Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
531556 | 2l9a RC | 17442 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 LYS 1 H1 LYS 1 6.300 1.234 -17.029
2 H2 LYS 1 H2 LYS 1 7.900 1.464 -16.520
3 H3 LYS 1 H3 LYS 1 6.616 1.783 -15.460
4 HA LYS 1 HA LYS 1 6.015 -0.492 -15.355
5 HB2 LYS 1 HB2 LYS 1 8.250 -0.869 -17.354
6 HB3 LYS 1 HB3 LYS 1 7.486 -2.192 -16.482
7 HG2 LYS 1 HG2 LYS 1 6.077 -0.284 -18.342
8 HG3 LYS 1 HG3 LYS 1 6.574 -1.932 -18.735
9 HD2 LYS 1 HD2 LYS 1 5.070 -2.856 -17.149
10 HD3 LYS 1 HD3 LYS 1 4.741 -1.273 -16.442
11 HE2 LYS 1 HE2 LYS 1 2.904 -2.054 -17.872
12 HE3 LYS 1 HE3 LYS 1 3.630 -0.563 -18.467
13 HZ1 LYS 1 HZ1 LYS 1 4.696 -1.691 -20.199
14 HZ2 LYS 1 HZ2 LYS 1 3.131 -2.356 -20.158
15 HZ3 LYS 1 HZ3 LYS 1 4.436 -3.217 -19.501
16 H LYS 2 H LYS 2 9.558 -0.166 -15.833
17 HA LYS 2 HA LYS 2 9.922 -1.408 -13.252
18 HB2 LYS 2 HB2 LYS 2 12.313 -1.421 -13.773
19 HB3 LYS 2 HB3 LYS 2 11.359 -2.125 -15.065
20 HG2 LYS 2 HG2 LYS 2 11.638 -0.130 -16.405
21 HG3 LYS 2 HG3 LYS 2 12.500 0.667 -15.085
22 HD2 LYS 2 HD2 LYS 2 14.171 -1.211 -15.181
23 HD3 LYS 2 HD3 LYS 2 13.370 -1.754 -16.655
24 HE2 LYS 2 HE2 LYS 2 14.632 0.950 -16.239
25 HE3 LYS 2 HE3 LYS 2 15.368 -0.393 -17.106
26 HZ1 LYS 2 HZ1 LYS 2 12.948 1.140 -17.868
27 HZ2 LYS 2 HZ2 LYS 2 13.391 -0.312 -18.620
28 HZ3 LYS 2 HZ3 LYS 2 14.420 1.036 -18.706
29 H LEU 3 H LEU 3 8.777 0.491 -12.312
30 HA LEU 3 HA LEU 3 10.606 1.902 -10.712
31 HB2 LEU 3 HB2 LEU 3 10.290 4.169 -11.333
32 HB3 LEU 3 HB3 LEU 3 10.771 3.316 -12.783
33 HG LEU 3 HG LEU 3 7.881 3.931 -12.187
34 HD11 LEU 3 HD11 LEU 3 9.864 5.630 -13.697
35 HD12 LEU 3 HD12 LEU 3 9.090 6.039 -12.165
36 HD13 LEU 3 HD13 LEU 3 8.123 5.896 -13.634
37 HD21 LEU 3 HD21 LEU 3 7.641 3.705 -14.608
38 HD22 LEU 3 HD22 LEU 3 8.315 2.236 -13.896
39 HD23 LEU 3 HD23 LEU 3 9.365 3.366 -14.754
40 H LYS 4 H LYS 4 7.355 1.554 -11.974
41 HA LYS 4 HA LYS 4 6.290 2.454 -9.386
42 HB2 LYS 4 HB2 LYS 4 5.545 3.576 -11.564
43 HB3 LYS 4 HB3 LYS 4 4.680 2.083 -11.907
44 HG2 LYS 4 HG2 LYS 4 3.180 3.695 -10.926
45 HG3 LYS 4 HG3 LYS 4 3.426 2.352 -9.805
46 HD2 LYS 4 HD2 LYS 4 5.121 3.704 -8.622
47 HD3 LYS 4 HD3 LYS 4 4.761 5.054 -9.697
48 HE2 LYS 4 HE2 LYS 4 2.413 4.979 -8.916
49 HE3 LYS 4 HE3 LYS 4 2.873 3.726 -7.765
50 HZ1 LYS 4 HZ1 LYS 4 3.961 6.484 -7.853
51 HZ2 LYS 4 HZ2 LYS 4 4.413 5.289 -6.743
52 HZ3 LYS 4 HZ3 LYS 4 2.832 5.901 -6.733
53 H LEU 5 H LEU 5 5.721 -0.016 -11.904
54 HA LEU 5 HA LEU 5 4.072 -1.610 -10.205
55 HB2 LEU 5 HB2 LEU 5 5.469 -2.303 -12.794
56 HB3 LEU 5 HB3 LEU 5 4.278 -3.315 -11.997
57 HG LEU 5 HG LEU 5 3.783 -0.572 -13.164
58 HD11 LEU 5 HD11 LEU 5 2.903 -3.318 -14.039
59 HD12 LEU 5 HD12 LEU 5 4.059 -2.272 -14.865
60 HD13 LEU 5 HD13 LEU 5 2.365 -1.797 -14.748
61 HD21 LEU 5 HD21 LEU 5 2.418 -0.951 -11.176
62 HD22 LEU 5 HD22 LEU 5 1.868 -2.490 -11.841
63 HD23 LEU 5 HD23 LEU 5 1.436 -0.979 -12.641
64 H ALA 6 H ALA 6 7.372 -1.134 -10.378
65 HA ALA 6 HA ALA 6 8.023 -3.743 -9.221
66 HB1 ALA 6 HB1 ALA 6 10.355 -3.079 -9.499
67 HB2 ALA 6 HB2 ALA 6 9.843 -1.494 -10.081
68 HB3 ALA 6 HB3 ALA 6 9.471 -2.941 -11.019
69 H LEU 7 H LEU 7 6.813 -0.957 -8.151
70 HA LEU 7 HA LEU 7 8.539 -0.724 -5.790
71 HB2 LEU 7 HB2 LEU 7 8.004 1.318 -7.124
72 HB3 LEU 7 HB3 LEU 7 6.313 1.093 -6.719
73 HG LEU 7 HG LEU 7 6.891 1.363 -4.316
74 HD11 LEU 7 HD11 LEU 7 9.219 0.663 -4.422
75 HD12 LEU 7 HD12 LEU 7 9.079 2.277 -3.727
76 HD13 LEU 7 HD13 LEU 7 9.612 2.080 -5.395
77 HD21 LEU 7 HD21 LEU 7 7.695 3.627 -6.139
78 HD22 LEU 7 HD22 LEU 7 7.284 3.786 -4.431
79 HD23 LEU 7 HD23 LEU 7 6.061 3.255 -5.586
80 H ALA 8 H ALA 8 7.949 -1.925 -4.135
81 HA ALA 8 HA ALA 8 6.733 -2.936 -2.514
82 HB1 ALA 8 HB1 ALA 8 4.539 -2.106 -1.912
83 HB2 ALA 8 HB2 ALA 8 4.415 -1.247 -3.446
84 HB3 ALA 8 HB3 ALA 8 5.620 -0.756 -2.259
85 H LYS 9 H LYS 9 6.289 -3.345 -5.689
86 HA LYS 9 HA LYS 9 5.750 -5.148 -6.935
87 HB2 LYS 9 HB2 LYS 9 5.029 -6.421 -4.292
88 HB3 LYS 9 HB3 LYS 9 5.013 -7.261 -5.835
89 HG2 LYS 9 HG2 LYS 9 7.423 -6.041 -4.495
90 HG3 LYS 9 HG3 LYS 9 7.043 -7.760 -4.617
91 HD2 LYS 9 HD2 LYS 9 7.619 -5.898 -6.924
92 HD3 LYS 9 HD3 LYS 9 8.720 -7.112 -6.273
93 HE2 LYS 9 HE2 LYS 9 6.034 -7.664 -7.539
94 HE3 LYS 9 HE3 LYS 9 7.598 -7.879 -8.322
95 HZ1 LYS 9 HZ1 LYS 9 6.617 -9.355 -5.932
96 HZ2 LYS 9 HZ2 LYS 9 8.156 -9.530 -6.621
97 HZ3 LYS 9 HZ3 LYS 9 6.775 -9.972 -7.505
98 H LEU 10 H LEU 10 3.239 -5.536 -4.455
99 HA LEU 10 HA LEU 10 1.263 -5.170 -6.590
100 HB2 LEU 10 HB2 LEU 10 1.090 -6.536 -3.909
101 HB3 LEU 10 HB3 LEU 10 -0.333 -6.155 -4.856
102 HG LEU 10 HG LEU 10 0.673 -7.555 -6.718
103 HD11 LEU 10 HD11 LEU 10 2.983 -7.579 -5.923
104 HD12 LEU 10 HD12 LEU 10 2.344 -9.215 -6.094
105 HD13 LEU 10 HD13 LEU 10 2.484 -8.483 -4.495
106 HD21 LEU 10 HD21 LEU 10 -1.153 -8.325 -5.302
107 HD22 LEU 10 HD22 LEU 10 0.008 -8.912 -4.112
108 HD23 LEU 10 HD23 LEU 10 -0.065 -9.651 -5.713
109 H ALA 11 H ALA 11 2.782 -3.316 -4.521
110 HA ALA 11 HA ALA 11 2.407 -1.417 -3.331
111 HB1 ALA 11 HB1 ALA 11 0.844 0.172 -4.315
112 HB2 ALA 11 HB2 ALA 11 0.104 -1.122 -5.257
113 HB3 ALA 11 HB3 ALA 11 1.775 -0.651 -5.567
114 HA PRO 12 HA PRO 12 -0.881 -3.716 -0.840
115 HB2 PRO 12 HB2 PRO 12 0.521 -3.352 1.527
116 HB3 PRO 12 HB3 PRO 12 0.583 -4.794 0.511
