2HG2 VAL 21 -3.837 -10.359 5.532
110 3HG2 VAL 21 3HG2 VAL 21 -3.631 -8.672 5.088
111 H TRP 22 H TRP 22 -1.846 -10.817 0.873
112 HA TRP 22 HA TRP 22 0.763 -10.858 1.965
113 1HB TRP 22 1HB TRP 22 1.249 -12.423 0.043
114 2HB TRP 22 2HB TRP 22 -0.039 -12.906 1.150
115 HD1 TRP 22 HD1 TRP 22 0.445 -11.554 -2.442
116 HE1 TRP 22 HE1 TRP 22 -1.623 -12.168 -3.808
117 HE3 TRP 22 HE3 TRP 22 -2.420 -13.500 1.273
118 HZ2 TRP 22 HZ2 TRP 22 -4.147 -13.343 -3.381
119 HZ3 TRP 22 HZ3 TRP 22 -4.667 -14.358 0.694
120 HH2 TRP 22 HH2 TRP 22 -5.484 -14.270 -1.584
121 H ASP 23 H ASP 23 -0.614 -8.801 -0.375
122 HA ASP 23 HA ASP 23 2.048 -8.132 -1.537
123 1HB ASP 23 1HB ASP 23 -0.740 -7.219 -2.347
124 2HB ASP 23 2HB ASP 23 0.767 -6.726 -3.124
125 H MET 24 H MET 24 0.152 -7.385 0.984
126 HA MET 24 HA MET 24 0.025 -4.659 1.053
127 1HB MET 24 1HB MET 24 -0.027 -6.677 3.162
128 2HB MET 24 2HB MET 24 0.294 -5.008 3.671
129 1HG MET 24 1HG MET 24 -2.043 -6.017 2.096
130 2HG MET 24 2HG MET 24 -2.047 -5.402 3.764
131 1HE MET 24 1HE MET 24 -3.934 -2.626 1.859
132 2HE MET 24 2HE MET 24 -3.846 -3.584 3.341
133 3HE MET 24 3HE MET 24 -4.015 -4.400 1.789
134 HA PRO 25 HA PRO 25 4.306 -4.183 3.463
135 1HB PRO 25 1HB PRO 25 5.646 -6.496 2.103
136 2HB PRO 25 2HB PRO 25 5.946 -5.827 3.720
137 1HG PRO 25 1HG PRO 25 4.606 -8.080 3.484
138 2HG PRO 25 2HG PRO 25 4.046 -6.835 4.617
139 1HD PRO 25 1HD PRO 25 2.967 -7.560 1.919
140 2HD PRO 25 2HD PRO 25 2.103 -7.109 3.408
141 H GLU 26 H GLU 26 4.443 -5.811 0.384
142 HA GLU 26 HA GLU 26 6.240 -4.238 -1.032
143 1HB GLU 26 1HB GLU 26 3.942 -5.992 -1.719
144 2HB GLU 26 2HB GLU 26 4.920 -5.332 -3.013
145 1HG GLU 26 1HG GLU 26 5.791 -7.105 -0.747
146 2HG GLU 26 2HG GLU 26 5.656 -7.548 -2.463
147 H HIS 27 H HIS 27 2.739 -4.069 -1.048
148 HA HIS 27 HA HIS 27 2.515 -1.791 -2.699
149 1HB HIS 27 1HB HIS 27 0.770 -3.406 -2.324
150 2HB HIS 27 2HB HIS 27 0.642 -2.953 -0.628
151 HD1 HIS 27 HD1 HIS 27 -0.879 -2.182 -3.892
152 HD2 HIS 27 HD2 HIS 27 -0.318 -0.298 -0.270
153 HE1 HIS 27 HE1 HIS 27 -2.574 -0.294 -3.831
154 H MET 28 H MET 28 2.801 -2.196 0.755
155 HA MET 28 HA MET 28 2.481 0.481 1.478
156 1HB MET 28 1HB MET 28 4.005 -1.715 2.902
157 2HB MET 28 2HB MET 28 3.887 -0.082 3.538
158 1HG MET 28 1HG MET 28 1.354 -1.458 2.848
159 2HG MET 28 2HG MET 28 2.220 -2.008 4.274
160 1HE MET 28 1HE MET 28 0.738 2.366 3.812
161 2HE MET 28 2HE MET 28 0.585 1.171 2.520
162 3HE MET 28 3HE MET 28 2.176 1.774 2.999
163 H ASP 29 H ASP 29 5.254 -1.305 0.321
164 HA ASP 29 HA ASP 29 7.203 0.747 0.883
165 1HB ASP 29 1HB ASP 29 7.900 -1.606 0.432
166 2HB ASP 29 2HB ASP 29 7.320 -1.430 -1.231
167 H TYR 30 H TYR 30 5.061 0.074 -1.764
168 HA TYR 30 HA TYR 30 6.113 1.967 -3.564
169 1HB TYR 30 1HB TYR 30 4.421 0.151 -4.097
170 2HB TYR 30 2HB TYR 30 3.214 1.159 -3.289
171 HD1 TYR 30 HD1 TYR 30 5.050 0.543 -6.316
172 HD2 TYR 30 HD2 TYR 30 2.671 3.417 -4.292
173 HE1 TYR 30 HE1 TYR 30 4.641 1.695 -8.448
174 HE2 TYR 30 HE2 TYR 30 2.250 4.577 -6.418
175 HH TYR 30 HH TYR 30 3.519 4.760 -8.634
176 H HIS 31 H HIS 31 3.494 2.263 -1.140
177 HA HIS 31 HA HIS 31 3.089 5.094 -1.638
178 1HB HIS 31 1HB HIS 31 2.387 3.490 0.827
179 2HB HIS 31 2HB HIS 31 2.157 5.234 0.731
180 HD1 HIS 31 HD1 HIS 31 0.350 5.922 -1.304
181 HD2 HIS 31 HD2 HIS 31 0.321 2.088 0.213
182 HE1 HIS 31 HE1 HIS 31 -1.909 4.987 -1.900
183 H PHE 32 H PHE 32 5.186 3.279 0.482
184 HA PHE 32 HA PHE 32 6.021 5.276 2.223
185 1HB PHE 32 1HB PHE 32 6.481 2.750 2.267
186 2HB PHE 32 2HB PHE 32 7.762 3.073 1.096
187 HD1 PHE 32 HD1 PHE 32 6.894 2.795 4.490
188 HD2 PHE 32 HD2 PHE 32 9.594 4.767 1.865
189 HE1 PHE 32 HE1 PHE 32 8.418 3.218 6.378
190 HE2 PHE 32 HE2 PHE 32 11.122 5.190 3.739
191 HZ PHE 32 HZ PHE 32 10.534 4.417 6.004
192 H ALA 33 H ALA 33 7.491 4.090 -0.706
193 HA ALA 33 HA ALA 33 9.563 6.011 -0.941
194 1HB ALA 33 1HB ALA 33 8.230 4.404 -3.122
195 2HB ALA 33 2HB ALA 33 9.580 3.860 -2.130
196 3HB ALA 33 3HB ALA 33 9.793 5.212 -3.245
197 H LEU 34 H LEU 34 6.384 5.816 -2.393
198 HA LEU 34 HA LEU 34 6.522 8.059 -4.087
199 1HB LEU 34 1HB LEU 34 4.855 6.238 -4.225
200 2HB LEU 34 2HB LEU 34 4.092 6.872 -2.771
201 HG LEU 34 HG LEU 34 3.504 8.915 -3.986
202 1HD1 LEU 34 1HD1 LEU 34 4.711 7.489 -6.351
203 2HD1 LEU 34 2HD1 LEU 34 5.318 8.971 -5.605
204 3HD1 LEU 34 3HD1 LEU 34 3.763 8.971 -6.429
205 1HD2 LEU 34 1HD2 LEU 34 1.816 7.911 -5.424
206 2HD2 LEU 34 2HD2 LEU 34 1.948 7.045 -3.893
207 3HD2 LEU 34 3HD2 LEU 34 2.670 6.373 -5.353
208 H GLU 35 H GLU 35 5.349 7.761 -0.760
209 HA GLU 35 HA GLU 35 4.702 10.566 -0.646
210 1HB GLU 35 1HB GLU 35 4.554 8.333 1.378
211 2HB GLU 35 2HB GLU 35 4.127 10.002 1.750
212 1HG GLU 35 1HG GLU 35 2.350 9.986 0.174
213 2HG GLU 35 2HG GLU 35 2.885 8.432 -0.481
214 H LEU 36 H LEU 36 7.446 8.617 -0.085
215 HA LEU 36 HA LEU 36 8.719 10.455 1.702
216 1HB LEU 36 1HB LEU 36 9.284 8.051 1.689
217 2HB LEU 36 2HB LEU 36 9.782 8.183 0.007
218 HG LEU 36 HG LEU 36 11.672 9.533 0.658
219 1HD1 LEU 36 1HD1 LEU 36 10.727 10.629 2.646
220 2HD1 LEU 36 2HD1 LEU 36 12.236 9.808 3.057
221 3HD1 LEU 36 3HD1 LEU 36 10.687 9.081 3.488
222 1HD2 LEU 36 1HD2 LEU 36 11.421 6.991 2.252
223 2HD2 LEU 36 2HD2 LEU 36 12.935 7.801 1.841
224 3HD2 LEU 36 3HD2 LEU 36 11.920 7.125 0.567
225 H GLN 37 H GLN 37 8.221 10.169 -1.668
226 HA GLN 37 HA GLN 37 10.395 11.700 -2.629
227 1HB GLN 37 1HB GLN 37 7.594 11.549 -3.775
228 2HB GLN 37 2HB GLN 37 9.013 12.170 -4.619
229 1HG GLN 37 1HG GLN 37 8.467 9.331 -3.771
230 2HG GLN 37 2HG GLN 37 8.504 9.975 -5.421
231 1HE2 GLN 37 1HE2 GLN 37 10.311 8.861 -2.754
232 2HE2 GLN 37 2HE2 GLN 37 11.875 8.865 -3.505
233 H LYS 38 H LYS 38 7.204 12.585 -1.496
234 HA LYS 38 HA LYS 38 7.733 15.413 -1.903
235 1HB LYS 38 1HB LYS 38 5.365 15.704 -1.189
236 2HB LYS 38 2HB LYS 38 5.564 14.653 -2.596
237 1HG LYS 38 1HG LYS 38 5.240 12.703 -1.202
238 2HG LYS 38 2HG LYS 38 5.114 13.727 0.238
239 1HD LYS 38 1HD LYS 38 3.125 14.786 -0.714
240 2HD LYS 38 2HD LYS 38 3.251 13.760 -2.143
241 1HE LYS 38 1HE LYS 38 2.981 11.780 -0.715
242 2HE LYS 38 2HE LYS 38 2.815 12.824 0.697
243 1HZ LYS 38 1HZ LYS 38 0.670 12.128 -0.109
244 2HZ LYS 38 2HZ LYS 38 0.987 12.733 -1.643
245 3HZ LYS 38 3HZ LYS 38 0.839 13.780 -0.341
246 H SER 39 H SER 39 9.106 13.764 0.187
247 HA SER 39 HA SER 39 8.354 15.412 2.471
248 1HB SER 39 1HB SER 39 9.383 12.569 2.482
249 2HB SER 39 2HB SER 39 9.163 13.561 3.928
250 HG SER 39 HG SER 39 7.227 12.419 2.226
Start of MODEL 11
1 H ALA 6 H ALA 6 -9.478 -14.715 -4.086
2 HA ALA 6 HA ALA 6 -9.729 -15.401 -1.393
3 1HB ALA 6 1HB ALA 6 -7.598 -15.411 -2.574
4 2HB ALA 6 2HB ALA 6 -7.515 -14.400 -1.127
5 3HB ALA 6 3HB ALA 6 -7.662 -13.654 -2.717
6 H GLU 7 H GLU 7 -10.555 -14.320 0.246
7 HA GLU 7 HA GLU 7 -11.253 -11.506 -0.048
8 1HB GLU 7 1HB GLU 7 -11.982 -13.552 2.032
9 2HB GLU 7 2HB GLU 7 -12.489 -11.858 2.088
10 1HG GLU 7 1HG GLU 7 -13.660 -12.143 -0.015
11 2HG GLU 7 2HG GLU 7 -13.120 -13.814 -0.089
12 H ASP 8 H ASP 8 -8.573 -12.797 0.594
13 HA ASP 8 HA ASP 8 -7.899 -11.447 3.134
14 1HB ASP 8 1HB ASP 8 -6.232 -13.284 1.367
15 2HB ASP 8 2HB ASP 8 -5.708 -12.589 2.910
16 H GLN 9 H GLN 9 -8.689 -9.703 1.616
17 HA GLN 9 HA GLN 9 -6.328 -8.357 0.668
18 1HB GLN 9 1HB GLN 9 -9.074 -8.237 -0.607
19 2HB GLN 9 2HB GLN 9 -7.670 -7.299 -1.111
20 1HG GLN 9 1HG GLN 9 -6.568 -9.384 -1.769
21 2HG GLN 9 2HG GLN 9 -8.024 -10.283 -1.317
22 1HE2 GLN 9 1HE2 GLN 9 -9.798 -8.209 -2.312
23 2HE2 GLN 9 2HE2 GLN 9 -9.702 -8.273 -4.046
24 H VAL 10 H VAL 10 -6.172 -6.656 1.957
25 HA VAL 10 HA VAL 10 -8.594 -5.723 3.287
26 HB VAL 10 HB VAL 10 -7.118 -4.707 5.010
27 1HG1 VAL 10 1HG1 VAL 10 -6.564 -7.631 4.545
28 2HG1 VAL 10 2HG1 VAL 10 -7.984 -6.967 5.346
29 3HG1 VAL 10 3HG1 VAL 10 -6.391 -6.782 6.080
30 1HG2 VAL 10 1HG2 VAL 10 -4.876 -6.091 3.534
31 2HG2 VAL 10 2HG2 VAL 10 -4.738 -5.268 5.092
32 3HG2 VAL 10 3HG2 VAL 10 -5.132 -4.348 3.640
33 HA PRO 11 HA PRO 11 -8.318 -2.039 0.922