117 HG2 PRO 12 HG2 PRO 12 2.479 -2.490 0.652
118 HG3 PRO 12 HG3 PRO 12 2.820 -4.217 0.440
119 HD2 PRO 12 HD2 PRO 12 2.919 -2.519 -1.624
120 HD3 PRO 12 HD3 PRO 12 2.304 -4.174 -1.819
121 H LEU 13 H LEU 13 0.813 -0.681 -0.277
122 HA LEU 13 HA LEU 13 -0.928 0.352 1.682
123 HB2 LEU 13 HB2 LEU 13 0.778 1.814 -0.336
124 HB3 LEU 13 HB3 LEU 13 -0.002 2.563 1.045
125 HG LEU 13 HG LEU 13 2.163 0.461 1.160
126 HD11 LEU 13 HD11 LEU 13 3.543 2.251 2.061
127 HD12 LEU 13 HD12 LEU 13 2.214 3.392 1.853
128 HD13 LEU 13 HD13 LEU 13 2.968 2.649 0.442
129 HD21 LEU 13 HD21 LEU 13 2.151 0.895 3.578
130 HD22 LEU 13 HD22 LEU 13 0.622 0.216 3.019
131 HD23 LEU 13 HD23 LEU 13 0.745 1.940 3.373
132 H TRP 14 H TRP 14 -1.016 0.397 -1.829
133 HA TRP 14 HA TRP 14 -3.334 2.130 -1.869
134 HB2 TRP 14 HB2 TRP 14 -1.709 0.791 -4.021
135 HB3 TRP 14 HB3 TRP 14 -3.216 1.631 -4.378
136 HD1 TRP 14 HD1 TRP 14 0.433 2.258 -3.631
137 HE1 TRP 14 HE1 TRP 14 0.911 4.790 -3.754
138 HE3 TRP 14 HE3 TRP 14 -4.372 3.972 -3.913
139 HZ2 TRP 14 HZ2 TRP 14 -0.568 7.191 -3.937
140 HZ3 TRP 14 HZ3 TRP 14 -4.758 6.395 -4.051
141 HH2 TRP 14 HH2 TRP 14 -2.895 7.971 -4.062
142 H LYS 15 H LYS 15 -2.936 -0.977 -1.084
143 HA LYS 15 HA LYS 15 -5.496 -1.807 -2.253
144 HB2 LYS 15 HB2 LYS 15 -3.404 -3.433 -0.789
145 HB3 LYS 15 HB3 LYS 15 -4.909 -4.070 -1.437
146 HG2 LYS 15 HG2 LYS 15 -2.690 -2.836 -3.054
147 HG3 LYS 15 HG3 LYS 15 -3.013 -4.563 -2.890
148 HD2 LYS 15 HD2 LYS 15 -4.965 -2.558 -4.016
149 HD3 LYS 15 HD3 LYS 15 -3.895 -3.562 -4.994
150 HE2 LYS 15 HE2 LYS 15 -4.949 -5.575 -4.053
151 HE3 LYS 15 HE3 LYS 15 -6.032 -4.554 -3.108
152 HZ1 LYS 15 HZ1 LYS 15 -7.091 -5.351 -5.133
153 HZ2 LYS 15 HZ2 LYS 15 -5.883 -4.620 -6.077
154 HZ3 LYS 15 HZ3 LYS 15 -6.940 -3.662 -5.156
155 H ALA 16 H ALA 16 -3.797 -1.177 0.737
156 HA ALA 16 HA ALA 16 -5.881 -2.067 2.466
157 HB1 ALA 16 HB1 ALA 16 -4.595 -1.006 4.241
158 HB2 ALA 16 HB2 ALA 16 -3.579 -0.204 3.044
159 HB3 ALA 16 HB3 ALA 16 -3.549 -1.962 3.194
160 H LEU 17 H LEU 17 -4.932 1.108 1.184
161 HA LEU 17 HA LEU 17 -6.985 2.473 2.667
162 HB2 LEU 17 HB2 LEU 17 -5.006 3.294 0.569
163 HB3 LEU 17 HB3 LEU 17 -6.339 4.354 0.974
164 HG LEU 17 HG LEU 17 -4.381 5.044 2.187
165 HD11 LEU 17 HD11 LEU 17 -6.342 3.667 4.011
166 HD12 LEU 17 HD12 LEU 17 -6.503 5.286 3.329
167 HD13 LEU 17 HD13 LEU 17 -5.214 4.941 4.482
168 HD21 LEU 17 HD21 LEU 17 -3.260 3.605 3.812
169 HD22 LEU 17 HD22 LEU 17 -3.148 2.940 2.182
170 HD23 LEU 17 HD23 LEU 17 -4.293 2.256 3.336
171 H ALA 18 H ALA 18 -6.702 0.828 -0.315
172 HA ALA 18 HA ALA 18 -8.883 2.079 -1.642
173 HB1 ALA 18 HB1 ALA 18 -8.711 0.263 -3.251
174 HB2 ALA 18 HB2 ALA 18 -7.637 -0.617 -2.164
175 HB3 ALA 18 HB3 ALA 18 -7.116 0.912 -2.874
176 H LEU 19 H LEU 19 -8.575 -0.375 0.756
177 HA LEU 19 HA LEU 19 -10.946 -1.807 0.370
178 HB2 LEU 19 HB2 LEU 19 -9.497 -1.134 2.934
179 HB3 LEU 19 HB3 LEU 19 -10.798 -2.303 2.813
180 HG LEU 19 HG LEU 19 -8.127 -2.505 1.424
181 HD11 LEU 19 HD11 LEU 19 -9.246 -3.977 3.798
182 HD12 LEU 19 HD12 LEU 19 -7.900 -2.837 3.802
183 HD13 LEU 19 HD13 LEU 19 -7.745 -4.382 2.966
184 HD21 LEU 19 HD21 LEU 19 -9.934 -3.531 0.128
185 HD22 LEU 19 HD22 LEU 19 -10.416 -4.466 1.545
186 HD23 LEU 19 HD23 LEU 19 -8.845 -4.750 0.794
187 H LYS 20 H LYS 20 -10.318 1.152 2.233
188 HA LYS 20 HA LYS 20 -13.050 1.397 3.063
189 HB2 LYS 20 HB2 LYS 20 -11.161 2.316 4.387
190 HB3 LYS 20 HB3 LYS 20 -10.852 3.477 3.102
191 HG2 LYS 20 HG2 LYS 20 -13.057 4.458 3.443
192 HG3 LYS 20 HG3 LYS 20 -13.384 3.286 4.720
193 HD2 LYS 20 HD2 LYS 20 -11.482 4.172 5.997
194 HD3 LYS 20 HD3 LYS 20 -11.199 5.363 4.726
195 HE2 LYS 20 HE2 LYS 20 -13.696 5.114 6.396
196 HE3 LYS 20 HE3 LYS 20 -12.437 6.329 6.598
197 HZ1 LYS 20 HZ1 LYS 20 -12.941 7.042 4.272
198 HZ2 LYS 20 HZ2 LYS 20 -14.183 7.322 5.387
199 HZ3 LYS 20 HZ3 LYS 20 -14.297 6.018 4.303
200 H LEU 21 H LEU 21 -11.037 2.733 0.519
201 HA LEU 21 HA LEU 21 -12.810 4.697 -0.438
202 HB2 LEU 21 HB2 LEU 21 -10.429 4.581 -1.037
203 HB3 LEU 21 HB3 LEU 21 -10.723 3.108 -1.936
204 HG LEU 21 HG LEU 21 -12.200 4.404 -3.475
205 HD11 LEU 21 HD11 LEU 21 -11.128 6.756 -1.923
206 HD12 LEU 21 HD12 LEU 21 -12.807 6.219 -1.984
207 HD13 LEU 21 HD13 LEU 21 -12.030 6.854 -3.435
208 HD21 LEU 21 HD21 LEU 21 -9.358 5.374 -3.192
209 HD22 LEU 21 HD22 LEU 21 -10.356 5.528 -4.639
210 HD23 LEU 21 HD23 LEU 21 -9.885 3.930 -4.056
211 H LYS 22 H LYS 22 -12.682 1.273 -0.853
212 HA LYS 22 HA LYS 22 -14.449 1.165 -3.122
213 HB2 LYS 22 HB2 LYS 22 -12.661 -0.516 -2.657
214 HB3 LYS 22 HB3 LYS 22 -13.561 -1.031 -1.239
215 HG2 LYS 22 HG2 LYS 22 -15.414 -1.731 -2.676
216 HG3 LYS 22 HG3 LYS 22 -14.493 -1.225 -4.096
217 HD2 LYS 22 HD2 LYS 22 -12.732 -2.833 -3.505
218 HD3 LYS 22 HD3 LYS 22 -13.683 -3.349 -2.111
219 HE2 LYS 22 HE2 LYS 22 -13.974 -4.909 -3.936
220 HE3 LYS 22 HE3 LYS 22 -15.484 -4.055 -3.626
221 HZ1 LYS 22 HZ1 LYS 22 -15.047 -2.627 -5.506
222 HZ2 LYS 22 HZ2 LYS 22 -14.987 -4.251 -5.995
223 HZ3 LYS 22 HZ3 LYS 22 -13.550 -3.378 -5.778
224 H LYS 23 H LYS 23 -14.856 1.641 0.175
225 HA LYS 23 HA LYS 23 -17.560 0.501 0.172
226 HB2 LYS 23 HB2 LYS 23 -16.132 -0.421 1.916
227 HB3 LYS 23 HB3 LYS 23 -15.744 1.196 2.487
228 HG2 LYS 23 HG2 LYS 23 -18.158 1.502 3.032
229 HG3 LYS 23 HG3 LYS 23 -18.406 -0.200 2.631
230 HD2 LYS 23 HD2 LYS 23 -16.783 -0.837 4.346
231 HD3 LYS 23 HD3 LYS 23 -16.538 0.863 4.749
232 HE2 LYS 23 HE2 LYS 23 -18.936 1.026 5.339
233 HE3 LYS 23 HE3 LYS 23 -19.102 -0.702 5.026
234 HZ1 LYS 23 HZ1 LYS 23 -17.377 -1.069 6.754
235 HZ2 LYS 23 HZ2 LYS 23 -18.810 -0.389 7.354
236 HZ3 LYS 23 HZ3 LYS 23 -17.441 0.586 7.124
237 H ALA 24 H ALA 24 -15.885 3.169 1.848
238 HA ALA 24 HA ALA 24 -17.550 5.226 0.878
239 HB1 ALA 24 HB1 ALA 24 -19.271 4.087 2.214
240 HB2 ALA 24 HB2 ALA 24 -18.896 5.682 2.865
241 HB3 ALA 24 HB3 ALA 24 -18.256 4.237 3.647
Start of MODEL 2
1 H1 LYS 1 H1 LYS 1 9.252 -0.253 12.629
2 H2 LYS 1 H2 LYS 1 8.143 -1.506 12.910
3 H3 LYS 1 H3 LYS 1 7.744 0.088 13.327
4 HA LYS 1 HA LYS 1 8.254 -0.856 10.567
5 HB2 LYS 1 HB2 LYS 1 5.756 -0.514 10.308
6 HB3 LYS 1 HB3 LYS 1 6.240 -1.906 11.264
7 HG2 LYS 1 HG2 LYS 1 5.793 -0.640 13.317
8 HG3 LYS 1 HG3 LYS 1 5.280 0.736 12.343
9 HD2 LYS 1 HD2 LYS 1 3.342 -0.484 13.111
10 HD3 LYS 1 HD3 LYS 1 3.498 -0.664 11.363
11 HE2 LYS 1 HE2 LYS 1 4.515 -2.860 11.675
12 HE3 LYS 1 HE3 LYS 1 4.394 -2.676 13.424
13 HZ1 LYS 1 HZ1 LYS 1 2.594 -4.028 12.484
14 HZ2 LYS 1 HZ2 LYS 1 2.080 -2.698 11.560
15 HZ3 LYS 1 HZ3 LYS 1 2.010 -2.630 13.251
16 H LYS 2 H LYS 2 9.575 0.945 10.220
17 HA LYS 2 HA LYS 2 8.055 3.410 9.803
18 HB2 LYS 2 HB2 LYS 2 9.992 4.750 10.580
19 HB3 LYS 2 HB3 LYS 2 9.278 3.785 11.867
20 HG2 LYS 2 HG2 LYS 2 11.058 2.115 11.570
21 HG3 LYS 2 HG3 LYS 2 11.788 3.142 10.335
22 HD2 LYS 2 HD2 LYS 2 12.178 4.891 11.950
23 HD3 LYS 2 HD3 LYS 2 11.303 3.987 13.190
24 HE2 LYS 2 HE2 LYS 2 12.997 2.183 12.992
25 HE3 LYS 2 HE3 LYS 2 13.893 3.198 11.864
26 HZ1 LYS 2 HZ1 LYS 2 13.210 4.103 14.598
27 HZ2 LYS 2 HZ2 LYS 2 14.373 4.744 13.538
28 HZ3 LYS 2 HZ3 LYS 2 14.626 3.234 14.261
29 H LEU 3 H LEU 3 9.186 4.883 8.291
30 HA LEU 3 HA LEU 3 10.156 5.353 6.307
31 HB2 LEU 3 HB2 LEU 3 12.125 3.220 7.128
32 HB3 LEU 3 HB3 LEU 3 12.367 4.387 5.844
33 HG LEU 3 HG LEU 3 12.039 5.093 8.764
34 HD11 LEU 3 HD11 LEU 3 14.518 4.958 7.050
35 HD12 LEU 3 HD12 LEU 3 14.113 3.883 8.389
36 HD13 LEU 3 HD13 LEU 3 14.440 5.589 8.695
37 HD21 LEU 3 HD21 LEU 3 12.824 6.769 6.380
38 HD22 LEU 3 HD22 LEU 3 12.798 7.309 8.058
39 HD23 LEU 3 HD23 LEU 3 11.294 6.858 7.256
40 H LYS 4 H LYS 4 11.484 2.202 5.811
41 HA LYS 4 HA LYS 4 9.607 1.879 3.588
42 HB2 LYS 4 HB2 LYS 4 11.248 0.368 2.605
43 HB3 LYS 4 HB3 LYS 4 11.984 1.913 2.997
44 HG2 LYS 4 HG2 LYS 4 12.987 0.954 4.985
45 HG3 LYS 4 HG3 LYS 4 12.209 -0.593 4.641
46 HD2 LYS 4 HD2 LYS 4 13.439 -0.739 2.526
47 HD3 LYS 4 HD3 LYS 4 14.221 0.803 2.876
48 HE2 LYS 4 HE2 LYS 4 14.445 -1.677 4.577
49 HE3 LYS 4 HE3 LYS 4 15.643 -1.152 3.396
50 HZ1 LYS 4 HZ1 LYS 4 14.811 0.351 5.822
51 HZ2 LYS 4 HZ2 LYS 4 15.927 0.893 4.667
52 HZ3 LYS 4 HZ3 LYS 4 16.280 -0.472 5.608
53 H LEU 5 H LEU 5 9.898 0.797 6.691
54 HA LEU 5 HA LEU 5 9.250 -1.973 6.258
55 HB2 LEU 5 HB2 LEU 5 9.034 -0.255 8.733
56 HB3 LEU 5 HB3 LEU 5 8.783 -1.991 8.698
57 HG LEU 5 HG LEU 5 11.379 -0.573 8.072
58 HD11 LEU 5 HD11 LEU 5 10.805 -0.506 10.441
59 HD12 LEU 5 HD12 LEU 5 12.167 -1.587 10.147
60 HD13 LEU 5 HD13 LEU 5 10.559 -2.251 10.439
61 HD21 LEU 5 HD21 LEU 5 10.737 -3.515 8.228
62 HD22 LEU 5 HD22 LEU 5 12.342 -2.818 8.008
63 HD23 LEU 5 HD23 LEU 5 11.113 -2.610 6.761
64 H ALA 6 H ALA 6 7.558 0.929 6.111
65 HA ALA 6 HA ALA 6 4.989 -0.491 6.298
66 HB1 ALA 6 HB1 ALA 6 5.502 2.484 6.381
67 HB2 ALA 6 HB2 ALA 6 5.184 1.458 7.779
68 HB3 ALA 6 HB3 ALA 6 3.935 1.691 6.556
69 H LEU 7 H LEU 7 7.147 -0.132 4.112
70 HA LEU 7 HA LEU 7 5.434 0.999 2.006
71 HB2 LEU 7 HB2 LEU 7 7.588 2.095 2.221
72 HB3 LEU 7 HB3 LEU 7 8.418 0.558 2.092
73 HG LEU 7 HG LEU 7 7.548 0.336 -0.233
74 HD11 LEU 7 HD11 LEU 7 6.644 2.303 -1.340
75 HD12 LEU 7 HD12 LEU 7 6.663 3.186 0.186
76 HD13 LEU 7 HD13 LEU 7 5.601 1.792 -0.013
77 HD21 LEU 7 HD21 LEU 7 9.081 1.978 -1.201
78 HD22 LEU 7 HD22 LEU 7 9.796 1.151 0.182
79 HD23 LEU 7 HD23 LEU 7 9.184 2.797 0.357
80 H ALA 8 H ALA 8 8.124 -1.282 1.732
81 HA ALA 8 HA ALA 8 6.610 -2.822 -0.183
82 HB1 ALA 8 HB1 ALA 8 8.956 -2.289 -0.589
83 HB2 ALA 8 HB2 ALA 8 8.693 -4.033 -0.532
84 HB3 ALA 8 HB3 ALA 8 9.415 -3.205 0.848
85 H LYS 9 H LYS 9 6.571 -2.809 3.031
86 HA LYS 9 HA LYS 9 6.396 -5.723 3.311
87 HB2 LYS 9 HB2 LYS 9 8.078 -4.354 4.707
88 HB3 LYS 9 HB3 LYS 9 6.675 -3.758 5.583
89 HG2 LYS 9 HG2 LYS 9 6.098 -6.070 6.188
90 HG3 LYS 9 HG3 LYS 9 7.548 -6.631 5.351
91 HD2 LYS 9 HD2 LYS 9 8.868 -5.113 6.874
92 HD3 LYS 9 HD3 LYS 9 7.380 -4.882 7.796
93 HE2 LYS 9 HE2 LYS 9 8.692 -6.610 8.835
94 HE3 LYS 9 HE3 LYS 9 7.250 -7.331 8.117
95 HZ1 LYS 9 HZ1 LYS 9 9.976 -7.330 6.934
96 HZ2 LYS 9 HZ2 LYS 9 8.594 -7.991 6.206
97 HZ3 LYS 9 HZ3 LYS 9 9.193 -8.663 7.642
98 H LEU 10 H LEU 10 4.429 -3.502 2.466
99 HA LEU 10 HA LEU 10 2.141 -4.512 3.880
100 HB2 LEU 10 HB2 LEU 10 2.991 -2.838 5.468
101 HB3 LEU 10 HB3 LEU 10 2.938 -1.619 4.210
102 HG LEU 10 HG LEU 10 0.476 -1.869 4.101
103 HD11 LEU 10 HD11 LEU 10 0.305 -4.168 4.884
104 HD12 LEU 10 HD12 LEU 10 -0.682 -3.090 5.876
105 HD13 LEU 10 HD13 LEU 10 0.869 -3.677 6.480
106 HD21 LEU 10 HD21 LEU 10 1.475 -0.123 5.474
107 HD22 LEU 10 HD22 LEU 10 1.580 -1.241 6.836
108 HD23 LEU 10 HD23 LEU 10 0.002 -0.743 6.221
109 H ALA 11 H ALA 11 3.324 -1.820 1.859
110 HA ALA 11 HA ALA 11 2.471 -0.764 0.044