34 1HB PRO 11 1HB PRO 11 -9.410 -0.288 2.633
35 2HB PRO 11 2HB PRO 11 -10.379 -1.344 1.592
36 1HG PRO 11 1HG PRO 11 -9.748 -1.589 4.501
37 2HG PRO 11 2HG PRO 11 -11.215 -2.069 3.625
38 1HD PRO 11 1HD PRO 11 -9.316 -3.853 4.428
39 2HD PRO 11 2HD PRO 11 -10.329 -4.090 2.989
40 H CYS 12 H CYS 12 -6.607 -0.918 0.721
41 HA CYS 12 HA CYS 12 -4.692 -0.505 2.775
42 1HB CYS 12 1HB CYS 12 -4.025 -0.936 0.515
43 2HB CYS 12 2HB CYS 12 -4.976 0.433 -0.058
44 H GLU 13 H GLU 13 -5.115 1.076 4.318
45 HA GLU 13 HA GLU 13 -6.980 3.086 4.310
46 1HB GLU 13 1HB GLU 13 -4.333 2.926 5.726
47 2HB GLU 13 2HB GLU 13 -5.412 4.283 5.940
48 1HG GLU 13 1HG GLU 13 -5.600 2.676 7.764
49 2HG GLU 13 2HG GLU 13 -7.107 2.844 6.884
50 H LYS 14 H LYS 14 -3.836 3.239 2.899
51 HA LYS 14 HA LYS 14 -3.953 6.047 2.678
52 1HB LYS 14 1HB LYS 14 -1.898 4.073 1.854
53 2HB LYS 14 2HB LYS 14 -1.663 5.750 1.381
54 1HG LYS 14 1HG LYS 14 -1.962 6.332 3.806
55 2HG LYS 14 2HG LYS 14 -1.932 4.611 4.159
56 1HD LYS 14 1HD LYS 14 0.308 4.477 3.153
57 2HD LYS 14 2HD LYS 14 0.229 6.224 2.848
58 1HE LYS 14 1HE LYS 14 -0.054 6.592 5.301
59 2HE LYS 14 2HE LYS 14 0.112 4.858 5.528
60 1HZ LYS 14 1HZ LYS 14 2.319 4.930 4.754
61 2HZ LYS 14 2HZ LYS 14 2.149 6.052 5.978
62 3HZ LYS 14 3HZ LYS 14 2.242 6.569 4.366
63 H CYS 15 H CYS 15 -5.172 3.771 0.888
64 HA CYS 15 HA CYS 15 -5.678 5.669 -1.319
65 1HB CYS 15 1HB CYS 15 -5.216 4.179 -3.195
66 2HB CYS 15 2HB CYS 15 -3.796 4.455 -2.176
67 H GLY 16 H GLY 16 -6.968 2.910 0.314
68 1HA GLY 16 1HA GLY 16 -9.254 2.522 0.532
69 2HA GLY 16 2HA GLY 16 -9.530 3.488 -0.921
70 H SER 17 H SER 17 -7.136 1.577 -1.837
71 HA SER 17 HA SER 17 -8.866 -0.135 -3.358
72 1HB SER 17 1HB SER 17 -5.861 0.013 -3.156
73 2HB SER 17 2HB SER 17 -6.759 -0.801 -4.448
74 HG SER 17 HG SER 17 -7.515 1.152 -5.125
75 H LEU 18 H LEU 18 -9.164 -2.311 -3.038
76 HA LEU 18 HA LEU 18 -8.399 -3.495 -0.517
77 1HB LEU 18 1HB LEU 18 -9.769 -4.637 -2.938
78 2HB LEU 18 2HB LEU 18 -9.586 -5.461 -1.392
79 HG LEU 18 HG LEU 18 -11.127 -2.898 -1.756
80 1HD1 LEU 18 1HD1 LEU 18 -13.127 -4.301 -1.590
81 2HD1 LEU 18 2HD1 LEU 18 -12.114 -5.744 -1.571
82 3HD1 LEU 18 3HD1 LEU 18 -12.168 -4.725 -3.009
83 1HD2 LEU 18 1HD2 LEU 18 -10.299 -3.283 0.503
84 2HD2 LEU 18 2HD2 LEU 18 -11.026 -4.888 0.502
85 3HD2 LEU 18 3HD2 LEU 18 -12.052 -3.455 0.432
86 H VAL 19 H VAL 19 -6.420 -3.990 -0.324
87 HA VAL 19 HA VAL 19 -4.991 -5.092 -2.645
88 HB VAL 19 HB VAL 19 -3.820 -3.860 -0.150
89 1HG1 VAL 19 1HG1 VAL 19 -1.704 -3.820 -1.389
90 2HG1 VAL 19 2HG1 VAL 19 -2.482 -4.678 -2.719
91 3HG1 VAL 19 3HG1 VAL 19 -2.301 -5.464 -1.154
92 1HG2 VAL 19 1HG2 VAL 19 -3.277 -1.941 -1.565
93 2HG2 VAL 19 2HG2 VAL 19 -5.017 -2.208 -1.465
94 3HG2 VAL 19 3HG2 VAL 19 -4.127 -2.702 -2.908
95 HA PRO 20 HA PRO 20 -4.977 -9.105 -0.698
96 1HB PRO 20 1HB PRO 20 -2.425 -9.232 -2.243
97 2HB PRO 20 2HB PRO 20 -3.748 -10.414 -2.164
98 1HG PRO 20 1HG PRO 20 -3.457 -8.837 -4.283
99 2HG PRO 20 2HG PRO 20 -5.071 -9.220 -3.645
100 1HD PRO 20 1HD PRO 20 -3.490 -6.692 -3.408
101 2HD PRO 20 2HD PRO 20 -5.246 -6.941 -3.534
102 H VAL 21 H VAL 21 -4.281 -9.651 1.091
103 HA VAL 21 HA VAL 21 -2.776 -8.092 2.785
104 HB VAL 21 HB VAL 21 -4.453 -9.890 3.332
105 1HG1 VAL 21 1HG1 VAL 21 -2.144 -11.771 3.115
106 2HG1 VAL 21 2HG1 VAL 21 -3.616 -11.757 2.150
107 3HG1 VAL 21 3HG1 VAL 21 -3.692 -12.139 3.873
108 1HG2 VAL 21 1HG2 VAL 21 -3.290 -8.729 5.088
109 2HG2 VAL 21 2HG2 VAL 21 -1.973 -9.925 5.033
110 3HG2 VAL 21 3HG2 VAL 21 -3.622 -10.406 5.489
111 H TRP 22 H TRP 22 -1.676 -10.805 0.859
112 HA TRP 22 HA TRP 22 0.953 -10.859 1.919
113 1HB TRP 22 1HB TRP 22 1.400 -12.412 -0.013
114 2HB TRP 22 2HB TRP 22 0.085 -12.887 1.068
115 HD1 TRP 22 HD1 TRP 22 0.607 -11.319 -2.426
116 HE1 TRP 22 HE1 TRP 22 -1.429 -11.866 -3.862
117 HE3 TRP 22 HE3 TRP 22 -2.263 -13.615 1.102
118 HZ2 TRP 22 HZ2 TRP 22 -3.958 -13.132 -3.554
119 HZ3 TRP 22 HZ3 TRP 22 -4.492 -14.472 0.433
120 HH2 TRP 22 HH2 TRP 22 -5.293 -14.224 -1.839
121 H ASP 23 H ASP 23 -0.473 -8.734 -0.320
122 HA ASP 23 HA ASP 23 2.133 -8.093 -1.593
123 1HB ASP 23 1HB ASP 23 -0.695 -7.301 -2.310
124 2HB ASP 23 2HB ASP 23 0.746 -6.587 -3.045
125 H MET 24 H MET 24 0.407 -7.334 1.014
126 HA MET 24 HA MET 24 0.406 -4.599 1.030
127 1HB MET 24 1HB MET 24 0.381 -6.537 3.236
128 2HB MET 24 2HB MET 24 0.771 -4.852 3.635
129 1HG MET 24 1HG MET 24 -1.674 -5.873 2.235
130 2HG MET 24 2HG MET 24 -1.575 -5.142 3.854
131 1HE MET 24 1HE MET 24 -3.430 -2.401 1.801
132 2HE MET 24 2HE MET 24 -3.370 -3.298 3.320
133 3HE MET 24 3HE MET 24 -3.591 -4.167 1.799
134 HA PRO 25 HA PRO 25 4.961 -4.394 2.930
135 1HB PRO 25 1HB PRO 25 5.867 -6.713 1.255
136 2HB PRO 25 2HB PRO 25 6.540 -6.108 2.785
137 1HG PRO 25 1HG PRO 25 5.043 -8.271 2.802
138 2HG PRO 25 2HG PRO 25 4.804 -7.030 4.043
139 1HD PRO 25 1HD PRO 25 3.130 -7.630 1.631
140 2HD PRO 25 2HD PRO 25 2.641 -7.115 3.263
141 H GLU 26 H GLU 26 4.651 -5.932 -0.225
142 HA GLU 26 HA GLU 26 6.254 -4.344 -1.826
143 1HB GLU 26 1HB GLU 26 3.848 -6.021 -2.253
144 2HB GLU 26 2HB GLU 26 4.447 -5.163 -3.650
145 1HG GLU 26 1HG GLU 26 5.276 -7.397 -3.666
146 2HG GLU 26 2HG GLU 26 6.634 -6.339 -3.255
147 H HIS 27 H HIS 27 2.780 -4.062 -1.418
148 HA HIS 27 HA HIS 27 2.490 -1.754 -3.021
149 1HB HIS 27 1HB HIS 27 0.754 -3.412 -2.666
150 2HB HIS 27 2HB HIS 27 0.670 -2.998 -0.961
151 HD1 HIS 27 HD1 HIS 27 -0.934 -2.145 -4.165
152 HD2 HIS 27 HD2 HIS 27 -0.275 -0.347 -0.499
153 HE1 HIS 27 HE1 HIS 27 -2.593 -0.247 -4.021
154 H MET 28 H MET 28 2.680 -2.149 0.480
155 HA MET 28 HA MET 28 2.301 0.607 0.926
156 1HB MET 28 1HB MET 28 3.363 -1.539 2.739
157 2HB MET 28 2HB MET 28 3.252 0.150 3.261
158 1HG MET 28 1HG MET 28 0.969 -1.592 2.334
159 2HG MET 28 2HG MET 28 1.323 -1.140 4.000
160 1HE MET 28 1HE MET 28 0.627 2.680 4.061
161 2HE MET 28 2HE MET 28 2.187 1.939 3.721
162 3HE MET 28 3HE MET 28 1.139 1.254 4.965
163 H ASP 29 H ASP 29 5.079 -1.284 0.170
164 HA ASP 29 HA ASP 29 7.048 0.740 0.893
165 1HB ASP 29 1HB ASP 29 7.610 -1.719 0.595
166 2HB ASP 29 2HB ASP 29 7.274 -1.519 -1.128
167 H TYR 30 H TYR 30 5.051 0.041 -1.824
168 HA TYR 30 HA TYR 30 6.191 1.928 -3.603
169 1HB TYR 30 1HB TYR 30 4.560 0.129 -4.267
170 2HB TYR 30 2HB TYR 30 3.305 1.034 -3.420
171 HD1 TYR 30 HD1 TYR 30 2.404 3.102 -4.403
172 HD2 TYR 30 HD2 TYR 30 5.391 0.844 -6.403
173 HE1 TYR 30 HE1 TYR 30 1.892 4.288 -6.496
174 HE2 TYR 30 HE2 TYR 30 4.894 2.033 -8.487
175 HH TYR 30 HH TYR 30 3.222 3.256 -9.519
176 H HIS 31 H HIS 31 3.553 2.227 -1.196
177 HA HIS 31 HA HIS 31 3.167 5.020 -1.771
178 1HB HIS 31 1HB HIS 31 2.383 3.495 0.718
179 2HB HIS 31 2HB HIS 31 2.188 5.242 0.592
180 HD1 HIS 31 HD1 HIS 31 0.425 5.923 -1.529
181 HD2 HIS 31 HD2 HIS 31 0.282 2.161 0.159
182 HE1 HIS 31 HE1 HIS 31 -1.786 4.965 -2.226
183 H PHE 32 H PHE 32 5.305 3.308 0.527
184 HA PHE 32 HA PHE 32 6.080 5.531 1.977
185 1HB PHE 32 1HB PHE 32 7.052 2.808 1.508
186 2HB PHE 32 2HB PHE 32 8.286 3.955 2.029
187 HD1 PHE 32 HD1 PHE 32 5.021 2.397 2.942
188 HD2 PHE 32 HD2 PHE 32 8.369 4.669 4.278
189 HE1 PHE 32 HE1 PHE 32 4.303 2.090 5.258
190 HE2 PHE 32 HE2 PHE 32 7.640 4.369 6.606
191 HZ PHE 32 HZ PHE 32 5.606 3.075 7.098
192 H ALA 33 H ALA 33 7.635 4.022 -0.827
193 HA ALA 33 HA ALA 33 9.666 5.950 -1.113
194 1HB ALA 33 1HB ALA 33 9.717 3.776 -2.252
195 2HB ALA 33 2HB ALA 33 9.931 5.100 -3.396
196 3HB ALA 33 3HB ALA 33 8.375 4.279 -3.277
197 H LEU 34 H LEU 34 6.430 5.743 -2.402
198 HA LEU 34 HA LEU 34 6.533 7.954 -4.157
199 1HB LEU 34 1HB LEU 34 4.795 6.175 -4.162
200 2HB LEU 34 2HB LEU 34 4.136 6.880 -2.691
201 HG LEU 34 HG LEU 34 3.562 8.921 -3.935
202 1HD1 LEU 34 1HD1 LEU 34 5.309 8.823 -5.638
203 2HD1 LEU 34 2HD1 LEU 34 3.713 8.935 -6.376
204 3HD1 LEU 34 3HD1 LEU 34 4.559 7.388 -6.336
205 1HD2 LEU 34 1HD2 LEU 34 2.552 6.373 -5.181
206 2HD2 LEU 34 2HD2 LEU 34 1.761 7.951 -5.252
207 3HD2 LEU 34 3HD2 LEU 34 1.942 7.121 -3.704