111 HB1 ALA 11 HB1 ALA 11 1.349 -2.105 -1.648
112 HB2 ALA 11 HB2 ALA 11 1.080 -3.393 -0.472
113 HB3 ALA 11 HB3 ALA 11 2.722 -2.986 -0.972
114 HA PRO 12 HA PRO 12 -1.424 0.048 2.454
115 HB2 PRO 12 HB2 PRO 12 -0.458 2.811 2.444
116 HB3 PRO 12 HB3 PRO 12 -0.881 1.778 3.811
117 HG2 PRO 12 HG2 PRO 12 1.666 2.477 3.285
118 HG3 PRO 12 HG3 PRO 12 1.240 0.899 3.978
119 HD2 PRO 12 HD2 PRO 12 1.914 1.605 1.140
120 HD3 PRO 12 HD3 PRO 12 2.438 0.209 2.109
121 H LEU 13 H LEU 13 0.032 1.492 -0.343
122 HA LEU 13 HA LEU 13 -2.248 3.042 -1.116
123 HB2 LEU 13 HB2 LEU 13 -1.093 3.490 -3.162
124 HB3 LEU 13 HB3 LEU 13 0.053 3.598 -1.844
125 HG LEU 13 HG LEU 13 -0.188 1.163 -3.616
126 HD11 LEU 13 HD11 LEU 13 1.682 3.519 -3.860
127 HD12 LEU 13 HD12 LEU 13 0.396 3.086 -4.986
128 HD13 LEU 13 HD13 LEU 13 1.789 2.024 -4.787
129 HD21 LEU 13 HD21 LEU 13 0.889 0.824 -1.421
130 HD22 LEU 13 HD22 LEU 13 2.039 2.103 -1.807
131 HD23 LEU 13 HD23 LEU 13 2.014 0.622 -2.763
132 H TRP 14 H TRP 14 -1.804 -0.193 -0.964
133 HA TRP 14 HA TRP 14 -3.790 -0.646 -3.085
134 HB2 TRP 14 HB2 TRP 14 -1.688 -1.769 -3.637
135 HB3 TRP 14 HB3 TRP 14 -1.681 -2.565 -2.068
136 HD1 TRP 14 HD1 TRP 14 -3.323 -4.649 -1.736
137 HE1 TRP 14 HE1 TRP 14 -4.583 -6.148 -3.412
138 HE3 TRP 14 HE3 TRP 14 -2.896 -1.730 -5.908
139 HZ2 TRP 14 HZ2 TRP 14 -5.293 -6.094 -6.133
140 HZ3 TRP 14 HZ3 TRP 14 -3.897 -2.528 -8.008
141 HH2 TRP 14 HH2 TRP 14 -5.069 -4.664 -8.118
142 H LYS 15 H LYS 15 -2.591 -1.973 -0.002
143 HA LYS 15 HA LYS 15 -4.699 -3.750 0.395
144 HB2 LYS 15 HB2 LYS 15 -3.012 -2.443 2.527
145 HB3 LYS 15 HB3 LYS 15 -3.952 -3.916 2.708
146 HG2 LYS 15 HG2 LYS 15 -1.525 -3.509 0.981
147 HG3 LYS 15 HG3 LYS 15 -1.651 -4.491 2.439
148 HD2 LYS 15 HD2 LYS 15 -3.372 -5.877 1.231
149 HD3 LYS 15 HD3 LYS 15 -2.945 -4.993 -0.235
150 HE2 LYS 15 HE2 LYS 15 -1.150 -6.734 1.442
151 HE3 LYS 15 HE3 LYS 15 -1.707 -7.044 -0.200
152 HZ1 LYS 15 HZ1 LYS 15 -0.393 -5.248 -1.013
153 HZ2 LYS 15 HZ2 LYS 15 0.607 -6.213 -0.038
154 HZ3 LYS 15 HZ3 LYS 15 0.009 -4.744 0.556
155 H ALA 16 H ALA 16 -4.355 -0.413 1.563
156 HA ALA 16 HA ALA 16 -7.175 -0.504 2.354
157 HB1 ALA 16 HB1 ALA 16 -4.994 0.523 4.165
158 HB2 ALA 16 HB2 ALA 16 -5.815 -1.028 4.346
159 HB3 ALA 16 HB3 ALA 16 -6.721 0.476 4.513
160 H LEU 17 H LEU 17 -6.360 0.687 0.080
161 HA LEU 17 HA LEU 17 -6.515 3.543 0.763
162 HB2 LEU 17 HB2 LEU 17 -4.602 2.879 -0.680
163 HB3 LEU 17 HB3 LEU 17 -5.741 2.283 -1.872
164 HG LEU 17 HG LEU 17 -6.646 4.587 -2.103
165 HD11 LEU 17 HD11 LEU 17 -6.029 5.457 0.082
166 HD12 LEU 17 HD12 LEU 17 -5.346 6.454 -1.199
167 HD13 LEU 17 HD13 LEU 17 -4.320 5.316 -0.329
168 HD21 LEU 17 HD21 LEU 17 -4.772 5.452 -3.394
169 HD22 LEU 17 HD22 LEU 17 -4.953 3.716 -3.647
170 HD23 LEU 17 HD23 LEU 17 -3.681 4.325 -2.591
171 H ALA 18 H ALA 18 -7.464 1.732 -2.126
172 HA ALA 18 HA ALA 18 -9.940 3.127 -2.291
173 HB1 ALA 18 HB1 ALA 18 -8.757 2.408 -4.304
174 HB2 ALA 18 HB2 ALA 18 -10.381 1.720 -4.243
175 HB3 ALA 18 HB3 ALA 18 -8.982 0.722 -3.839
176 H LEU 19 H LEU 19 -8.889 0.222 -0.774
177 HA LEU 19 HA LEU 19 -11.450 -1.067 -0.754
178 HB2 LEU 19 HB2 LEU 19 -8.860 -1.608 0.677
179 HB3 LEU 19 HB3 LEU 19 -10.308 -2.535 1.012
180 HG LEU 19 HG LEU 19 -8.989 -3.804 -0.504
181 HD11 LEU 19 HD11 LEU 19 -10.459 -4.007 -2.445
182 HD12 LEU 19 HD12 LEU 19 -11.219 -2.470 -2.027
183 HD13 LEU 19 HD13 LEU 19 -11.372 -3.857 -0.947
184 HD21 LEU 19 HD21 LEU 19 -8.902 -1.382 -2.299
185 HD22 LEU 19 HD22 LEU 19 -8.236 -2.972 -2.669
186 HD23 LEU 19 HD23 LEU 19 -7.557 -2.016 -1.350
187 H LYS 20 H LYS 20 -10.204 1.531 0.924
188 HA LYS 20 HA LYS 20 -11.970 1.039 3.212
189 HB2 LYS 20 HB2 LYS 20 -9.697 2.989 2.837
190 HB3 LYS 20 HB3 LYS 20 -10.793 3.053 4.212
191 HG2 LYS 20 HG2 LYS 20 -8.964 0.773 3.477
192 HG3 LYS 20 HG3 LYS 20 -8.764 1.900 4.823
193 HD2 LYS 20 HD2 LYS 20 -10.865 1.076 5.802
194 HD3 LYS 20 HD3 LYS 20 -11.035 -0.058 4.462
195 HE2 LYS 20 HE2 LYS 20 -8.883 -1.096 5.121
196 HE3 LYS 20 HE3 LYS 20 -8.823 -0.014 6.513
197 HZ1 LYS 20 HZ1 LYS 20 -10.893 -0.982 7.307
198 HZ2 LYS 20 HZ2 LYS 20 -9.707 -2.180 7.113
199 HZ3 LYS 20 HZ3 LYS 20 -10.947 -2.018 5.965
200 H LEU 21 H LEU 21 -11.307 3.286 0.586
201 HA LEU 21 HA LEU 21 -13.455 5.040 1.415
202 HB2 LEU 21 HB2 LEU 21 -11.462 5.095 -0.820
203 HB3 LEU 21 HB3 LEU 21 -12.873 6.131 -0.874
204 HG LEU 21 HG LEU 21 -12.167 7.096 1.330
205 HD11 LEU 21 HD11 LEU 21 -10.756 5.265 2.099
206 HD12 LEU 21 HD12 LEU 21 -9.872 6.789 2.064
207 HD13 LEU 21 HD13 LEU 21 -9.614 5.589 0.797
208 HD21 LEU 21 HD21 LEU 21 -11.730 8.245 -0.773
209 HD22 LEU 21 HD22 LEU 21 -10.210 7.369 -0.949
210 HD23 LEU 21 HD23 LEU 21 -10.420 8.511 0.379
211 H LYS 22 H LYS 22 -12.872 2.596 -1.048
212 HA LYS 22 HA LYS 22 -15.609 2.996 -2.057
213 HB2 LYS 22 HB2 LYS 22 -13.516 1.236 -3.333
214 HB3 LYS 22 HB3 LYS 22 -14.952 1.930 -4.072
215 HG2 LYS 22 HG2 LYS 22 -12.495 3.439 -3.206
216 HG3 LYS 22 HG3 LYS 22 -12.941 3.031 -4.863
217 HD2 LYS 22 HD2 LYS 22 -14.893 4.441 -4.732
218 HD3 LYS 22 HD3 LYS 22 -14.595 4.756 -3.021
219 HE2 LYS 22 HE2 LYS 22 -12.451 5.824 -3.622
220 HE3 LYS 22 HE3 LYS 22 -12.820 5.559 -5.324
221 HZ1 LYS 22 HZ1 LYS 22 -14.709 6.994 -5.150
222 HZ2 LYS 22 HZ2 LYS 22 -13.350 7.816 -4.558