208 H GLU 35 H GLU 35 5.626 7.689 -0.729
209 HA GLU 35 HA GLU 35 4.871 10.435 -0.476
210 1HB GLU 35 1HB GLU 35 5.535 8.376 1.621
211 2HB GLU 35 2HB GLU 35 4.989 10.003 1.983
212 1HG GLU 35 1HG GLU 35 2.890 9.469 0.732
213 2HG GLU 35 2HG GLU 35 3.467 7.795 0.633
214 H LEU 36 H LEU 36 7.847 8.656 -0.324
215 HA LEU 36 HA LEU 36 9.219 10.614 1.246
216 1HB LEU 36 1HB LEU 36 9.691 8.206 1.378
217 2HB LEU 36 2HB LEU 36 10.073 8.192 -0.339
218 HG LEU 36 HG LEU 36 12.071 9.449 0.065
219 1HD1 LEU 36 1HD1 LEU 36 12.776 9.968 2.393
220 2HD1 LEU 36 2HD1 LEU 36 11.203 9.422 2.977
221 3HD1 LEU 36 3HD1 LEU 36 11.319 10.843 1.940
222 1HD2 LEU 36 1HD2 LEU 36 13.291 7.802 1.405
223 2HD2 LEU 36 2HD2 LEU 36 12.176 7.044 0.267
224 3HD2 LEU 36 3HD2 LEU 36 11.757 7.149 1.978
225 H GLN 37 H GLN 37 8.558 9.933 -2.047
226 HA GLN 37 HA GLN 37 10.548 11.737 -3.079
227 1HB GLN 37 1HB GLN 37 8.216 10.390 -4.432
228 2HB GLN 37 2HB GLN 37 9.401 11.406 -5.259
229 1HG GLN 37 1HG GLN 37 9.938 8.813 -3.837
230 2HG GLN 37 2HG GLN 37 9.877 9.063 -5.587
231 1HE2 GLN 37 1HE2 GLN 37 11.571 10.181 -6.584
232 2HE2 GLN 37 2HE2 GLN 37 13.106 10.365 -5.788
233 H LYS 38 H LYS 38 7.144 11.928 -2.250
234 HA LYS 38 HA LYS 38 7.177 14.598 -3.387
235 1HB LYS 38 1HB LYS 38 4.696 14.616 -3.283
236 2HB LYS 38 2HB LYS 38 5.391 13.386 -4.331
237 1HG LYS 38 1HG LYS 38 3.569 12.344 -3.309
238 2HG LYS 38 2HG LYS 38 4.953 11.781 -2.367
239 1HD LYS 38 1HD LYS 38 4.419 13.291 -0.587
240 2HD LYS 38 2HD LYS 38 3.197 14.100 -1.563
241 1HE LYS 38 1HE LYS 38 1.928 11.972 -1.654
242 2HE LYS 38 2HE LYS 38 3.098 11.246 -0.566
243 1HZ LYS 38 1HZ LYS 38 1.386 13.589 0.073
244 2HZ LYS 38 2HZ LYS 38 2.470 12.866 1.135
245 3HZ LYS 38 3HZ LYS 38 1.125 12.025 0.604
246 H SER 39 H SER 39 7.111 13.190 -0.259
247 HA SER 39 HA SER 39 7.145 15.876 0.792
248 1HB SER 39 1HB SER 39 5.282 13.721 1.818
249 2HB SER 39 2HB SER 39 5.544 15.285 2.589
250 HG SER 39 HG SER 39 4.993 15.901 0.182
Start of MODEL 12
1 H ALA 6 H ALA 6 -12.217 -14.996 3.546
2 HA ALA 6 HA ALA 6 -11.769 -13.612 1.842
3 1HB ALA 6 1HB ALA 6 -13.515 -12.096 1.012
4 2HB ALA 6 2HB ALA 6 -14.422 -12.329 2.508
5 3HB ALA 6 3HB ALA 6 -14.175 -13.683 1.406
6 H GLU 7 H GLU 7 -10.862 -13.065 4.464
7 HA GLU 7 HA GLU 7 -10.649 -10.157 4.424
8 1HB GLU 7 1HB GLU 7 -10.291 -12.164 6.613
9 2HB GLU 7 2HB GLU 7 -9.662 -10.517 6.760
10 1HG GLU 7 1HG GLU 7 -12.526 -11.361 6.384
11 2HG GLU 7 2HG GLU 7 -11.784 -10.644 7.819
12 H ASP 8 H ASP 8 -9.215 -12.252 2.834
13 HA ASP 8 HA ASP 8 -6.450 -11.639 3.573
14 1HB ASP 8 1HB ASP 8 -7.572 -13.523 1.488
15 2HB ASP 8 2HB ASP 8 -5.850 -13.202 1.699
16 H GLN 9 H GLN 9 -8.655 -10.067 2.224
17 HA GLN 9 HA GLN 9 -6.719 -8.706 0.637
18 1HB GLN 9 1HB GLN 9 -9.639 -9.007 -0.082
19 2HB GLN 9 2HB GLN 9 -8.669 -7.691 -0.747
20 1HG GLN 9 1HG GLN 9 -7.161 -9.371 -1.712
21 2HG GLN 9 2HG GLN 9 -8.251 -10.644 -1.128
22 1HE2 GLN 9 1HE2 GLN 9 -8.636 -11.326 -3.247
23 2HE2 GLN 9 2HE2 GLN 9 -9.620 -10.408 -4.340
24 H VAL 10 H VAL 10 -6.449 -6.741 1.525
25 HA VAL 10 HA VAL 10 -8.591 -5.714 3.237
26 HB VAL 10 HB VAL 10 -6.937 -4.755 4.797
27 1HG1 VAL 10 1HG1 VAL 10 -6.599 -7.716 4.392
28 2HG1 VAL 10 2HG1 VAL 10 -7.885 -6.915 5.297
29 3HG1 VAL 10 3HG1 VAL 10 -6.217 -6.828 5.868
30 1HG2 VAL 10 1HG2 VAL 10 -4.588 -5.452 4.714
31 2HG2 VAL 10 2HG2 VAL 10 -5.042 -4.516 3.288
32 3HG2 VAL 10 3HG2 VAL 10 -4.891 -6.269 3.181
33 HA PRO 11 HA PRO 11 -8.191 -2.106 0.833
34 1HB PRO 11 1HB PRO 11 -9.223 -0.313 2.478
35 2HB PRO 11 2HB PRO 11 -10.257 -1.448 1.592
36 1HG PRO 11 1HG PRO 11 -9.361 -1.533 4.449
37 2HG PRO 11 2HG PRO 11 -10.942 -1.979 3.764
38 1HD PRO 11 1HD PRO 11 -9.047 -3.803 4.446
39 2HD PRO 11 2HD PRO 11 -10.199 -4.058 3.119
40 H CYS 12 H CYS 12 -6.510 -0.915 0.589
41 HA CYS 12 HA CYS 12 -4.544 -0.545 2.598
42 1HB CYS 12 1HB CYS 12 -3.810 -0.723 0.379
43 2HB CYS 12 2HB CYS 12 -4.956 0.502 -0.174
44 H GLU 13 H GLU 13 -4.971 0.851 4.213
45 HA GLU 13 HA GLU 13 -6.997 2.752 4.317
46 1HB GLU 13 1HB GLU 13 -4.430 2.852 5.883
47 2HB GLU 13 2HB GLU 13 -5.951 3.621 6.317
48 1HG GLU 13 1HG GLU 13 -6.967 1.348 6.450
49 2HG GLU 13 2HG GLU 13 -5.363 0.687 6.177
50 H LYS 14 H LYS 14 -3.918 3.121 2.889
51 HA LYS 14 HA LYS 14 -4.016 5.947 3.016
52 1HB LYS 14 1HB LYS 14 -2.133 4.051 1.715
53 2HB LYS 14 2HB LYS 14 -1.958 5.777 1.410
54 1HG LYS 14 1HG LYS 14 -1.830 6.074 3.907
55 2HG LYS 14 2HG LYS 14 -1.762 4.315 4.037
56 1HD LYS 14 1HD LYS 14 0.254 4.240 2.761
57 2HD LYS 14 2HD LYS 14 0.148 5.968 2.400
58 1HE LYS 14 1HE LYS 14 0.317 6.393 4.868
59 2HE LYS 14 2HE LYS 14 0.657 4.673 5.063
60 1HZ LYS 14 1HZ LYS 14 2.661 4.914 3.773
61 2HZ LYS 14 2HZ LYS 14 2.674 6.168 4.898
62 3HZ LYS 14 3HZ LYS 14 2.207 6.457 3.311
63 H CYS 15 H CYS 15 -5.041 3.659 0.806
64 HA CYS 15 HA CYS 15 -5.819 5.860 -1.036
65 1HB CYS 15 1HB CYS 15 -5.375 4.581 -3.080
66 2HB CYS 15 2HB CYS 15 -3.924 4.807 -2.092
67 H GLY 16 H GLY 16 -6.965 3.031 0.436
68 1HA GLY 16 1HA GLY 16 -9.160 2.443 0.694
69 2HA GLY 16 2HA GLY 16 -9.603 3.551 -0.610
70 H SER 17 H SER 17 -7.135 1.784 -1.808
71 HA SER 17 HA SER 17 -8.884 0.176 -3.427
72 1HB SER 17 1HB SER 17 -5.876 0.323 -3.281
73 2HB SER 17 2HB SER 17 -6.787 -0.394 -4.615
74 HG SER 17 HG SER 17 -7.768 1.837 -4.718
75 H LEU 18 H LEU 18 -8.963 -2.103 -3.387
76 HA LEU 18 HA LEU 18 -8.239 -3.337 -0.864
77 1HB LEU 18 1HB LEU 18 -9.625 -4.443 -3.299
78 2HB LEU 18 2HB LEU 18 -9.407 -5.291 -1.768
79 HG LEU 18 HG LEU 18 -10.979 -2.756 -2.120
80 1HD1 LEU 18 1HD1 LEU 18 -11.899 -5.612 -1.808
81 2HD1 LEU 18 2HD1 LEU 18 -12.052 -4.632 -3.263
82 3HD1 LEU 18 3HD1 LEU 18 -12.956 -4.201 -1.808
83 1HD2 LEU 18 1HD2 LEU 18 -11.832 -3.291 0.129
84 2HD2 LEU 18 2HD2 LEU 18 -10.103 -2.967 0.103
85 3HD2 LEU 18 3HD2 LEU 18 -10.681 -4.628 0.220
86 H VAL 19 H VAL 19 -6.406 -4.119 -0.526
87 HA VAL 19 HA VAL 19 -4.846 -5.120 -2.805
88 HB VAL 19 HB VAL 19 -3.777 -4.072 -0.163
89 1HG1 VAL 19 1HG1 VAL 19 -2.268 -5.628 -1.235
90 2HG1 VAL 19 2HG1 VAL 19 -1.624 -3.987 -1.316
91 3HG1 VAL 19 3HG1 VAL 19 -2.366 -4.716 -2.740
92 1HG2 VAL 19 1HG2 VAL 19 -4.868 -2.273 -1.371
93 2HG2 VAL 19 2HG2 VAL 19 -3.957 -2.679 -2.826
94 3HG2 VAL 19 3HG2 VAL 19 -3.116 -2.065 -1.404
95 HA PRO 20 HA PRO 20 -5.129 -9.145 -0.847
96 1HB PRO 20 1HB PRO 20 -2.478 -9.549 -2.130
97 2HB PRO 20 2HB PRO 20 -3.941 -10.548 -2.237
98 1HG PRO 20 1HG PRO 20 -3.197 -9.035 -4.272
99 2HG PRO 20 2HG PRO 20 -4.912 -9.172 -3.818
100 1HD PRO 20 1HD PRO 20 -2.988 -6.941 -3.280
101 2HD PRO 20 2HD PRO 20 -4.695 -6.876 -3.759
102 H VAL 21 H VAL 21 -4.395 -9.920 0.936
103 HA VAL 21 HA VAL 21 -2.917 -8.416 2.737
104 HB VAL 21 HB VAL 21 -4.566 -10.260 3.232
105 1HG1 VAL 21 1HG1 VAL 21 -2.227 -12.092 2.887
106 2HG1 VAL 21 2HG1 VAL 21 -3.722 -12.061 1.952
107 3HG1 VAL 21 3HG1 VAL 21 -3.756 -12.526 3.652
108 1HG2 VAL 21 1HG2 VAL 21 -3.567 -10.914 5.375
109 2HG2 VAL 21 2HG2 VAL 21 -3.469 -9.185 5.045
110 3HG2 VAL 21 3HG2 VAL 21 -2.037 -10.202 4.856
111 H TRP 22 H TRP 22 -1.771 -10.961 0.623
112 HA TRP 22 HA TRP 22 0.862 -10.945 1.668
113 1HB TRP 22 1HB TRP 22 1.418 -12.376 -0.322
114 2HB TRP 22 2HB TRP 22 0.111 -12.969 0.705
115 HD1 TRP 22 HD1 TRP 22 0.667 -11.349 -2.768
116 HE1 TRP 22 HE1 TRP 22 -1.335 -11.974 -4.266
117 HE3 TRP 22 HE3 TRP 22 -2.236 -13.708 0.691
118 HZ2 TRP 22 HZ2 TRP 22 -3.807 -13.299 -4.019
119 HZ3 TRP 22 HZ3 TRP 22 -4.421 -14.637 -0.040
120 HH2 TRP 22 HH2 TRP 22 -5.160 -14.422 -2.346
121 H ASP 23 H ASP 23 -0.695 -8.789 -0.615
122 HA ASP 23 HA ASP 23 1.886 -8.000 -1.738
123 1HB ASP 23 1HB ASP 23 -0.966 -7.474 -2.531
124 2HB ASP 23 2HB ASP 23 0.308 -6.356 -3.025
125 H MET 24 H MET 24 -0.078 -7.333 0.795
126 HA MET 24 HA MET 24 -0.233 -4.604 0.870
127 1HB MET 24 1HB MET 24 -0.167 -6.568 3.102
128 2HB MET 24 2HB MET 24 -0.219 -4.832 3.440
129 1HG MET 24 1HG MET 24 -2.191 -6.420 1.819
130 2HG MET 24 2HG MET 24 -2.436 -5.788 3.458