223 HZ3 LYS 22 HZ3 LYS 22 -14.489 7.171 -3.475
224 H LYS 23 H LYS 23 -14.302 1.462 0.324
225 HA LYS 23 HA LYS 23 -14.755 -0.341 1.598
226 HB2 LYS 23 HB2 LYS 23 -16.998 -0.850 -0.364
227 HB3 LYS 23 HB3 LYS 23 -16.792 -1.658 1.182
228 HG2 LYS 23 HG2 LYS 23 -16.995 0.561 2.292
229 HG3 LYS 23 HG3 LYS 23 -17.399 1.250 0.715
230 HD2 LYS 23 HD2 LYS 23 -19.284 -0.359 0.555
231 HD3 LYS 23 HD3 LYS 23 -18.912 -0.904 2.191
232 HE2 LYS 23 HE2 LYS 23 -20.712 0.687 2.273
233 HE3 LYS 23 HE3 LYS 23 -19.275 1.402 3.002
234 HZ1 LYS 23 HZ1 LYS 23 -20.551 2.877 1.462
235 HZ2 LYS 23 HZ2 LYS 23 -20.075 1.870 0.185
236 HZ3 LYS 23 HZ3 LYS 23 -18.905 2.709 1.082
237 H ALA 24 H ALA 24 -15.061 -2.850 1.438
238 HA ALA 24 HA ALA 24 -12.926 -3.739 -0.314
239 HB1 ALA 24 HB1 ALA 24 -14.430 -5.223 1.842
240 HB2 ALA 24 HB2 ALA 24 -12.887 -4.392 2.041
241 HB3 ALA 24 HB3 ALA 24 -12.998 -5.805 0.992
Start of MODEL 3
1 H1 LYS 1 H1 LYS 1 10.815 -1.976 11.930
2 H2 LYS 1 H2 LYS 1 11.150 -1.153 13.373
3 H3 LYS 1 H3 LYS 1 12.275 -1.132 12.101
4 HA LYS 1 HA LYS 1 9.556 0.012 12.004
5 HB2 LYS 1 HB2 LYS 1 10.732 2.220 11.922
6 HB3 LYS 1 HB3 LYS 1 10.828 1.397 13.468
7 HG2 LYS 1 HG2 LYS 1 13.050 1.165 11.476
8 HG3 LYS 1 HG3 LYS 1 12.916 2.578 12.522
9 HD2 LYS 1 HD2 LYS 1 12.955 1.099 14.492
10 HD3 LYS 1 HD3 LYS 1 13.123 -0.298 13.430
11 HE2 LYS 1 HE2 LYS 1 15.244 0.588 12.605
12 HE3 LYS 1 HE3 LYS 1 15.071 1.993 13.654
13 HZ1 LYS 1 HZ1 LYS 1 16.533 0.347 14.630
14 HZ2 LYS 1 HZ2 LYS 1 15.312 -0.828 14.552
15 HZ3 LYS 1 HZ3 LYS 1 15.131 0.520 15.569
16 H LYS 2 H LYS 2 12.745 -0.217 10.364
17 HA LYS 2 HA LYS 2 11.601 1.069 8.025
18 HB2 LYS 2 HB2 LYS 2 14.398 0.153 8.651
19 HB3 LYS 2 HB3 LYS 2 13.933 0.885 7.120
20 HG2 LYS 2 HG2 LYS 2 13.107 2.858 8.468
21 HG3 LYS 2 HG3 LYS 2 13.938 2.137 9.849
22 HD2 LYS 2 HD2 LYS 2 15.358 3.789 8.783
23 HD3 LYS 2 HD3 LYS 2 16.044 2.177 8.577
24 HE2 LYS 2 HE2 LYS 2 16.192 3.467 6.509
25 HE3 LYS 2 HE3 LYS 2 15.132 2.072 6.311
26 HZ1 LYS 2 HZ1 LYS 2 14.278 4.182 5.333
27 HZ2 LYS 2 HZ2 LYS 2 14.145 4.809 6.901
28 HZ3 LYS 2 HZ3 LYS 2 13.222 3.462 6.447
29 H LEU 3 H LEU 3 10.360 -1.312 8.411
30 HA LEU 3 HA LEU 3 11.294 -2.747 6.020
31 HB2 LEU 3 HB2 LEU 3 9.892 -3.778 8.467
32 HB3 LEU 3 HB3 LEU 3 9.710 -4.605 6.932
33 HG LEU 3 HG LEU 3 12.224 -4.826 6.860
34 HD11 LEU 3 HD11 LEU 3 13.437 -4.612 8.961
35 HD12 LEU 3 HD12 LEU 3 11.998 -3.944 9.731
36 HD13 LEU 3 HD13 LEU 3 12.793 -3.059 8.428
37 HD21 LEU 3 HD21 LEU 3 10.799 -6.687 7.480
38 HD22 LEU 3 HD22 LEU 3 10.752 -6.124 9.150
39 HD23 LEU 3 HD23 LEU 3 12.270 -6.693 8.454
40 H LYS 4 H LYS 4 8.148 -2.966 7.610
41 HA LYS 4 HA LYS 4 7.013 -1.420 5.381
42 HB2 LYS 4 HB2 LYS 4 5.000 -2.876 5.494
43 HB3 LYS 4 HB3 LYS 4 6.449 -3.716 4.969
44 HG2 LYS 4 HG2 LYS 4 6.703 -4.735 7.132
45 HG3 LYS 4 HG3 LYS 4 5.354 -3.792 7.768
46 HD2 LYS 4 HD2 LYS 4 3.808 -4.914 6.316
47 HD3 LYS 4 HD3 LYS 4 5.122 -5.746 5.486
48 HE2 LYS 4 HE2 LYS 4 4.453 -6.083 8.405
49 HE3 LYS 4 HE3 LYS 4 3.908 -7.166 7.126
50 HZ1 LYS 4 HZ1 LYS 4 6.263 -7.579 6.586
51 HZ2 LYS 4 HZ2 LYS 4 5.844 -8.085 8.150
52 HZ3 LYS 4 HZ3 LYS 4 6.719 -6.649 7.930
53 H LEU 5 H LEU 5 7.442 -1.591 8.674
54 HA LEU 5 HA LEU 5 4.906 -0.645 9.562
55 HB2 LEU 5 HB2 LEU 5 6.560 -1.824 11.010
56 HB3 LEU 5 HB3 LEU 5 7.591 -0.409 10.924
57 HG LEU 5 HG LEU 5 5.856 0.923 12.049
58 HD11 LEU 5 HD11 LEU 5 3.922 -0.165 13.050
59 HD12 LEU 5 HD12 LEU 5 4.373 -1.690 12.287
60 HD13 LEU 5 HD13 LEU 5 3.892 -0.315 11.293
61 HD21 LEU 5 HD21 LEU 5 6.602 -1.605 13.514
62 HD22 LEU 5 HD22 LEU 5 6.066 -0.098 14.258
63 HD23 LEU 5 HD23 LEU 5 7.593 -0.150 13.377
64 H ALA 6 H ALA 6 8.058 0.953 9.083
65 HA ALA 6 HA ALA 6 6.814 3.571 9.208
66 HB1 ALA 6 HB1 ALA 6 9.663 2.802 8.572
67 HB2 ALA 6 HB2 ALA 6 9.043 3.249 10.162
68 HB3 ALA 6 HB3 ALA 6 9.073 4.438 8.859
69 H LEU 7 H LEU 7 6.003 1.691 7.145
70 HA LEU 7 HA LEU 7 6.672 3.312 4.786
71 HB2 LEU 7 HB2 LEU 7 7.879 1.155 4.716
72 HB3 LEU 7 HB3 LEU 7 6.350 0.309 4.839
73 HG LEU 7 HG LEU 7 5.667 1.266 2.659
74 HD11 LEU 7 HD11 LEU 7 6.990 3.299 2.687
75 HD12 LEU 7 HD12 LEU 7 7.373 2.344 1.255
76 HD13 LEU 7 HD13 LEU 7 8.478 2.357 2.629
77 HD21 LEU 7 HD21 LEU 7 6.685 -0.944 2.760
78 HD22 LEU 7 HD22 LEU 7 8.291 -0.223 2.656
79 HD23 LEU 7 HD23 LEU 7 7.180 -0.101 1.291
80 H ALA 8 H ALA 8 4.452 0.776 5.951
81 HA ALA 8 HA ALA 8 2.288 2.036 4.439
82 HB1 ALA 8 HB1 ALA 8 1.034 -0.004 4.885
83 HB2 ALA 8 HB2 ALA 8 2.357 -0.609 5.880
84 HB3 ALA 8 HB3 ALA 8 2.594 -0.373 4.148
85 H LYS 9 H LYS 9 3.378 3.250 6.835
86 HA LYS 9 HA LYS 9 1.654 2.768 9.050
87 HB2 LYS 9 HB2 LYS 9 3.959 3.668 9.270
88 HB3 LYS 9 HB3 LYS 9 3.437 5.143 8.472
89 HG2 LYS 9 HG2 LYS 9 1.858 5.557 10.312
90 HG3 LYS 9 HG3 LYS 9 2.464 4.114 11.130
91 HD2 LYS 9 HD2 LYS 9 4.140 6.492 10.340
92 HD3 LYS 9 HD3 LYS 9 3.496 6.206 11.957
93 HE2 LYS 9 HE2 LYS 9 4.810 4.222 12.202
94 HE3 LYS 9 HE3 LYS 9 5.315 4.284 10.515
95 HZ1 LYS 9 HZ1 LYS 9 5.983 6.361 12.524
96 HZ2 LYS 9 HZ2 LYS 9 6.571 6.251 10.940
97 HZ3 LYS 9 HZ3 LYS 9 7.018 5.091 12.092
98 H LEU 10 H LEU 10 -0.414 2.965 8.314
99 HA LEU 10 HA LEU 10 -2.416 3.988 8.011
100 HB2 LEU 10 HB2 LEU 10 -0.786 6.423 8.682
101 HB3 LEU 10 HB3 LEU 10 -2.459 6.566 8.184
102 HG LEU 10 HG LEU 10 -3.079 5.067 10.107
103 HD11 LEU 10 HD11 LEU 10 -1.489 4.807 11.929
104 HD12 LEU 10 HD12 LEU 10 -0.232 5.572 10.954
105 HD13 LEU 10 HD13 LEU 10 -0.906 4.018 10.462
106 HD21 LEU 10 HD21 LEU 10 -2.845 6.846 11.787
107 HD22 LEU 10 HD22 LEU 10 -3.383 7.464 10.226
108 HD23 LEU 10 HD23 LEU 10 -1.706 7.677 10.728
109 H ALA 11 H ALA 11 0.051 4.067 5.964
110 HA ALA 11 HA ALA 11 -1.625 5.135 3.805
111 HB1 ALA 11 HB1 ALA 11 0.345 6.127 2.731
112 HB2 ALA 11 HB2 ALA 11 1.336 5.646 4.108
113 HB3 ALA 11 HB3 ALA 11 0.053 6.838 4.319
114 HA PRO 12 HA PRO 12 -0.049 0.832 2.948
115 HB2 PRO 12 HB2 PRO 12 -2.815 0.230 2.268
116 HB3 PRO 12 HB3 PRO 12 -1.784 -0.516 3.490
117 HG2 PRO 12 HG2 PRO 12 -3.907 1.034 4.136
118 HG3 PRO 12 HG3 PRO 12 -2.444 0.949 5.135
119 HD2 PRO 12 HD2 PRO 12 -3.252 3.038 3.139
120 HD3 PRO 12 HD3 PRO 12 -2.559 3.244 4.764
121 H LEU 13 H LEU 13 -1.720 3.251 1.250
122 HA LEU 13 HA LEU 13 -1.774 3.893 -0.916
123 HB2 LEU 13 HB2 LEU 13 0.247 1.689 -1.311
124 HB3 LEU 13 HB3 LEU 13 -0.184 2.886 -2.517
125 HG LEU 13 HG LEU 13 1.101 3.493 0.147
126 HD11 LEU 13 HD11 LEU 13 2.626 2.351 -1.365
127 HD12 LEU 13 HD12 LEU 13 3.067 4.051 -1.205
128 HD13 LEU 13 HD13 LEU 13 2.227 3.490 -2.650
129 HD21 LEU 13 HD21 LEU 13 1.365 5.750 -0.764
130 HD22 LEU 13 HD22 LEU 13 -0.336 5.307 -0.632
131 HD23 LEU 13 HD23 LEU 13 0.464 5.276 -2.204
132 H TRP 14 H TRP 14 -1.474 0.350 -1.039
133 HA TRP 14 HA TRP 14 -3.812 0.310 -2.834
134 HB2 TRP 14 HB2 TRP 14 -1.571 -0.573 -3.658
135 HB3 TRP 14 HB3 TRP 14 -1.742 -1.869 -2.480
136 HD1 TRP 14 HD1 TRP 14 -4.167 -3.361 -2.848
137 HE1 TRP 14 HE1 TRP 14 -5.134 -4.206 -5.081
138 HE3 TRP 14 HE3 TRP 14 -1.722 -0.194 -6.030
139 HZ2 TRP 14 HZ2 TRP 14 -4.873 -3.613 -7.831
140 HZ3 TRP 14 HZ3 TRP 14 -2.132 -0.404 -8.448
141 HH2 TRP 14 HH2 TRP 14 -3.677 -2.081 -9.328
142 H LYS 15 H LYS 15 -2.305 -1.231 -0.036
143 HA LYS 15 HA LYS 15 -3.994 -3.440 0.168
144 HB2 LYS 15 HB2 LYS 15 -1.841 -3.329 1.274
145 HB3 LYS 15 HB3 LYS 15 -2.409 -2.026 2.309
146 HG2 LYS 15 HG2 LYS 15 -3.994 -3.522 3.366
147 HG3 LYS 15 HG3 LYS 15 -3.500 -4.832 2.291
148 HD2 LYS 15 HD2 LYS 15 -1.262 -4.795 3.225
149 HD3 LYS 15 HD3 LYS 15 -1.681 -3.412 4.238
150 HE2 LYS 15 HE2 LYS 15 -2.952 -6.143 4.388
151 HE3 LYS 15 HE3 LYS 15 -1.720 -5.527 5.488
152 HZ1 LYS 15 HZ1 LYS 15 -4.471 -4.469 5.125
153 HZ2 LYS 15 HZ2 LYS 15 -3.280 -3.715 6.060
154 HZ3 LYS 15 HZ3 LYS 15 -3.849 -5.250 6.495
155 H ALA 16 H ALA 16 -4.318 -0.248 1.713
156 HA ALA 16 HA ALA 16 -7.080 -0.942 2.341
157 HB1 ALA 16 HB1 ALA 16 -6.891 -0.218 4.661
158 HB2 ALA 16 HB2 ALA 16 -5.163 0.059 4.446
159 HB3 ALA 16 HB3 ALA 16 -5.815 -1.576 4.338
160 H LEU 17 H LEU 17 -6.068 0.787 0.391
161 HA LEU 17 HA LEU 17 -7.092 3.335 1.444
162 HB2 LEU 17 HB2 LEU 17 -4.774 3.511 0.624
163 HB3 LEU 17 HB3 LEU 17 -5.286 2.908 -0.940
164 HG LEU 17 HG LEU 17 -6.706 4.906 -1.234
165 HD11 LEU 17 HD11 LEU 17 -5.450 5.806 1.355
166 HD12 LEU 17 HD12 LEU 17 -7.145 5.386 1.113
167 HD13 LEU 17 HD13 LEU 17 -6.461 6.793 0.297
168 HD21 LEU 17 HD21 LEU 17 -3.813 5.462 -0.598
169 HD22 LEU 17 HD22 LEU 17 -4.872 6.513 -1.539
170 HD23 LEU 17 HD23 LEU 17 -4.463 4.907 -2.140
171 H ALA 18 H ALA 18 -6.733 1.892 -1.787
172 HA ALA 18 HA ALA 18 -9.236 2.864 -2.680
173 HB1 ALA 18 HB1 ALA 18 -8.837 1.499 -4.669
174 HB2 ALA 18 HB2 ALA 18 -7.503 0.691 -3.848
175 HB3 ALA 18 HB3 ALA 18 -7.396 2.412 -4.220
176 H LEU 19 H LEU 19 -8.257 -0.001 -1.000
177 HA LEU 19 HA LEU 19 -10.566 -1.540 -1.769
178 HB2 LEU 19 HB2 LEU 19 -8.471 -2.056 0.342
179 HB3 LEU 19 HB3 LEU 19 -9.703 -3.200 -0.151
180 HG LEU 19 HG LEU 19 -7.444 -2.158 -1.858
181 HD11 LEU 19 HD11 LEU 19 -6.703 -4.490 -1.827
182 HD12 LEU 19 HD12 LEU 19 -8.025 -4.891 -0.732
183 HD13 LEU 19 HD13 LEU 19 -6.748 -3.795 -0.207
184 HD21 LEU 19 HD21 LEU 19 -9.461 -2.472 -3.190
185 HD22 LEU 19 HD22 LEU 19 -9.639 -4.103 -2.546
186 HD23 LEU 19 HD23 LEU 19 -8.254 -3.704 -3.562
187 H LYS 20 H LYS 20 -10.012 0.900 0.481
188 HA LYS 20 HA LYS 20 -12.280 -0.030 2.119
189 HB2 LYS 20 HB2 LYS 20 -10.026 1.814 2.928
190 HB3 LYS 20 HB3 LYS 20 -11.379 1.350 3.951
191 HG2 LYS 20 HG2 LYS 20 -9.302 -0.527 2.833
192 HG3 LYS 20 HG3 LYS 20 -9.355 0.086 4.486
193 HD2 LYS 20 HD2 LYS 20 -11.501 -1.015 4.837
194 HD3 LYS 20 HD3 LYS 20 -11.494 -1.591 3.170
195 HE2 LYS 20 HE2 LYS 20 -9.521 -2.924 3.601
196 HE3 LYS 20 HE3 LYS 20 -9.418 -2.291 5.244
197 HZ1 LYS 20 HZ1 LYS 20 -11.580 -4.004 4.135
198 HZ2 LYS 20 HZ2 LYS 20 -11.613 -3.299 5.676
199 HZ3 LYS 20 HZ3 LYS 20 -10.424 -4.445 5.295
200 H LEU 21 H LEU 21 -10.923 2.534 0.236
201 HA LEU 21 HA LEU 21 -12.541 4.677 0.923
202 HB2 LEU 21 HB2 LEU 21 -10.605 4.839 -0.563
203 HB3 LEU 21 HB3 LEU 21 -11.455 3.926 -1.793
204 HG LEU 21 HG LEU 21 -13.128 5.782 -1.930
205 HD11 LEU 21 HD11 LEU 21 -11.149 7.215 -0.166
206 HD12 LEU 21 HD12 LEU 21 -12.791 6.747 0.278
207 HD13 LEU 21 HD13 LEU 21 -12.529 7.952 -0.983
208 HD21 LEU 21 HD21 LEU 21 -10.246 6.485 -2.466
209 HD22 LEU 21 HD22 LEU 21 -11.644 7.299 -3.168
210 HD23 LEU 21 HD23 LEU 21 -11.329 5.605 -3.545
211 H LYS 22 H LYS 22 -13.187 1.983 -1.257
212 HA LYS 22 HA LYS 22 -15.811 3.109 -1.883
213 HB2 LYS 22 HB2 LYS 22 -14.209 2.270 -3.673
214 HB3 LYS 22 HB3 LYS 22 -14.557 0.647 -3.092
215 HG2 LYS 22 HG2 LYS 22 -16.836 0.816 -3.720
216 HG3 LYS 22 HG3 LYS 22 -16.691 2.549 -4.018