131 1HE MET 24 1HE MET 24 -2.470 -1.920 2.772
132 2HE MET 24 2HE MET 24 -1.041 -2.874 3.171
133 3HE MET 24 3HE MET 24 -2.571 -3.178 4.005
134 HA PRO 25 HA PRO 25 4.010 -4.091 3.272
135 1HB PRO 25 1HB PRO 25 5.417 -6.370 1.950
136 2HB PRO 25 2HB PRO 25 5.645 -5.698 3.578
137 1HG PRO 25 1HG PRO 25 4.375 -7.988 3.252
138 2HG PRO 25 2HG PRO 25 3.795 -6.800 4.428
139 1HD PRO 25 1HD PRO 25 2.707 -7.468 1.718
140 2HD PRO 25 2HD PRO 25 1.851 -7.051 3.218
141 H GLU 26 H GLU 26 4.135 -5.769 0.230
142 HA GLU 26 HA GLU 26 5.954 -4.302 -1.322
143 1HB GLU 26 1HB GLU 26 3.356 -5.527 -2.236
144 2HB GLU 26 2HB GLU 26 4.801 -5.332 -3.219
145 1HG GLU 26 1HG GLU 26 4.463 -7.173 -0.860
146 2HG GLU 26 2HG GLU 26 4.452 -7.628 -2.568
147 H HIS 27 H HIS 27 2.483 -3.931 -1.144
148 HA HIS 27 HA HIS 27 2.353 -1.683 -2.825
149 1HB HIS 27 1HB HIS 27 0.565 -3.258 -2.523
150 2HB HIS 27 2HB HIS 27 0.408 -2.832 -0.822
151 HD1 HIS 27 HD1 HIS 27 -1.004 -1.996 -4.104
152 HD2 HIS 27 HD2 HIS 27 -0.483 -0.149 -0.452
153 HE1 HIS 27 HE1 HIS 27 -2.609 -0.032 -4.083
154 H MET 28 H MET 28 2.380 -1.987 0.691
155 HA MET 28 HA MET 28 2.072 0.806 1.129
156 1HB MET 28 1HB MET 28 3.291 -1.185 3.061
157 2HB MET 28 2HB MET 28 2.762 0.447 3.422
158 1HG MET 28 1HG MET 28 0.913 -1.709 2.439
159 2HG MET 28 2HG MET 28 1.114 -1.241 4.126
160 1HE MET 28 1HE MET 28 0.101 0.863 5.219
161 2HE MET 28 2HE MET 28 -0.423 2.291 4.327
162 3HE MET 28 3HE MET 28 1.266 1.790 4.281
163 H ASP 29 H ASP 29 4.839 -1.172 0.406
164 HA ASP 29 HA ASP 29 6.779 0.810 1.194
165 1HB ASP 29 1HB ASP 29 7.333 -1.618 0.975
166 2HB ASP 29 2HB ASP 29 7.033 -1.492 -0.763
167 H TYR 30 H TYR 30 4.905 0.091 -1.626
168 HA TYR 30 HA TYR 30 6.202 1.869 -3.410
169 1HB TYR 30 1HB TYR 30 4.522 0.069 -4.022
170 2HB TYR 30 2HB TYR 30 3.272 1.129 -3.364
171 HD1 TYR 30 HD1 TYR 30 2.787 3.307 -4.530
172 HD2 TYR 30 HD2 TYR 30 5.400 0.388 -6.166
173 HE1 TYR 30 HE1 TYR 30 2.573 4.365 -6.737
174 HE2 TYR 30 HE2 TYR 30 5.199 1.434 -8.374
175 HH TYR 30 HH TYR 30 3.882 4.490 -8.806
176 H HIS 31 H HIS 31 3.451 2.348 -1.178
177 HA HIS 31 HA HIS 31 3.213 5.156 -1.846
178 1HB HIS 31 1HB HIS 31 2.279 3.750 0.658
179 2HB HIS 31 2HB HIS 31 2.127 5.488 0.431
180 HD1 HIS 31 HD1 HIS 31 0.495 6.082 -1.812
181 HD2 HIS 31 HD2 HIS 31 0.206 2.415 0.067
182 HE1 HIS 31 HE1 HIS 31 -1.724 5.107 -2.537
183 H PHE 32 H PHE 32 5.167 3.332 0.391
184 HA PHE 32 HA PHE 32 5.916 5.384 2.127
185 1HB PHE 32 1HB PHE 32 6.294 2.839 2.301
186 2HB PHE 32 2HB PHE 32 7.698 3.107 1.260
187 HD1 PHE 32 HD1 PHE 32 9.563 4.557 2.099
188 HD2 PHE 32 HD2 PHE 32 6.338 3.281 4.558
189 HE1 PHE 32 HE1 PHE 32 10.884 5.110 4.096
190 HE2 PHE 32 HE2 PHE 32 7.653 3.844 6.573
191 HZ PHE 32 HZ PHE 32 9.929 4.757 6.335
192 H ALA 33 H ALA 33 7.474 4.070 -0.749
193 HA ALA 33 HA ALA 33 9.564 5.948 -0.931
194 1HB ALA 33 1HB ALA 33 8.238 4.391 -3.156
195 2HB ALA 33 2HB ALA 33 9.586 3.825 -2.161
196 3HB ALA 33 3HB ALA 33 9.802 5.196 -3.249
197 H LEU 34 H LEU 34 6.424 5.820 -2.485
198 HA LEU 34 HA LEU 34 6.553 8.147 -4.019
199 1HB LEU 34 1HB LEU 34 4.851 6.343 -4.168
200 2HB LEU 34 2HB LEU 34 4.117 6.974 -2.699
201 HG LEU 34 HG LEU 34 3.507 9.034 -3.869
202 1HD1 LEU 34 1HD1 LEU 34 5.353 9.147 -5.441
203 2HD1 LEU 34 2HD1 LEU 34 3.810 9.208 -6.285
204 3HD1 LEU 34 3HD1 LEU 34 4.748 7.712 -6.270
205 1HD2 LEU 34 1HD2 LEU 34 1.966 7.115 -3.879
206 2HD2 LEU 34 2HD2 LEU 34 2.688 6.562 -5.390
207 3HD2 LEU 34 3HD2 LEU 34 1.821 8.095 -5.338
208 H GLU 35 H GLU 35 5.624 7.743 -0.662
209 HA GLU 35 HA GLU 35 4.951 10.512 -0.299
210 1HB GLU 35 1HB GLU 35 5.091 8.187 1.594
211 2HB GLU 35 2HB GLU 35 4.736 9.824 2.129
212 1HG GLU 35 1HG GLU 35 2.754 9.898 0.821
213 2HG GLU 35 2HG GLU 35 3.157 8.354 0.043
214 H LEU 36 H LEU 36 7.816 8.579 -0.019
215 HA LEU 36 HA LEU 36 9.176 10.456 1.705
216 1HB LEU 36 1HB LEU 36 9.708 7.941 1.477
217 2HB LEU 36 2HB LEU 36 10.308 8.303 -0.133
218 HG LEU 36 HG LEU 36 12.082 7.918 1.556
219 1HD1 LEU 36 1HD1 LEU 36 12.101 10.698 0.426
220 2HD1 LEU 36 2HD1 LEU 36 12.649 9.227 -0.381
221 3HD1 LEU 36 3HD1 LEU 36 13.502 9.821 1.043
222 1HD2 LEU 36 1HD2 LEU 36 12.546 9.608 3.258
223 2HD2 LEU 36 2HD2 LEU 36 10.984 8.831 3.509
224 3HD2 LEU 36 3HD2 LEU 36 11.062 10.454 2.823
225 H GLN 37 H GLN 37 8.689 9.819 -1.632
226 HA GLN 37 HA GLN 37 10.338 11.982 -2.587
227 1HB GLN 37 1HB GLN 37 8.162 10.398 -3.974
228 2HB GLN 37 2HB GLN 37 9.301 11.488 -4.770
229 1HG GLN 37 1HG GLN 37 10.092 9.011 -3.257
230 2HG GLN 37 2HG GLN 37 9.809 9.064 -5.001
231 1HE2 GLN 37 1HE2 GLN 37 11.872 8.392 -5.362
232 2HE2 GLN 37 2HE2 GLN 37 13.258 9.430 -5.203
233 H LYS 38 H LYS 38 7.457 11.722 -1.085
234 HA LYS 38 HA LYS 38 5.759 12.946 -0.408
235 1HB LYS 38 1HB LYS 38 5.923 15.301 -0.082
236 2HB LYS 38 2HB LYS 38 7.537 14.616 0.134
237 1HG LYS 38 1HG LYS 38 8.239 15.439 -1.980
238 2HG LYS 38 2HG LYS 38 6.583 15.909 -2.395
239 1HD LYS 38 1HD LYS 38 6.635 17.535 -0.549
240 2HD LYS 38 2HD LYS 38 8.317 17.101 -0.239
241 1HE LYS 38 1HE LYS 38 8.148 19.133 -1.613
242 2HE LYS 38 2HE LYS 38 8.936 17.816 -2.481
243 1HZ LYS 38 1HZ LYS 38 7.308 19.031 -3.827
244 2HZ LYS 38 2HZ LYS 38 6.068 18.550 -2.790
245 3HZ LYS 38 3HZ LYS 38 6.917 17.407 -3.684
246 H SER 39 H SER 39 6.461 13.159 -3.698
247 HA SER 39 HA SER 39 5.271 13.533 -5.557
248 1HB SER 39 1HB SER 39 2.828 13.384 -3.748
249 2HB SER 39 2HB SER 39 2.826 13.218 -5.507
250 HG SER 39 HG SER 39 4.604 11.534 -4.420
Start of MODEL 13
1 H ALA 6 H ALA 6 -12.328 -8.461 4.726
2 HA ALA 6 HA ALA 6 -13.547 -10.400 3.084
3 1HB ALA 6 1HB ALA 6 -12.924 -8.854 1.295
4 2HB ALA 6 2HB ALA 6 -11.754 -10.183 1.312
5 3HB ALA 6 3HB ALA 6 -11.344 -8.623 2.036
6 H GLU 7 H GLU 7 -11.578 -12.039 2.698
7 HA GLU 7 HA GLU 7 -10.419 -12.228 5.341
8 1HB GLU 7 1HB GLU 7 -10.411 -14.216 3.081
9 2HB GLU 7 2HB GLU 7 -9.808 -14.507 4.722
10 1HG GLU 7 1HG GLU 7 -12.010 -14.199 5.629
11 2HG GLU 7 2HG GLU 7 -12.648 -13.787 4.043
12 H ASP 8 H ASP 8 -9.228 -12.293 2.100
13 HA ASP 8 HA ASP 8 -6.474 -11.631 3.135
14 1HB ASP 8 1HB ASP 8 -7.109 -13.171 0.609
15 2HB ASP 8 2HB ASP 8 -5.517 -12.776 1.232
16 H GLN 9 H GLN 9 -8.798 -10.015 2.202
17 HA GLN 9 HA GLN 9 -7.136 -8.440 0.426
18 1HB GLN 9 1HB GLN 9 -10.167 -8.467 0.488
19 2HB GLN 9 2HB GLN 9 -9.185 -7.385 -0.499
20 1HG GLN 9 1HG GLN 9 -8.325 -9.303 -1.709
21 2HG GLN 9 2HG GLN 9 -9.329 -10.378 -0.715
22 1HE2 GLN 9 1HE2 GLN 9 -9.300 -8.019 -3.234
23 2HE2 GLN 9 2HE2 GLN 9 -10.942 -8.256 -3.759
24 H VAL 10 H VAL 10 -6.501 -6.576 1.599
25 HA VAL 10 HA VAL 10 -8.371 -5.629 3.614
26 HB VAL 10 HB VAL 10 -6.390 -4.829 4.954
27 1HG1 VAL 10 1HG1 VAL 10 -7.532 -6.884 5.597
28 2HG1 VAL 10 2HG1 VAL 10 -5.799 -7.029 5.885
29 3HG1 VAL 10 3HG1 VAL 10 -6.526 -7.807 4.481
30 1HG2 VAL 10 1HG2 VAL 10 -4.712 -4.815 3.179
31 2HG2 VAL 10 2HG2 VAL 10 -4.816 -6.572 3.054
32 3HG2 VAL 10 3HG2 VAL 10 -4.192 -5.829 4.526
33 HA PRO 11 HA PRO 11 -8.181 -1.989 1.176
34 1HB PRO 11 1HB PRO 11 -9.273 -0.291 2.972
35 2HB PRO 11 2HB PRO 11 -10.234 -1.260 1.848
36 1HG PRO 11 1HG PRO 11 -9.753 -1.629 4.755
37 2HG PRO 11 2HG PRO 11 -11.118 -2.193 3.768
38 1HD PRO 11 1HD PRO 11 -9.056 -3.792 4.697
39 2HD PRO 11 2HD PRO 11 -10.094 -4.181 3.314
40 H CYS 12 H CYS 12 -6.549 -0.860 0.913
41 HA CYS 12 HA CYS 12 -4.574 -0.308 2.890
42 1HB CYS 12 1HB CYS 12 -3.995 -0.814 0.644
43 2HB CYS 12 2HB CYS 12 -4.977 0.521 0.035
44 H GLU 13 H GLU 13 -4.943 1.243 4.310
45 HA GLU 13 HA GLU 13 -6.886 3.248 4.253
46 1HB GLU 13 1HB GLU 13 -4.271 3.447 5.742
47 2HB GLU 13 2HB GLU 13 -5.795 4.210 6.154
48 1HG GLU 13 1HG GLU 13 -5.815 2.513 7.645
49 2HG GLU 13 2HG GLU 13 -6.598 1.708 6.291
50 H LYS 14 H LYS 14 -3.698 3.269 2.965
51 HA LYS 14 HA LYS 14 -3.681 6.058 2.672
52 1HB LYS 14 1HB LYS 14 -1.812 3.939 1.769
53 2HB LYS 14 2HB LYS 14 -1.568 5.566 1.148
54 1HG LYS 14 1HG LYS 14 -1.379 6.376 3.457
55 2HG LYS 14 2HG LYS 14 -1.588 4.722 4.032