217 HD2 LYS 22 HD2 LYS 22 -15.105 2.055 -5.855
218 HD3 LYS 22 HD3 LYS 22 -15.387 0.331 -5.591
219 HE2 LYS 22 HE2 LYS 22 -16.725 1.290 -7.448
220 HE3 LYS 22 HE3 LYS 22 -17.703 0.565 -6.175
221 HZ1 LYS 22 HZ1 LYS 22 -18.414 2.820 -7.084
222 HZ2 LYS 22 HZ2 LYS 22 -17.121 3.466 -6.196
223 HZ3 LYS 22 HZ3 LYS 22 -18.371 2.641 -5.401
224 H LYS 23 H LYS 23 -15.171 1.960 0.734
225 HA LYS 23 HA LYS 23 -17.409 0.069 0.760
226 HB2 LYS 23 HB2 LYS 23 -14.834 -0.171 2.302
227 HB3 LYS 23 HB3 LYS 23 -16.292 -1.041 2.750
228 HG2 LYS 23 HG2 LYS 23 -16.292 -2.065 0.476
229 HG3 LYS 23 HG3 LYS 23 -14.718 -1.314 0.204
230 HD2 LYS 23 HD2 LYS 23 -13.798 -2.528 2.107
231 HD3 LYS 23 HD3 LYS 23 -15.378 -3.248 2.424
232 HE2 LYS 23 HE2 LYS 23 -13.936 -4.810 1.237
233 HE3 LYS 23 HE3 LYS 23 -15.318 -4.351 0.246
234 HZ1 LYS 23 HZ1 LYS 23 -13.177 -4.382 -0.966
235 HZ2 LYS 23 HZ2 LYS 23 -12.634 -3.110 0.015
236 HZ3 LYS 23 HZ3 LYS 23 -13.958 -2.878 -1.017
237 H ALA 24 H ALA 24 -15.410 2.176 2.823
238 HA ALA 24 HA ALA 24 -17.880 2.891 4.259
239 HB1 ALA 24 HB1 ALA 24 -16.581 3.138 6.295
240 HB2 ALA 24 HB2 ALA 24 -15.109 2.693 5.431
241 HB3 ALA 24 HB3 ALA 24 -16.397 1.509 5.645
Start of MODEL 4
1 H1 LYS 1 H1 LYS 1 3.205 3.138 10.332
2 H2 LYS 1 H2 LYS 1 2.490 1.609 10.484
3 H3 LYS 1 H3 LYS 1 1.540 2.948 10.059
4 HA LYS 1 HA LYS 1 2.033 1.482 8.181
5 HB2 LYS 1 HB2 LYS 1 2.846 3.303 6.664
6 HB3 LYS 1 HB3 LYS 1 1.494 3.761 7.687
7 HG2 LYS 1 HG2 LYS 1 2.961 5.000 9.145
8 HG3 LYS 1 HG3 LYS 1 4.372 4.445 8.241
9 HD2 LYS 1 HD2 LYS 1 3.512 5.584 6.237
10 HD3 LYS 1 HD3 LYS 1 2.135 6.165 7.172
11 HE2 LYS 1 HE2 LYS 1 5.012 6.772 7.830
12 HE3 LYS 1 HE3 LYS 1 3.971 7.835 6.888
13 HZ1 LYS 1 HZ1 LYS 1 3.644 7.053 9.733
14 HZ2 LYS 1 HZ2 LYS 1 2.447 7.859 8.843
15 HZ3 LYS 1 HZ3 LYS 1 3.948 8.603 9.109
16 H LYS 2 H LYS 2 3.747 0.170 9.586
17 HA LYS 2 HA LYS 2 6.403 0.577 8.421
18 HB2 LYS 2 HB2 LYS 2 5.451 -1.370 10.530
19 HB3 LYS 2 HB3 LYS 2 7.100 -1.277 9.929
20 HG2 LYS 2 HG2 LYS 2 7.284 1.008 10.789
21 HG3 LYS 2 HG3 LYS 2 5.627 0.902 11.396
22 HD2 LYS 2 HD2 LYS 2 6.282 -0.984 12.822
23 HD3 LYS 2 HD3 LYS 2 7.937 -0.855 12.225
24 HE2 LYS 2 HE2 LYS 2 7.696 0.210 14.408
25 HE3 LYS 2 HE3 LYS 2 8.105 1.391 13.164
26 HZ1 LYS 2 HZ1 LYS 2 6.350 2.159 14.684
27 HZ2 LYS 2 HZ2 LYS 2 5.356 0.883 14.168
28 HZ3 LYS 2 HZ3 LYS 2 5.828 2.088 13.075
29 H LEU 3 H LEU 3 4.565 -2.372 9.148
30 HA LEU 3 HA LEU 3 5.658 -3.567 6.730
31 HB2 LEU 3 HB2 LEU 3 4.046 -4.778 8.979
32 HB3 LEU 3 HB3 LEU 3 4.780 -5.672 7.660
33 HG LEU 3 HG LEU 3 6.312 -4.060 9.697
34 HD11 LEU 3 HD11 LEU 3 5.935 -7.038 9.489
35 HD12 LEU 3 HD12 LEU 3 5.226 -5.989 10.716
36 HD13 LEU 3 HD13 LEU 3 6.976 -6.199 10.640
37 HD21 LEU 3 HD21 LEU 3 8.259 -5.230 8.770
38 HD22 LEU 3 HD22 LEU 3 7.459 -4.221 7.567
39 HD23 LEU 3 HD23 LEU 3 7.223 -5.968 7.548
40 H LYS 4 H LYS 4 2.837 -1.971 7.632
41 HA LYS 4 HA LYS 4 1.159 -3.414 5.735
42 HB2 LYS 4 HB2 LYS 4 0.385 -2.408 8.014
43 HB3 LYS 4 HB3 LYS 4 0.342 -0.882 7.136
44 HG2 LYS 4 HG2 LYS 4 -1.851 -1.829 7.115
45 HG3 LYS 4 HG3 LYS 4 -1.181 -1.954 5.487
46 HD2 LYS 4 HD2 LYS 4 -0.528 -4.288 5.970
47 HD3 LYS 4 HD3 LYS 4 -1.299 -4.151 7.549
48 HE2 LYS 4 HE2 LYS 4 -3.437 -3.614 6.358
49 HE3 LYS 4 HE3 LYS 4 -2.618 -3.999 4.844
50 HZ1 LYS 4 HZ1 LYS 4 -3.805 -5.921 5.603
51 HZ2 LYS 4 HZ2 LYS 4 -3.074 -5.832 7.129
52 HZ3 LYS 4 HZ3 LYS 4 -2.144 -6.225 5.767
53 H LEU 5 H LEU 5 3.149 -0.624 5.942
54 HA LEU 5 HA LEU 5 2.087 0.572 3.517
55 HB2 LEU 5 HB2 LEU 5 2.885 1.995 5.371
56 HB3 LEU 5 HB3 LEU 5 4.488 1.312 5.199
57 HG LEU 5 HG LEU 5 4.573 2.262 2.885
58 HD11 LEU 5 HD11 LEU 5 2.200 2.463 2.459
59 HD12 LEU 5 HD12 LEU 5 2.971 4.043 2.332
60 HD13 LEU 5 HD13 LEU 5 2.038 3.630 3.770
61 HD21 LEU 5 HD21 LEU 5 5.644 3.383 4.765
62 HD22 LEU 5 HD22 LEU 5 4.142 4.233 5.124
63 HD23 LEU 5 HD23 LEU 5 4.991 4.551 3.613
64 H ALA 6 H ALA 6 4.781 -1.330 4.647
65 HA ALA 6 HA ALA 6 6.222 -1.180 2.155
66 HB1 ALA 6 HB1 ALA 6 7.449 -1.339 4.243
67 HB2 ALA 6 HB2 ALA 6 7.792 -2.735 3.220
68 HB3 ALA 6 HB3 ALA 6 6.691 -2.894 4.589
69 H LEU 7 H LEU 7 3.439 -2.420 2.350
70 HA LEU 7 HA LEU 7 3.720 -5.176 1.710
71 HB2 LEU 7 HB2 LEU 7 1.545 -3.174 1.106
72 HB3 LEU 7 HB3 LEU 7 1.428 -4.868 0.678
73 HG LEU 7 HG LEU 7 1.673 -3.789 3.490
74 HD11 LEU 7 HD11 LEU 7 -0.678 -4.999 2.034
75 HD12 LEU 7 HD12 LEU 7 -0.494 -3.302 2.473
76 HD13 LEU 7 HD13 LEU 7 -0.643 -4.525 3.734
77 HD21 LEU 7 HD21 LEU 7 2.712 -5.991 3.224
78 HD22 LEU 7 HD22 LEU 7 1.229 -6.604 2.490
79 HD23 LEU 7 HD23 LEU 7 1.234 -6.090 4.180
80 H ALA 8 H ALA 8 3.301 -2.272 -0.248
81 HA ALA 8 HA ALA 8 4.845 -3.476 -2.382
82 HB1 ALA 8 HB1 ALA 8 2.521 -4.142 -2.865
83 HB2 ALA 8 HB2 ALA 8 3.195 -3.082 -4.102
84 HB3 ALA 8 HB3 ALA 8 2.063 -2.438 -2.911
85 H LYS 9 H LYS 9 3.638 -0.755 -0.693
86 HA LYS 9 HA LYS 9 4.281 1.417 -0.593
87 HB2 LYS 9 HB2 LYS 9 6.313 0.652 -2.695
88 HB3 LYS 9 HB3 LYS 9 6.274 2.183 -1.836
89 HG2 LYS 9 HG2 LYS 9 6.726 1.051 0.260
90 HG3 LYS 9 HG3 LYS 9 6.681 -0.515 -0.558
91 HD2 LYS 9 HD2 LYS 9 8.568 0.208 -1.976
92 HD3 LYS 9 HD3 LYS 9 8.637 1.724 -1.075
93 HE2 LYS 9 HE2 LYS 9 9.141 0.504 0.965
94 HE3 LYS 9 HE3 LYS 9 9.013 -1.027 0.099
95 HZ1 LYS 9 HZ1 LYS 9 11.014 1.110 -0.414
96 HZ2 LYS 9 HZ2 LYS 9 10.874 -0.328 -1.301