56 1HD LYS 14 1HD LYS 14 0.393 4.011 2.901
57 2HD LYS 14 2HD LYS 14 0.563 5.591 2.130
58 1HE LYS 14 1HE LYS 14 0.650 5.195 5.112
59 2HE LYS 14 2HE LYS 14 2.096 5.214 4.101
60 1HZ LYS 14 1HZ LYS 14 0.152 7.454 4.411
61 2HZ LYS 14 2HZ LYS 14 1.464 7.442 3.366
62 3HZ LYS 14 3HZ LYS 14 1.726 7.396 5.032
63 H CYS 15 H CYS 15 -5.170 3.796 0.935
64 HA CYS 15 HA CYS 15 -5.612 5.697 -1.254
65 1HB CYS 15 1HB CYS 15 -5.221 4.228 -3.174
66 2HB CYS 15 2HB CYS 15 -3.772 4.488 -2.195
67 H GLY 16 H GLY 16 -6.983 3.057 0.415
68 1HA GLY 16 1HA GLY 16 -9.151 2.490 0.580
69 2HA GLY 16 2HA GLY 16 -9.560 3.609 -0.721
70 H SER 17 H SER 17 -7.090 1.622 -1.698
71 HA SER 17 HA SER 17 -8.853 -0.074 -3.243
72 1HB SER 17 1HB SER 17 -5.841 0.007 -3.067
73 2HB SER 17 2HB SER 17 -6.782 -0.768 -4.348
74 HG SER 17 HG SER 17 -7.703 1.518 -4.500
75 H LEU 18 H LEU 18 -8.988 -2.332 -2.991
76 HA LEU 18 HA LEU 18 -8.265 -3.366 -0.393
77 1HB LEU 18 1HB LEU 18 -9.651 -4.629 -2.752
78 2HB LEU 18 2HB LEU 18 -9.382 -5.424 -1.202
79 HG LEU 18 HG LEU 18 -11.043 -2.933 -1.566
80 1HD1 LEU 18 1HD1 LEU 18 -11.860 -5.820 -1.247
81 2HD1 LEU 18 2HD1 LEU 18 -12.078 -4.837 -2.701
82 3HD1 LEU 18 3HD1 LEU 18 -12.955 -4.441 -1.220
83 1HD2 LEU 18 1HD2 LEU 18 -10.718 -4.831 0.751
84 2HD2 LEU 18 2HD2 LEU 18 -11.849 -3.483 0.683
85 3HD2 LEU 18 3HD2 LEU 18 -10.113 -3.178 0.667
86 H VAL 19 H VAL 19 -6.323 -3.852 -0.169
87 HA VAL 19 HA VAL 19 -4.724 -4.801 -2.408
88 HB VAL 19 HB VAL 19 -3.836 -4.124 0.403
89 1HG1 VAL 19 1HG1 VAL 19 -2.214 -4.550 -2.100
90 2HG1 VAL 19 2HG1 VAL 19 -2.239 -5.599 -0.680
91 3HG1 VAL 19 3HG1 VAL 19 -1.590 -3.960 -0.563
92 1HG2 VAL 19 1HG2 VAL 19 -4.767 -2.202 -0.691
93 2HG2 VAL 19 2HG2 VAL 19 -3.785 -2.508 -2.120
94 3HG2 VAL 19 3HG2 VAL 19 -3.009 -2.045 -0.608
95 HA PRO 20 HA PRO 20 -4.996 -9.034 -1.075
96 1HB PRO 20 1HB PRO 20 -2.487 -9.408 -2.572
97 2HB PRO 20 2HB PRO 20 -4.067 -10.160 -2.850
98 1HG PRO 20 1HG PRO 20 -3.010 -8.277 -4.495
99 2HG PRO 20 2HG PRO 20 -4.757 -8.493 -4.246
100 1HD PRO 20 1HD PRO 20 -2.932 -6.403 -3.165
101 2HD PRO 20 2HD PRO 20 -4.643 -6.317 -3.645
102 H VAL 21 H VAL 21 -4.273 -9.767 0.745
103 HA VAL 21 HA VAL 21 -2.567 -8.471 2.451
104 HB VAL 21 HB VAL 21 -4.271 -10.152 3.104
105 1HG1 VAL 21 1HG1 VAL 21 -3.796 -12.517 3.128
106 2HG1 VAL 21 2HG1 VAL 21 -2.237 -12.219 2.366
107 3HG1 VAL 21 3HG1 VAL 21 -3.720 -11.871 1.486
108 1HG2 VAL 21 1HG2 VAL 21 -1.558 -10.671 4.287
109 2HG2 VAL 21 2HG2 VAL 21 -3.114 -11.154 4.978
110 3HG2 VAL 21 3HG2 VAL 21 -2.725 -9.437 4.805
111 H TRP 22 H TRP 22 -1.573 -11.095 0.328
112 HA TRP 22 HA TRP 22 1.013 -11.340 1.370
113 1HB TRP 22 1HB TRP 22 1.466 -12.467 -0.928
114 2HB TRP 22 2HB TRP 22 0.322 -13.201 0.205
115 HD1 TRP 22 HD1 TRP 22 0.357 -11.170 -3.083
116 HE1 TRP 22 HE1 TRP 22 -1.866 -11.600 -4.300
117 HE3 TRP 22 HE3 TRP 22 -1.991 -13.948 0.482
118 HZ2 TRP 22 HZ2 TRP 22 -4.307 -12.955 -3.809
119 HZ3 TRP 22 HZ3 TRP 22 -4.275 -14.772 0.027
120 HH2 TRP 22 HH2 TRP 22 -5.387 -14.276 -2.073
121 H ASP 23 H ASP 23 -0.213 -9.012 -0.966
122 HA ASP 23 HA ASP 23 2.567 -8.154 -1.426
123 1HB ASP 23 1HB ASP 23 0.076 -7.774 -3.073
124 2HB ASP 23 2HB ASP 23 1.488 -6.722 -3.271
125 H MET 24 H MET 24 0.235 -7.600 0.614
126 HA MET 24 HA MET 24 -0.247 -4.892 0.687
127 1HB MET 24 1HB MET 24 -0.818 -6.996 2.337
128 2HB MET 24 2HB MET 24 0.244 -5.998 3.341
129 1HG MET 24 1HG MET 24 -2.281 -5.115 1.978
130 2HG MET 24 2HG MET 24 -2.050 -5.404 3.709
131 1HE MET 24 1HE MET 24 -2.556 -1.518 3.243
132 2HE MET 24 2HE MET 24 -3.247 -3.023 3.881
133 3HE MET 24 3HE MET 24 -3.164 -2.755 2.138
134 HA PRO 25 HA PRO 25 3.736 -4.033 3.376
135 1HB PRO 25 1HB PRO 25 5.844 -5.754 2.870
136 2HB PRO 25 2HB PRO 25 4.789 -5.858 4.292
137 1HG PRO 25 1HG PRO 25 4.726 -7.425 1.751
138 2HG PRO 25 2HG PRO 25 4.428 -7.965 3.409
139 1HD PRO 25 1HD PRO 25 2.433 -7.506 1.660
140 2HD PRO 25 2HD PRO 25 2.236 -7.190 3.396
141 H GLU 26 H GLU 26 4.300 -5.767 0.388
142 HA GLU 26 HA GLU 26 6.235 -4.212 -0.867
143 1HB GLU 26 1HB GLU 26 3.921 -5.812 -1.924
144 2HB GLU 26 2HB GLU 26 5.230 -5.250 -2.953
145 1HG GLU 26 1HG GLU 26 5.441 -7.159 -0.634
146 2HG GLU 26 2HG GLU 26 5.530 -7.567 -2.357
147 H HIS 27 H HIS 27 2.748 -4.043 -1.083
148 HA HIS 27 HA HIS 27 2.564 -1.777 -2.776
149 1HB HIS 27 1HB HIS 27 0.830 -3.428 -2.498
150 2HB HIS 27 2HB HIS 27 0.644 -3.015 -0.802
151 HD1 HIS 27 HD1 HIS 27 -0.939 -2.323 -3.993
152 HD2 HIS 27 HD2 HIS 27 -0.257 -0.293 -0.469
153 HE1 HIS 27 HE1 HIS 27 -2.605 -0.409 -3.964
154 H MET 28 H MET 28 2.452 -2.091 0.748
155 HA MET 28 HA MET 28 2.021 0.636 1.181
156 1HB MET 28 1HB MET 28 3.120 -1.509 2.948
157 2HB MET 28 2HB MET 28 3.122 0.172 3.498
158 1HG MET 28 1HG MET 28 0.700 -1.378 2.607
159 2HG MET 28 2HG MET 28 1.176 -1.092 4.281
160 1HE MET 28 1HE MET 28 0.735 2.718 4.744
161 2HE MET 28 2HE MET 28 2.221 1.882 4.310
162 3HE MET 28 3HE MET 28 1.128 1.174 5.505
163 H ASP 29 H ASP 29 4.904 -1.183 0.645
164 HA ASP 29 HA ASP 29 6.793 0.899 1.289
165 1HB ASP 29 1HB ASP 29 7.588 -1.373 1.219
166 2HB ASP 29 2HB ASP 29 7.010 -1.573 -0.442
167 H TYR 30 H TYR 30 5.016 0.035 -1.597
168 HA TYR 30 HA TYR 30 6.393 1.822 -3.254
169 1HB TYR 30 1HB TYR 30 4.879 0.107 -4.200
170 2HB TYR 30 2HB TYR 30 3.495 0.963 -3.495
171 HD1 TYR 30 HD1 TYR 30 2.513 2.773 -4.615
172 HD2 TYR 30 HD2 TYR 30 6.249 1.298 -5.955
173 HE1 TYR 30 HE1 TYR 30 2.374 4.248 -6.589
174 HE2 TYR 30 HE2 TYR 30 6.127 2.756 -7.931
175 HH TYR 30 HH TYR 30 4.328 3.849 -9.248
176 H HIS 31 H HIS 31 3.563 2.231 -1.165
177 HA HIS 31 HA HIS 31 3.185 5.015 -1.818
178 1HB HIS 31 1HB HIS 31 2.399 3.548 0.694
179 2HB HIS 31 2HB HIS 31 2.175 5.285 0.491
180 HD1 HIS 31 HD1 HIS 31 0.463 5.908 -1.585
181 HD2 HIS 31 HD2 HIS 31 0.414 2.074 -0.062
182 HE1 HIS 31 HE1 HIS 31 -1.763 4.958 -2.259
183 H PHE 32 H PHE 32 5.216 3.404 0.608
184 HA PHE 32 HA PHE 32 5.965 5.699 1.891
185 1HB PHE 32 1HB PHE 32 7.081 2.978 1.551
186 2HB PHE 32 2HB PHE 32 8.082 4.170 2.360
187 HD1 PHE 32 HD1 PHE 32 6.176 1.496 3.070
188 HD2 PHE 32 HD2 PHE 32 6.270 5.641 4.034
189 HE1 PHE 32 HE1 PHE 32 4.923 1.045 5.124
190 HE2 PHE 32 HE2 PHE 32 5.014 5.187 6.098
191 HZ PHE 32 HZ PHE 32 4.340 2.888 6.646
192 H ALA 33 H ALA 33 7.538 4.002 -0.818
193 HA ALA 33 HA ALA 33 9.591 5.849 -1.099
194 1HB ALA 33 1HB ALA 33 9.699 3.623 -2.099
195 2HB ALA 33 2HB ALA 33 9.963 4.857 -3.328
196 3HB ALA 33 3HB ALA 33 8.401 4.045 -3.216
197 H LEU 34 H LEU 34 6.410 5.594 -2.593
198 HA LEU 34 HA LEU 34 6.556 7.673 -4.472
199 1HB LEU 34 1HB LEU 34 4.844 5.915 -4.430
200 2HB LEU 34 2HB LEU 34 4.169 6.629 -2.967
201 HG LEU 34 HG LEU 34 3.599 8.648 -4.278
202 1HD1 LEU 34 1HD1 LEU 34 3.655 8.517 -6.713
203 2HD1 LEU 34 2HD1 LEU 34 4.490 6.968 -6.611
204 3HD1 LEU 34 3HD1 LEU 34 5.279 8.435 -6.030
205 1HD2 LEU 34 1HD2 LEU 34 1.980 6.880 -3.883
206 2HD2 LEU 34 2HD2 LEU 34 2.515 6.056 -5.344
207 3HD2 LEU 34 3HD2 LEU 34 1.736 7.636 -5.457
208 H GLU 35 H GLU 35 5.483 7.659 -1.104
209 HA GLU 35 HA GLU 35 4.839 10.436 -1.094
210 1HB GLU 35 1HB GLU 35 5.119 8.392 1.106
211 2HB GLU 35 2HB GLU 35 4.718 10.078 1.408
212 1HG GLU 35 1HG GLU 35 2.687 9.867 0.106
213 2HG GLU 35 2HG GLU 35 3.114 8.200 -0.316
214 H LEU 36 H LEU 36 7.777 8.602 -0.749
215 HA LEU 36 HA LEU 36 9.108 10.689 0.658
216 1HB LEU 36 1HB LEU 36 9.637 8.337 1.036
217 2HB LEU 36 2HB LEU 36 10.007 8.132 -0.673
218 HG LEU 36 HG LEU 36 11.974 9.488 -0.433
219 1HD1 LEU 36 1HD1 LEU 36 11.216 11.038 1.309
220 2HD1 LEU 36 2HD1 LEU 36 12.713 10.250 1.815
221 3HD1 LEU 36 3HD1 LEU 36 11.169 9.718 2.478
222 1HD2 LEU 36 1HD2 LEU 36 12.162 7.107 -0.012
223 2HD2 LEU 36 2HD2 LEU 36 11.772 7.358 1.689
224 3HD2 LEU 36 3HD2 LEU 36 13.271 8.004 1.025
225 H GLN 37 H GLN 37 8.096 10.027 -2.496
226 HA GLN 37 HA GLN 37 10.304 11.109 -3.943
227 1HB GLN 37 1HB GLN 37 7.493 10.537 -4.882
228 2HB GLN 37 2HB GLN 37 8.789 11.126 -5.927
229 1HG GLN 37 1HG GLN 37 8.596 8.476 -4.522
230 2HG GLN 37 2HG GLN 37 8.581 8.789 -6.266
231 1HE2 GLN 37 1HE2 GLN 37 10.455 8.395 -3.458
232 2HE2 GLN 37 2HE2 GLN 37 12.029 8.414 -4.204
233 H LYS 38 H LYS 38 8.138 12.650 -2.047
234 HA LYS 38 HA LYS 38 7.961 15.000 -3.720
235 1HB LYS 38 1HB LYS 38 6.832 16.101 -1.810
236 2HB LYS 38 2HB LYS 38 6.057 14.584 -2.272
237 1HG LYS 38 1HG LYS 38 7.026 13.482 -0.352
238 2HG LYS 38 2HG LYS 38 7.930 14.951 0.062
239 1HD LYS 38 1HD LYS 38 5.855 16.155 0.425
240 2HD LYS 38 2HD LYS 38 4.917 14.751 -0.070
241 1HE LYS 38 1HE LYS 38 6.771 14.846 2.308
242 2HE LYS 38 2HE LYS 38 5.025 15.078 2.386
243 1HZ LYS 38 1HZ LYS 38 6.384 12.584 1.454
244 2HZ LYS 38 2HZ LYS 38 4.723 12.823 1.576
245 3HZ LYS 38 3HZ LYS 38 5.672 12.819 2.963
246 H SER 39 H SER 39 10.285 13.637 -1.821
247 HA SER 39 HA SER 39 11.536 16.199 -1.217
248 1HB SER 39 1HB SER 39 12.072 13.456 -0.051
249 2HB SER 39 2HB SER 39 12.769 14.988 0.496
250 HG SER 39 HG SER 39 10.269 15.445 0.515
Start of MODEL 14
1 H ALA 6 H ALA 6 -8.082 -14.125 -3.354
2 HA ALA 6 HA ALA 6 -9.066 -16.583 -2.269
3 1HB ALA 6 1HB ALA 6 -7.456 -16.532 -0.398
4 2HB ALA 6 2HB ALA 6 -6.603 -15.199 -1.155
5 3HB ALA 6 3HB ALA 6 -6.605 -16.790 -1.925
6 H GLU 7 H GLU 7 -9.892 -15.994 0.010
7 HA GLU 7 HA GLU 7 -11.054 -13.338 -0.195
8 1HB GLU 7 1HB GLU 7 -11.606 -15.562 1.796
9 2HB GLU 7 2HB GLU 7 -12.558 -14.086 1.594
10 1HG GLU 7 1HG GLU 7 -13.087 -14.811 -0.714
11 2HG GLU 7 2HG GLU 7 -12.237 -16.318 -0.392
12 H ASP 8 H ASP 8 -8.579 -12.915 0.179
13 HA ASP 8 HA ASP 8 -8.173 -12.118 2.975
14 1HB ASP 8 1HB ASP 8 -6.225 -13.783 1.374
15 2HB ASP 8 2HB ASP 8 -5.770 -12.826 2.789
16 H GLN 9 H GLN 9 -8.909 -10.145 1.815
17 HA GLN 9 HA GLN 9 -6.487 -8.819 0.961
18 1HB GLN 9 1HB GLN 9 -9.289 -8.261 -0.062
19 2HB GLN 9 2HB GLN 9 -7.848 -7.314 -0.439
20 1HG GLN 9 1HG GLN 9 -6.924 -9.445 -1.457
21 2HG GLN 9 2HG GLN 9 -8.563 -10.085 -1.299
22 1HE2 GLN 9 1HE2 GLN 9 -6.908 -9.465 -3.611
23 2HE2 GLN 9 2HE2 GLN 9 -7.822 -8.387 -4.613
24 H VAL 10 H VAL 10 -6.487 -6.558 1.573
25 HA VAL 10 HA VAL 10 -8.437 -5.836 3.606
26 HB VAL 10 HB VAL 10 -6.617 -4.825 5.002
27 1HG1 VAL 10 1HG1 VAL 10 -5.776 -6.904 6.002
28 2HG1 VAL 10 2HG1 VAL 10 -6.334 -7.794 4.583
29 3HG1 VAL 10 3HG1 VAL 10 -7.500 -6.996 5.635
30 1HG2 VAL 10 1HG2 VAL 10 -4.755 -6.351 3.179
31 2HG2 VAL 10 2HG2 VAL 10 -4.283 -5.529 4.667
32 3HG2 VAL 10 3HG2 VAL 10 -4.887 -4.596 3.297
33 HA PRO 11 HA PRO 11 -8.312 -2.167 1.145
34 1HB PRO 11 1HB PRO 11 -9.371 -0.444 2.929
35 2HB PRO 11 2HB PRO 11 -10.365 -1.452 1.870
36 1HG PRO 11 1HG PRO 11 -9.757 -1.742 4.775
37 2HG PRO 11 2HG PRO 11 -11.167 -2.326 3.864
38 1HD PRO 11 1HD PRO 11 -9.076 -3.913 4.741
39 2HD PRO 11 2HD PRO 11 -10.165 -4.323 3.404
40 H CYS 12 H CYS 12 -6.629 -0.970 0.847
41 HA CYS 12 HA CYS 12 -4.691 -0.474 2.850
42 1HB CYS 12 1HB CYS 12 -3.996 -0.918 0.643
43 2HB CYS 12 2HB CYS 12 -5.050 0.339 -0.011
44 H GLU 13 H GLU 13 -5.089 1.067 4.280
45 HA GLU 13 HA GLU 13 -7.011 3.095 4.373
46 1HB GLU 13 1HB GLU 13 -4.270 3.215 5.604
47 2HB GLU 13 2HB GLU 13 -5.688 4.112 6.111
48 1HG GLU 13 1HG GLU 13 -6.767 2.090 6.830
49 2HG GLU 13 2HG GLU 13 -5.432 1.120 6.205
50 H LYS 14 H LYS 14 -3.908 3.229 2.880
51 HA LYS 14 HA LYS 14 -4.038 6.033 2.688
52 1HB LYS 14 1HB LYS 14 -2.005 4.077 1.832
53 2HB LYS 14 2HB LYS 14 -1.864 5.694 1.154
54 1HG LYS 14 1HG LYS 14 -1.951 6.525 3.551
55 2HG LYS 14 2HG LYS 14 -1.779 4.836 4.042
56 1HD LYS 14 1HD LYS 14 0.334 4.667 2.929
57 2HD LYS 14 2HD LYS 14 0.129 6.272 2.211
58 1HE LYS 14 1HE LYS 14 0.090 7.204 4.535
59 2HE LYS 14 2HE LYS 14 0.526 5.600 5.116
60 1HZ LYS 14 1HZ LYS 14 2.594 5.714 3.967
61 2HZ LYS 14 2HZ LYS 14 2.411 7.200 4.754
62 3HZ LYS 14 3HZ LYS 14 2.103 7.079 3.110
63 H CYS 15 H CYS 15 -5.380 3.776 0.889
64 HA CYS 15 HA CYS 15 -5.886 5.718 -1.261
65 1HB CYS 15 1HB CYS 15 -5.492 4.214 -3.153
66 2HB CYS 15 2HB CYS 15 -4.038 4.512 -2.188
67 H GLY 16 H GLY 16 -7.130 3.026 0.465
68 1HA GLY 16 1HA GLY 16 -9.281 2.426 0.722
69 2HA GLY 16 2HA GLY 16 -9.764 3.467 -0.619
70 H SER 17 H SER 17 -7.219 1.631 -1.625
71 HA SER 17 HA SER 17 -8.950 -0.025 -3.218
72 1HB SER 17 1HB SER 17 -5.941 0.099 -3.068
73 2HB SER 17 2HB SER 17 -6.884 -0.626 -4.379
74 HG SER 17 HG SER 17 -7.831 1.732 -4.301
75 H LEU 18 H LEU 18 -9.195 -2.214 -2.993
76 HA LEU 18 HA LEU 18 -8.434 -3.437 -0.509
77 1HB LEU 18 1HB LEU 18 -9.841 -4.504 -2.938
78 2HB LEU 18 2HB LEU 18 -9.629 -5.398 -1.434
79 HG LEU 18 HG LEU 18 -11.169 -2.807 -1.649
80 1HD1 LEU 18 1HD1 LEU 18 -13.161 -4.171 -1.475
81 2HD1 LEU 18 2HD1 LEU 18 -12.178 -5.634 -1.509
82 3HD1 LEU 18 3HD1 LEU 18 -12.252 -4.587 -2.930
83 1HD2 LEU 18 1HD2 LEU 18 -12.015 -3.453 0.552
84 2HD2 LEU 18 2HD2 LEU 18 -10.266 -3.257 0.567
85 3HD2 LEU 18 3HD2 LEU 18 -10.971 -4.872 0.536
86 H VAL 19 H VAL 19 -6.512 -4.020 -0.276
87 HA VAL 19 HA VAL 19 -4.938 -4.981 -2.560
88 HB VAL 19 HB VAL 19 -3.980 -4.116 0.171
89 1HG1 VAL 19 1HG1 VAL 19 -2.418 -5.661 -0.858
90 2HG1 VAL 19 2HG1 VAL 19 -1.750 -4.028 -0.836
91 3HG1 VAL 19 3HG1 VAL 19 -2.404 -4.692 -2.332
92 1HG2 VAL 19 1HG2 VAL 19 -3.989 -2.645 -2.453
93 2HG2 VAL 19 2HG2 VAL 19 -3.198 -2.091 -0.982
94 3HG2 VAL 19 3HG2 VAL 19 -4.957 -2.264 -1.029
95 HA PRO 20 HA PRO 20 -5.141 -9.192 -1.029
96 1HB PRO 20 1HB PRO 20 -2.553 -9.377 -2.478
97 2HB PRO 20 2HB PRO 20 -4.001 -10.392 -2.640
98 1HG PRO 20 1HG PRO 20 -3.362 -8.604 -4.512
99 2HG PRO 20 2HG PRO 20 -5.053 -8.893 -4.041
100 1HD PRO 20 1HD PRO 20 -3.256 -6.603 -3.316
101 2HD PRO 20 2HD PRO 20 -4.996 -6.637 -3.686
102 H VAL 21 H VAL 21 -4.447 -10.033 0.703
103 HA VAL 21 HA VAL 21 -2.914 -8.636 2.544
104 HB VAL 21 HB VAL 21 -4.607 -10.512 2.925
105 1HG1 VAL 21 1HG1 VAL 21 -2.215 -12.277 2.619
106 2HG1 VAL 21 2HG1 VAL 21 -3.692 -12.282 1.659
107 3HG1 VAL 21 3HG1 VAL 21 -3.735 -12.765 3.357
108 1HG2 VAL 21 1HG2 VAL 21 -3.510 -9.407 4.766
109 2HG2 VAL 21 2HG2 VAL 21 -2.155 -10.554 4.679
110 3HG2 VAL 21 3HG2 VAL 21 -3.794 -11.111 5.080
111 H TRP 22 H TRP 22 -1.798 -11.146 0.373
112 HA TRP 22 HA TRP 22 0.813 -11.271 1.443
113 1HB TRP 22 1HB TRP 22 1.322 -12.526 -0.710
114 2HB TRP 22 2HB TRP 22 0.072 -13.196 0.345
115 HD1 TRP 22 HD1 TRP 22 0.418 -11.244 -2.971
116 HE1 TRP 22 HE1 TRP 22 -1.670 -11.719 -4.395
117 HE3 TRP 22 HE3 TRP 22 -2.249 -13.990 0.393
118 HZ2 TRP 22 HZ2 TRP 22 -4.124 -13.086 -4.127
119 HZ3 TRP 22 HZ3 TRP 22 -4.473 -14.847 -0.292
120 HH2 TRP 22 HH2 TRP 22 -5.360 -14.391 -2.502
121 H ASP 23 H ASP 23 -0.549 -8.982 -0.851
122 HA ASP 23 HA ASP 23 2.202 -8.143 -1.531
123 1HB ASP 23 1HB ASP 23 -0.418 -7.597 -2.944
124 2HB ASP 23 2HB ASP 23 1.066 -6.701 -3.287
125 H MET 24 H MET 24 -0.009 -7.577 0.652
126 HA MET 24 HA MET 24 -0.488 -4.867 0.869
127 1HB MET 24 1HB MET 24 -0.993 -7.001 2.435
128 2HB MET 24 2HB MET 24 0.289 -6.230 3.372
129 1HG MET 24 1HG MET 24 -2.239 -4.884 2.475
130 2HG MET 24 2HG MET 24 -1.933 -5.538 4.089
131 1HE MET 24 1HE MET 24 -2.766 -2.555 3.051
132 2HE MET 24 2HE MET 24 -1.993 -1.590 4.324
133 3HE MET 24 3HE MET 24 -2.848 -3.093 4.729
134 HA PRO 25 HA PRO 25 3.742 -4.079 3.205
135 1HB PRO 25 1HB PRO 25 5.772 -5.856 2.545
136 2HB PRO 25 2HB PRO 25 4.835 -5.908 4.050
137 1HG PRO 25 1HG PRO 25 4.533 -7.527 1.562
138 2HG PRO 25 2HG PRO 25 4.327 -8.004 3.256
139 1HD PRO 25 1HD PRO 25 2.238 -7.518 1.605
140 2HD PRO 25 2HD PRO 25 2.155 -7.197 3.343
141 H GLU 26 H GLU 26 4.115 -5.836 0.176
142 HA GLU 26 HA GLU 26 5.948 -4.276 -1.229
143 1HB GLU 26 1HB GLU 26 3.562 -5.900 -2.032
144 2HB GLU 26 2HB GLU 26 4.565 -5.125 -3.250
145 1HG GLU 26 1HG GLU 26 5.510 -7.126 -1.211
146 2HG GLU 26 2HG GLU 26 5.077 -7.500 -2.890
147 H HIS 27 H HIS 27 2.455 -4.032 -1.210
148 HA HIS 27 HA HIS 27 2.301 -1.750 -2.844
149 1HB HIS 27 1HB HIS 27 0.513 -3.375 -2.583
150 2HB HIS 27 2HB HIS 27 0.353 -2.962 -0.883
151 HD1 HIS 27 HD1 HIS 27 -1.062 -2.068 -4.161
152 HD2 HIS 27 HD2 HIS 27 -0.567 -0.326 -0.453
153 HE1 HIS 27 HE1 HIS 27 -2.711 -0.156 -4.069
154 H MET 28 H MET 28 2.295 -2.118 0.669
155 HA MET 28 HA MET 28 1.965 0.643 1.107
156 1HB MET 28 1HB MET 28 2.958 -1.503 2.956
157 2HB MET 28 2HB MET 28 2.904 0.195 3.438
158 1HG MET 28 1HG MET 28 0.564 -1.439 2.502
159 2HG MET 28 2HG MET 28 0.909 -0.998 4.172
160 1HE MET 28 1HE MET 28 0.841 1.432 5.122
161 2HE MET 28 2HE MET 28 0.447 2.868 4.186
162 3HE MET 28 3HE MET 28 1.967 2.026 3.897
163 H ASP 29 H ASP 29 4.732 -1.255 0.396
164 HA ASP 29 HA ASP 29 6.637 0.752 1.216
165 1HB ASP 29 1HB ASP 29 7.340 -1.603 1.041
166 2HB ASP 29 2HB ASP 29 6.952 -1.582 -0.689
167 H TYR 30 H TYR 30 4.826 0.014 -1.628
168 HA TYR 30 HA TYR 30 6.151 1.801 -3.372
169 1HB TYR 30 1HB TYR 30 4.539 0.005 -4.087
170 2HB TYR 30 2HB TYR 30 3.235 0.974 -3.394
171 HD1 TYR 30 HD1 TYR 30 5.420 0.472 -6.232
172 HD2 TYR 30 HD2 TYR 30 2.654 3.148 -4.458
173 HE1 TYR 30 HE1 TYR 30 5.148 1.615 -8.395
174 HE2 TYR 30 HE2 TYR 30 2.371 4.310 -6.610
175 HH TYR 30 HH TYR 30 3.480 2.972 -9.512
176 H HIS 31 H HIS 31 3.322 2.270 -1.238
177 HA HIS 31 HA HIS 31 3.058 5.086 -1.895
178 1HB HIS 31 1HB HIS 31 2.174 3.667 0.637
179 2HB HIS 31 2HB HIS 31 1.974 5.396 0.386
180 HD1 HIS 31 HD1 HIS 31 0.171 5.987 -1.637
181 HD2 HIS 31 HD2 HIS 31 0.184 2.185 -0.054
182 HE1 HIS 31 HE1 HIS 31 -2.042 5.010 -2.257
183 H PHE 32 H PHE 32 4.987 3.255 0.410
184 HA PHE 32 HA PHE 32 5.649 5.396 2.072
185 1HB PHE 32 1HB PHE 32 5.934 2.811 2.387
186 2HB PHE 32 2HB PHE 32 7.499 3.089 1.608
187 HD1 PHE 32 HD1 PHE 32 5.754 3.010 4.639
188 HD2 PHE 32 HD2 PHE 32 8.940 5.027 2.675
189 HE1 PHE 32 HE1 PHE 32 6.629 3.742 6.815
190 HE2 PHE 32 HE2 PHE 32 9.827 5.754 4.857
191 HZ PHE 32 HZ PHE 32 8.670 5.110 6.925
192 H ALA 33 H ALA 33 7.451 3.760 -0.535
193 HA ALA 33 HA ALA 33 9.629 5.525 -0.641
194 1HB ALA 33 1HB ALA 33 8.449 3.825 -2.837
195 2HB ALA 33 2HB ALA 33 9.609 3.268 -1.639
196 3HB ALA 33 3HB ALA 33 10.074 4.503 -2.809
197 H LEU 34 H LEU 34 6.502 5.609 -2.113
198 HA LEU 34 HA LEU 34 7.052 7.662 -4.015
199 1HB LEU 34 1HB LEU 34 5.113 6.098 -4.121
200 2HB LEU 34 2HB LEU 34 4.414 6.949 -2.753
201 HG LEU 34 HG LEU 34 4.184 8.975 -4.100
202 1HD1 LEU 34 1HD1 LEU 34 5.308 7.291 -6.329
203 2HD1 LEU 34 2HD1 LEU 34 6.068 8.710 -5.601
204 3HD1 LEU 34 3HD1 LEU 34 4.579 8.880 -6.527
205 1HD2 LEU 34 1HD2 LEU 34 3.040 6.522 -5.422
206 2HD2 LEU 34 2HD2 LEU 34 2.436 8.170 -5.600
207 3HD2 LEU 34 3HD2 LEU 34 2.358 7.366 -4.032
208 H GLU 35 H GLU 35 5.819 7.688 -0.686
209 HA GLU 35 HA GLU 35 5.408 10.529 -0.801
210 1HB GLU 35 1HB GLU 35 5.009 8.548 1.440
211 2HB GLU 35 2HB GLU 35 4.588 10.255 1.527
212 1HG GLU 35 1HG GLU 35 3.007 9.968 -0.301
213 2HG GLU 35 2HG GLU 35 3.443 8.253 -0.398
214 H LEU 36 H LEU 36 7.867 8.357 -0.024
215 HA LEU 36 HA LEU 36 9.173 9.999 1.966
216 1HB LEU 36 1HB LEU 36 9.281 7.545 2.105
217 2HB LEU 36 2HB LEU 36 10.070 7.488 0.533
218 HG LEU 36 HG LEU 36 12.044 8.522 1.466
219 1HD1 LEU 36 1HD1 LEU 36 12.249 8.884 3.898
220 2HD1 LEU 36 2HD1 LEU 36 10.548 8.467 4.103
221 3HD1 LEU 36 3HD1 LEU 36 11.002 9.911 3.199
222 1HD2 LEU 36 1HD2 LEU 36 11.827 6.104 1.521
223 2HD2 LEU 36 2HD2 LEU 36 11.079 6.195 3.113
224 3HD2 LEU 36 3HD2 LEU 36 12.758 6.687 2.897
225 H GLN 37 H GLN 37 8.847 10.038 -1.304
226 HA GLN 37 HA GLN 37 11.412 11.094 -2.010
227 1HB GLN 37 1HB GLN 37 8.718 11.288 -3.373
228 2HB GLN 37 2HB GLN 37 10.230 11.880 -4.077
229 1HG GLN 37 1HG GLN 37 11.122 9.659 -4.133
230 2HG GLN 37 2HG GLN 37 9.702 9.029 -3.284
231 1HE2 GLN 37 1HE2 GLN 37 10.838 8.319 -5.874
232 2HE2 GLN 37 2HE2 GLN 37 9.560 8.558 -7.024
233 H LYS 38 H LYS 38 8.691 12.193 -0.388
234 HA LYS 38 HA LYS 38 7.912 14.004 0.508
235 1HB LYS 38 1HB LYS 38 9.495 15.464 1.753
236 2HB LYS 38 2HB LYS 38 9.707 13.732 2.012
237 1HG LYS 38 1HG LYS 38 11.659 13.796 0.516
238 2HG LYS 38 2HG LYS 38 11.431 15.544 0.326
239 1HD LYS 38 1HD LYS 38 11.712 15.835 2.743
240 2HD LYS 38 2HD LYS 38 11.936 14.098 2.927
241 1HE LYS 38 1HE LYS 38 13.948 14.206 1.547
242 2HE LYS 38 2HE LYS 38 13.703 15.940 1.325
243 1HZ LYS 38 1HZ LYS 38 13.972 16.245 3.708
244 2HZ LYS 38 2HZ LYS 38 15.331 15.496 3.066
245 3HZ LYS 38 3HZ LYS 38 14.209 14.590 3.927
246 H SER 39 H SER 39 8.890 14.449 -2.431
247 HA SER 39 HA SER 39 7.533 16.931 -2.558
248 1HB SER 39 1HB SER 39 9.948 17.595 -2.234
249 2HB SER 39 2HB SER 39 10.344 16.717 -3.707
250 HG SER 39 HG SER 39 8.282 18.532 -3.959
Start of MODEL 15
1 H ALA 6 H ALA 6 -9.512 -15.841 -0.400
2 HA ALA 6 HA ALA 6 -7.694 -15.278 -2.346
3 1HB ALA 6 1HB ALA 6 -9.102 -16.488 -3.971
4 2HB ALA 6 2HB ALA 6 -9.102 -14.759 -4.322
5 3HB ALA 6 3HB ALA 6 -10.487 -15.496 -3.516
6 H GLU 7 H GLU 7 -10.717 -14.762 -0.827
7 HA GLU 7 HA GLU 7 -10.890 -11.913 -1.007
8 1HB GLU 7 1HB GLU 7 -12.149 -13.856 0.928
9 2HB GLU 7 2HB GLU 7 -12.634 -12.173 0.693
10 1HG GLU 7 1HG GLU 7 -13.201 -12.732 -1.648
11 2HG GLU 7 2HG GLU 7 -12.844 -14.419 -1.278
12 H ASP 8 H ASP 8 -8.418 -12.806 -0.169
13 HA ASP 8 HA ASP 8 -8.057 -12.187 2.657
14 1HB ASP 8 1HB ASP 8 -6.205 -13.357 0.536
15 2HB ASP 8 2HB ASP 8 -5.762 -13.079 2.224
16 H GLN 9 H GLN 9 -8.828 -10.092 1.729
17 HA GLN 9 HA GLN 9 -6.613 -8.628 0.579
18 1HB GLN 9 1HB GLN 9 -9.551 -8.191 -0.007
19 2HB GLN 9 2HB GLN 9 -8.211 -7.253 -0.672
20 1HG GLN 9 1HG GLN 9 -7.477 -9.160 -1.921
21 2HG GLN 9 2HG GLN 9 -8.730 -10.171 -1.173
22 1HE2 GLN 9 1HE2 GLN 9 -8.331 -9.620 -3.948
23 2HE2 GLN 9 2HE2 GLN 9 -9.788 -8.853 -4.519
24 H VAL 10 H VAL 10 -6.470 -6.561 1.522
25 HA VAL 10 HA VAL 10 -8.543 -5.791 3.397
26 HB VAL 10 HB VAL 10 -6.764 -4.891 5.015
27 1HG1 VAL 10 1HG1 VAL 10 -6.397 -7.052 6.121
28 2HG1 VAL 10 2HG1 VAL 10 -6.915 -7.885 4.656
29 3HG1 VAL 10 3HG1 VAL 10 -8.058 -6.884 5.553
30 1HG2 VAL 10 1HG2 VAL 10 -4.844 -5.018 3.513
31 2HG2 VAL 10 2HG2 VAL 10 -4.995 -6.773 3.464
32 3HG2 VAL 10 3HG2 VAL 10 -4.569 -5.967 4.975
33 HA PRO 11 HA PRO 11 -8.248 -2.094 1.141
34 1HB PRO 11 1HB PRO 11 -9.327 -0.394 2.938
35 2HB PRO 11 2HB PRO 11 -10.299 -1.389 1.845
36 1HG PRO 11 1HG PRO 11 -9.715 -1.752 4.749
37 2HG PRO 11 2HG PRO 11 -11.141 -2.262 3.817
38 1HD PRO 11 1HD PRO 11 -9.134 -3.966 4.634
39 2HD PRO 11 2HD PRO 11 -10.184 -4.253 3.234
40 H CYS 12 H CYS 12 -6.554 -1.001 0.870
41 HA CYS 12 HA CYS 12 -4.600 -0.528 2.877
42 1HB CYS 12 1HB CYS 12 -3.903 -1.018 0.677
43 2HB CYS 12 2HB CYS 12 -4.927 0.249 0.001
44 H GLU 13 H GLU 13 -4.848 1.090 4.265
45 HA GLU 13 HA GLU 13 -6.767 3.125 4.362
46 1HB GLU 13 1HB GLU 13 -3.985 3.350 5.446
47 2HB GLU 13 2HB GLU 13 -5.408 4.213 5.989
48 1HG GLU 13 1HG GLU 13 -6.372 2.092 6.748
49 2HG GLU 13 2HG GLU 13 -4.883 1.273 6.260
50 H LYS 14 H LYS 14 -3.664 3.191 2.859
51 HA LYS 14 HA LYS 14 -3.659 5.955 2.643
52 1HB LYS 14 1HB LYS 14 -1.873 3.861 1.542
53 2HB LYS 14 2HB LYS 14 -1.567 5.538 1.122
54 1HG LYS 14 1HG LYS 14 -1.308 6.093 3.451
55 2HG LYS 14 2HG LYS 14 -1.718 4.440 3.918
56 1HD LYS 14 1HD LYS 14 0.199 3.622 2.681
57 2HD LYS 14 2HD LYS 14 0.587 5.284 2.213
58 1HE LYS 14 1HE LYS 14 0.422 4.364 5.075
59 2HE LYS 14 2HE LYS 14 1.921 4.381 4.155
60 1HZ LYS 14 1HZ LYS 14 1.574 6.776 3.813
61 2HZ LYS 14 2HZ LYS 14 1.793 6.346 5.420
62 3HZ LYS 14 3HZ LYS 14 0.243 6.732 4.863
63 H CYS 15 H CYS 15 -5.200 3.774 0.879
64 HA CYS 15 HA CYS 15 -5.683 5.663 -1.323
65 1HB CYS 15 1HB CYS 15 -5.393 4.094 -3.186
66 2HB CYS 15 2HB CYS 15 -3.900 4.397 -2.285
67 H GLY 16 H GLY 16 -6.957 2.957 0.413
68 1HA GLY 16 1HA GLY 16 -9.147 2.475 0.709
69 2HA GLY 16 2HA GLY 16 -9.571 3.481 -0.674
70 H SER 17 H SER 17 -7.125 1.516 -1.696
71 HA SER 17 HA SER 17 -8.942 -0.153 -3.187
72 1HB SER 17 1HB SER 17 -5.933 -0.179 -3.013
73 2HB SER 17 2HB SER 17 -6.873 -0.973 -4.273
74 HG SER 17 HG SER 17 -7.694 1.457 -4.385
75 H LEU 18 H LEU 18 -9.396 -2.287 -2.754
76 HA LEU 18 HA LEU 18 -8.445 -3.494 -0.324
77 1HB LEU 18 1HB LEU 18 -10.000 -4.671 -2.626
78 2HB LEU 18 2HB LEU 18 -9.666 -5.493 -1.108
79 HG LEU 18 HG LEU 18 -11.270 -2.957 -1.283
80 1HD1 LEU 18 1HD1 LEU 18 -12.397 -4.786 -2.485
81 2HD1 LEU 18 2HD1 LEU 18 -13.229 -4.414 -0.970
82 3HD1 LEU 18 3HD1 LEU 18 -12.184 -5.833 -1.080
83 1HD2 LEU 18 1HD2 LEU 18 -10.233 -3.407 0.869
84 2HD2 LEU 18 2HD2 LEU 18 -10.955 -5.016 0.888
85 3HD2 LEU 18 3HD2 LEU 18 -11.982 -3.586 0.945
86 H VAL 19 H VAL 19 -6.476 -3.971 -0.282
87 HA VAL 19 HA VAL 19 -5.146 -5.000 -2.686
88 HB VAL 19 HB VAL 19 -3.900 -4.095 -0.080
89 1HG1 VAL 19 1HG1 VAL 19 -2.626 -4.666 -2.756
90 2HG1 VAL 19 2HG1 VAL 19 -2.443 -5.630 -1.291
91 3HG1 VAL 19 3HG1 VAL 19 -1.792 -3.991 -1.358
92 1HG2 VAL 19 1HG2 VAL 19 -5.029 -2.256 -1.165
93 2HG2 VAL 19 2HG2 VAL 19 -4.226 -2.630 -2.687
94 3HG2 VAL 19 3HG2 VAL 19 -3.281 -2.058 -1.313
95 HA PRO 20 HA PRO 20 -5.183 -9.188 -1.139
96 1HB PRO 20 1HB PRO 20 -2.550 -9.241 -2.569
97 2HB PRO 20 2HB PRO 20 -3.896 -10.397 -2.662
98 1HG PRO 20 1HG PRO 20 -3.473 -8.654 -4.620
99 2HG PRO 20 2HG PRO 20 -5.124 -9.049 -4.086
100 1HD PRO 20 1HD PRO 20 -3.488 -6.609 -3.554
101 2HD PRO 20 2HD PRO 20 -5.240 -6.769 -3.810
102 H VAL 21 H VAL 21 -4.519 -9.833 0.699
103 HA VAL 21 HA VAL 21 -3.121 -8.298 2.489
104 HB VAL 21 HB VAL 21 -4.780 -10.153 2.908
105 1HG1 VAL 21 1HG1 VAL 21 -3.955 -12.381 3.480
106 2HG1 VAL 21 2HG1 VAL 21 -2.391 -11.939 2.795
107 3HG1 VAL 21 3HG1 VAL 21 -3.823 -11.977 1.768
108 1HG2 VAL 21 1HG2 VAL 21 -4.005 -10.682 5.118
109 2HG2 VAL 21 2HG2 VAL 21 -3.796 -8.971 4.740
110 3HG2 VAL 21 3HG2 VAL 21 -2.392 -10.061 4.738
111 H TRP 22 H TRP 22 -1.809 -10.950 0.576
112 HA TRP 22 HA TRP 22 0.715 -10.921 1.828
113 1HB TRP 22 1HB TRP 22 1.458 -12.291 -0.165
114 2HB TRP 22 2HB TRP 22 0.089 -12.926 0.752
115 HD1 TRP 22 HD1 TRP 22 0.958 -11.365 -2.652
116 HE1 TRP 22 HE1 TRP 22 -0.958 -11.884 -4.285
117 HE3 TRP 22 HE3 TRP 22 -2.326 -13.461 0.608
118 HZ2 TRP 22 HZ2 TRP 22 -3.544 -13.047 -4.199
119 HZ3 TRP 22 HZ3 TRP 22 -4.513 -14.264 -0.255
120 HH2 TRP 22 HH2 TRP 22 -5.082 -14.047 -2.603
121 H ASP 23 H ASP 23 -0.520 -8.940 -0.796
122 HA ASP 23 HA ASP 23 2.196 -8.010 -1.407
123 1HB ASP 23 1HB ASP 23 -0.469 -7.445 -2.705
124 2HB ASP 23 2HB ASP 23 0.966 -6.479 -3.056
125 H MET 24 H MET 24 0.013 -7.373 0.873
126 HA MET 24 HA MET 24 -0.258 -4.650 0.850
127 1HB MET 24 1HB MET 24 -0.398 -6.593 3.075
128 2HB MET 24 2HB MET 24 -0.342 -4.873 3.484
129 1HG MET 24 1HG MET 24 -2.281 -5.790 1.424
130 2HG MET 24 2HG MET 24 -2.616 -6.150 3.123
131 1HE MET 24 1HE MET 24 -0.744 -2.862 1.884
132 2HE MET 24 2HE MET 24 -2.093 -1.756 1.661
133 3HE MET 24 3HE MET 24 -1.884 -3.120 0.562
134 HA PRO 25 HA PRO 25 3.759 -3.781 3.484
135 1HB PRO 25 1HB PRO 25 5.349 -6.121 2.540
136 2HB PRO 25 2HB PRO 25 5.393 -5.299 4.114
137 1HG PRO 25 1HG PRO 25 4.225 -7.665 3.890
138 2HG PRO 25 2HG PRO 25 3.480 -6.391 4.871
139 1HD PRO 25 1HD PRO 25 2.742 -7.343 2.125
140 2HD PRO 25 2HD PRO 25 1.698 -6.860 3.484
141 H GLU 26 H GLU 26 4.212 -5.723 0.603
142 HA GLU 26 HA GLU 26 6.110 -4.268 -0.877
143 1HB GLU 26 1HB GLU 26 3.663 -5.719 -1.859
144 2HB GLU 26 2HB GLU 26 5.088 -5.334 -2.824
145 1HG GLU 26 1HG GLU 26 4.985 -7.197 -0.463
146 2HG GLU 26 2HG GLU 26 5.012 -7.674 -2.168
147 H HIS 27 H HIS 27 2.641 -4.007 -1.058
148 HA HIS 27 HA HIS 27 2.559 -1.822 -2.841
149 1HB HIS 27 1HB HIS 27 0.759 -3.359 -2.669
150 2HB HIS 27 2HB HIS 27 0.546 -3.046 -0.951
151 HD1 HIS 27 HD1 HIS 27 -1.016 -2.201 -4.124
152 HD2 HIS 27 HD2 HIS 27 -0.332 -0.304 -0.528
153 HE1 HIS 27 HE1 HIS 27 -2.703 -0.351 -4.003
154 H MET 28 H MET 28 2.412 -2.000 0.687
155 HA MET 28 HA MET 28 2.025 0.796 0.984
156 1HB MET 28 1HB MET 28 3.231 -1.076 3.043
157 2HB MET 28 2HB MET 28 2.753 0.593 3.321
158 1HG MET 28 1HG MET 28 0.427 0.007 2.742
159 2HG MET 28 2HG MET 28 0.925 -1.676 2.604
160 1HE MET 28 1HE MET 28 0.370 1.387 4.966
161 2HE MET 28 2HE MET 28 2.080 1.065 5.266
162 3HE MET 28 3HE MET 28 0.889 0.761 6.528
163 H ASP 29 H ASP 29 4.861 -1.141 0.425
164 HA ASP 29 HA ASP 29 6.723 0.890 1.215
165 1HB ASP 29 1HB ASP 29 7.404 -1.477 1.117
166 2HB ASP 29 2HB ASP 29 7.044 -1.505 -0.616
167 H TYR 30 H TYR 30 5.011 0.042 -1.675
168 HA TYR 30 HA TYR 30 6.297 1.869 -3.410
169 1HB TYR 30 1HB TYR 30 4.762 0.067 -4.201
170 2HB TYR 30 2HB TYR 30 3.411 0.927 -3.451
171 HD1 TYR 30 HD1 TYR 30 2.555 2.989 -4.470
172 HD2 TYR 30 HD2 TYR 30 5.722 0.805 -6.270
173 HE1 TYR 30 HE1 TYR 30 2.201 4.222 -6.561
174 HE2 TYR 30 HE2 TYR 30 5.378 2.033 -8.372
175 HH TYR 30 HH TYR 30 3.516 3.205 -9.463
176 H HIS 31 H HIS 31 3.502 2.245 -1.255
177 HA HIS 31 HA HIS 31 3.124 5.035 -1.905
178 1HB HIS 31 1HB HIS 31 2.318 3.538 0.587
179 2HB HIS 31 2HB HIS 31 2.081 5.272 0.401
180 HD1 HIS 31 HD1 HIS 31 0.318 5.900 -1.618
181 HD2 HIS 31 HD2 HIS 31 0.352 2.044 -0.170
182 HE1 HIS 31 HE1 HIS 31 -1.929 4.956 -2.215
183 H PHE 32 H PHE 32 5.167 3.305 0.373
184 HA PHE 32 HA PHE 32 5.811 5.441 2.021
185 1HB PHE 32 1HB PHE 32 6.254 2.921 2.334
186 2HB PHE 32 2HB PHE 32 7.669 3.179 1.306
187 HD1 PHE 32 HD1 PHE 32 6.330 3.312 4.580
188 HD2 PHE 32 HD2 PHE 32 9.397 4.906 2.114
189 HE1 PHE 32 HE1 PHE 32 7.573 4.006 6.584
190 HE2 PHE 32 HE2 PHE 32 10.655 5.597 4.115
191 HZ PHE 32 HZ PHE 32 9.738 5.143 6.352
192 H ALA 33 H ALA 33 7.543 4.015 -0.683
193 HA ALA 33 HA ALA 33 9.564 5.932 -0.870
194 1HB ALA 33 1HB ALA 33 8.410 4.212 -3.048
195 2HB ALA 33 2HB ALA 33 9.677 3.729 -1.921
196 3HB ALA 33 3HB ALA 33 9.978 5.015 -3.096
197 H LEU 34 H LEU 34 6.417 5.728 -2.352
198 HA LEU 34 HA LEU 34 6.668 7.896 -4.165
199 1HB LEU 34 1HB LEU 34 4.948 6.158 -4.342
200 2HB LEU 34 2HB LEU 34 4.194 6.778 -2.882
201 HG LEU 34 HG LEU 34 3.581 8.846 -4.024
202 1HD1 LEU 34 1HD1 LEU 34 3.913 9.101 -6.422
203 2HD1 LEU 34 2HD1 LEU 34 4.820 7.592 -6.465
204 3HD1 LEU 34 3HD1 LEU 34 5.466 8.982 -5.592
205 1HD2 LEU 34 1HD2 LEU 34 2.076 6.922 -4.094
206 2HD2 LEU 34 2HD2 LEU 34 2.823 6.405 -5.606
207 3HD2 LEU 34 3HD2 LEU 34 1.941 7.933 -5.532
208 H GLU 35 H GLU 35 5.506 7.711 -0.839
209 HA GLU 35 HA GLU 35 4.820 10.510 -0.766
210 1HB GLU 35 1HB GLU 35 4.925 8.434 1.438
211 2HB GLU 35 2HB GLU 35 4.377 10.087 1.664
212 1HG GLU 35 1HG GLU 35 2.551 9.687 0.080
213 2HG GLU 35 2HG GLU 35 3.110 8.018 -0.118
214 H LEU 36 H LEU 36 7.603 8.614 -0.358
215 HA LEU 36 HA LEU 36 8.928 10.458 1.426
216 1HB LEU 36 1HB LEU 36 9.273 8.035 1.629
217 2HB LEU 36 2HB LEU 36 9.896 7.997 -0.016
218 HG LEU 36 HG LEU 36 11.829 9.320 0.700
219 1HD1 LEU 36 1HD1 LEU 36 12.239 9.701 3.080
220 2HD1 LEU 36 2HD1 LEU 36 10.664 9.018 3.464
221 3HD1 LEU 36 3HD1 LEU 36 10.771 10.532 2.563
222 1HD2 LEU 36 1HD2 LEU 36 11.310 6.843 2.335
223 2HD2 LEU 36 2HD2 LEU 36 12.888 7.571 2.051
224 3HD2 LEU 36 3HD2 LEU 36 11.970 6.902 0.699
225 H GLN 37 H GLN 37 8.350 10.237 -1.906
226 HA GLN 37 HA GLN 37 10.794 10.977 -2.993
227 1HB GLN 37 1HB GLN 37 8.029 11.600 -4.024
228 2HB GLN 37 2HB GLN 37 9.515 11.922 -4.927
229 1HG GLN 37 1HG GLN 37 8.528 9.232 -3.997
230 2HG GLN 37 2HG GLN 37 8.491 9.853 -5.658
231 1HE2 GLN 37 1HE2 GLN 37 9.757 7.508 -4.509
232 2HE2 GLN 37 2HE2 GLN 37 11.443 7.572 -4.903
233 H LYS 38 H LYS 38 8.166 13.237 -2.099
234 HA LYS 38 HA LYS 38 10.308 15.243 -1.872
235 1HB LYS 38 1HB LYS 38 8.603 16.983 -1.914
236 2HB LYS 38 2HB LYS 38 8.368 15.913 -3.300
237 1HG LYS 38 1HG LYS 38 6.533 14.833 -2.169
238 2HG LYS 38 2HG LYS 38 6.792 15.847 -0.734
239 1HD LYS 38 1HD LYS 38 6.297 17.821 -2.109
240 2HD LYS 38 2HD LYS 38 6.020 16.774 -3.500
241 1HE LYS 38 1HE LYS 38 4.449 16.826 -0.922
242 2HE LYS 38 2HE LYS 38 3.908 17.377 -2.498
243 1HZ LYS 38 1HZ LYS 38 4.537 14.566 -1.761
244 2HZ LYS 38 2HZ LYS 38 4.092 15.079 -3.301
245 3HZ LYS 38 3HZ LYS 38 3.011 15.212 -2.031
246 H SER 39 H SER 39 8.682 13.064 -0.189
247 HA SER 39 HA SER 39 8.387 12.500 1.947
248 1HB SER 39 1HB SER 39 10.242 14.805 2.563
249 2HB SER 39 2HB SER 39 9.894 13.430 3.613
250 HG SER 39 HG SER 39 10.703 12.592 1.179