97 HZ3 LYS 9 HZ3 LYS 9 11.316 -0.382 0.336
98 H LEU 10 H LEU 10 4.561 0.466 -4.013
99 HA LEU 10 HA LEU 10 3.397 2.990 -4.827
100 HB2 LEU 10 HB2 LEU 10 3.868 2.049 -7.147
101 HB3 LEU 10 HB3 LEU 10 5.247 2.381 -6.119
102 HG LEU 10 HG LEU 10 5.194 -0.109 -5.522
103 HD11 LEU 10 HD11 LEU 10 4.194 -1.599 -7.150
104 HD12 LEU 10 HD12 LEU 10 3.537 -0.227 -8.037
105 HD13 LEU 10 HD13 LEU 10 2.956 -0.584 -6.411
106 HD21 LEU 10 HD21 LEU 10 6.903 0.914 -6.921
107 HD22 LEU 10 HD22 LEU 10 5.867 0.725 -8.337
108 HD23 LEU 10 HD23 LEU 10 6.483 -0.699 -7.499
109 H ALA 11 H ALA 11 1.943 0.409 -3.677
110 HA ALA 11 HA ALA 11 -0.194 0.445 -5.704
111 HB1 ALA 11 HB1 ALA 11 0.566 -1.882 -3.946
112 HB2 ALA 11 HB2 ALA 11 1.002 -1.703 -5.644
113 HB3 ALA 11 HB3 ALA 11 -0.693 -1.863 -5.184
114 HA PRO 12 HA PRO 12 -2.046 1.992 -1.780
115 HB2 PRO 12 HB2 PRO 12 -3.531 3.812 -3.492
116 HB3 PRO 12 HB3 PRO 12 -2.375 4.189 -2.214
117 HG2 PRO 12 HG2 PRO 12 -1.868 4.633 -4.848
118 HG3 PRO 12 HG3 PRO 12 -0.601 4.264 -3.665
119 HD2 PRO 12 HD2 PRO 12 -1.919 2.451 -5.653
120 HD3 PRO 12 HD3 PRO 12 -0.205 2.566 -5.196
121 H LEU 13 H LEU 13 -3.298 0.773 -4.739
122 HA LEU 13 HA LEU 13 -6.037 0.936 -4.358
123 HB2 LEU 13 HB2 LEU 13 -6.177 -1.089 -5.837
124 HB3 LEU 13 HB3 LEU 13 -5.286 0.268 -6.485
125 HG LEU 13 HG LEU 13 -3.797 -1.955 -5.136
126 HD11 LEU 13 HD11 LEU 13 -5.279 -3.063 -6.726
127 HD12 LEU 13 HD12 LEU 13 -3.611 -3.090 -7.297
128 HD13 LEU 13 HD13 LEU 13 -4.763 -1.950 -7.993
129 HD21 LEU 13 HD21 LEU 13 -2.062 -1.288 -6.734
130 HD22 LEU 13 HD22 LEU 13 -2.594 0.082 -5.758
131 HD23 LEU 13 HD23 LEU 13 -3.156 -0.088 -7.421
132 H TRP 14 H TRP 14 -3.810 -1.597 -3.227
133 HA TRP 14 HA TRP 14 -6.031 -2.607 -1.590
134 HB2 TRP 14 HB2 TRP 14 -4.915 -4.805 -1.577
135 HB3 TRP 14 HB3 TRP 14 -5.349 -4.290 -3.200
136 HD1 TRP 14 HD1 TRP 14 -3.287 -3.509 -4.815
137 HE1 TRP 14 HE1 TRP 14 -0.822 -4.268 -4.846
138 HE3 TRP 14 HE3 TRP 14 -3.013 -5.522 -0.128
139 HZ2 TRP 14 HZ2 TRP 14 0.987 -5.550 -3.104
140 HZ3 TRP 14 HZ3 TRP 14 -0.882 -6.499 0.610
141 HH2 TRP 14 HH2 TRP 14 1.077 -6.512 -0.848
142 H LYS 15 H LYS 15 -3.699 -0.587 -1.291
143 HA LYS 15 HA LYS 15 -2.435 -1.587 1.127
144 HB2 LYS 15 HB2 LYS 15 -1.278 -0.129 -0.615
145 HB3 LYS 15 HB3 LYS 15 -2.269 1.200 -0.034
146 HG2 LYS 15 HG2 LYS 15 -1.270 0.978 2.188
147 HG3 LYS 15 HG3 LYS 15 -0.277 -0.360 1.605
148 HD2 LYS 15 HD2 LYS 15 1.034 1.671 1.607
149 HD3 LYS 15 HD3 LYS 15 0.741 1.160 -0.055
150 HE2 LYS 15 HE2 LYS 15 0.405 3.502 -0.007
151 HE3 LYS 15 HE3 LYS 15 -1.195 2.768 -0.091
152 HZ1 LYS 15 HZ1 LYS 15 0.115 4.063 2.215
153 HZ2 LYS 15 HZ2 LYS 15 -1.189 3.008 2.438
154 HZ3 LYS 15 HZ3 LYS 15 -1.384 4.419 1.519
155 H ALA 16 H ALA 16 -5.292 -1.308 0.974
156 HA ALA 16 HA ALA 16 -7.047 -0.714 2.265
157 HB1 ALA 16 HB1 ALA 16 -6.648 -0.061 4.577
158 HB2 ALA 16 HB2 ALA 16 -4.948 0.237 4.212
159 HB3 ALA 16 HB3 ALA 16 -5.599 -1.401 4.110
160 H LEU 17 H LEU 17 -6.038 1.171 0.305
161 HA LEU 17 HA LEU 17 -7.056 3.654 1.501
162 HB2 LEU 17 HB2 LEU 17 -4.861 3.852 0.400
163 HB3 LEU 17 HB3 LEU 17 -5.557 3.241 -1.089
164 HG LEU 17 HG LEU 17 -7.044 5.234 -1.166
165 HD11 LEU 17 HD11 LEU 17 -6.468 7.159 0.262
166 HD12 LEU 17 HD12 LEU 17 -5.381 6.119 1.185
167 HD13 LEU 17 HD13 LEU 17 -7.116 5.796 1.179
168 HD21 LEU 17 HD21 LEU 17 -4.087 5.801 -1.049
169 HD22 LEU 17 HD22 LEU 17 -5.297 6.812 -1.839
170 HD23 LEU 17 HD23 LEU 17 -4.977 5.186 -2.442
171 H ALA 18 H ALA 18 -7.095 2.209 -1.758
172 HA ALA 18 HA ALA 18 -9.691 3.157 -2.334
173 HB1 ALA 18 HB1 ALA 18 -8.100 0.962 -3.655
174 HB2 ALA 18 HB2 ALA 18 -8.113 2.665 -4.111
175 HB3 ALA 18 HB3 ALA 18 -9.567 1.690 -4.311
176 H LEU 19 H LEU 19 -8.437 0.178 -0.996
177 HA LEU 19 HA LEU 19 -10.787 -1.369 -1.268
178 HB2 LEU 19 HB2 LEU 19 -8.557 -2.323 -0.916
179 HB3 LEU 19 HB3 LEU 19 -8.505 -1.625 0.690
180 HG LEU 19 HG LEU 19 -10.433 -3.053 1.336
181 HD11 LEU 19 HD11 LEU 19 -9.999 -4.310 -1.369
182 HD12 LEU 19 HD12 LEU 19 -11.402 -3.357 -0.885
183 HD13 LEU 19 HD13 LEU 19 -11.078 -4.908 -0.109
184 HD21 LEU 19 HD21 LEU 19 -9.169 -5.130 1.478
185 HD22 LEU 19 HD22 LEU 19 -8.133 -3.743 1.810
186 HD23 LEU 19 HD23 LEU 19 -8.053 -4.549 0.242
187 H LYS 20 H LYS 20 -9.879 1.098 0.958
188 HA LYS 20 HA LYS 20 -11.962 0.247 2.850
189 HB2 LYS 20 HB2 LYS 20 -9.526 0.615 3.590
190 HB3 LYS 20 HB3 LYS 20 -9.842 2.328 3.362
191 HG2 LYS 20 HG2 LYS 20 -11.650 2.206 5.012
192 HG3 LYS 20 HG3 LYS 20 -11.296 0.494 5.256
193 HD2 LYS 20 HD2 LYS 20 -8.965 1.160 5.895
194 HD3 LYS 20 HD3 LYS 20 -9.495 2.842 5.832
195 HE2 LYS 20 HE2 LYS 20 -10.628 0.694 7.625
196 HE3 LYS 20 HE3 LYS 20 -9.523 1.975 8.118
197 HZ1 LYS 20 HZ1 LYS 20 -11.777 2.537 8.698
198 HZ2 LYS 20 HZ2 LYS 20 -12.290 2.346 7.095
199 HZ3 LYS 20 HZ3 LYS 20 -11.223 3.604 7.502
200 H LEU 21 H LEU 21 -11.107 2.641 0.550
201 HA LEU 21 HA LEU 21 -12.998 4.599 1.558
202 HB2 LEU 21 HB2 LEU 21 -10.897 5.359 0.576
203 HB3 LEU 21 HB3 LEU 21 -11.299 4.570 -0.936
204 HG LEU 21 HG LEU 21 -13.231 6.124 -1.187
205 HD11 LEU 21 HD11 LEU 21 -13.313 8.120 0.229
206 HD12 LEU 21 HD12 LEU 21 -12.023 7.458 1.232
207 HD13 LEU 21 HD13 LEU 21 -13.588 6.650 1.165
208 HD21 LEU 21 HD21 LEU 21 -11.880 8.085 -1.759
209 HD22 LEU 21 HD22 LEU 21 -11.104 6.588 -2.281
210 HD23 LEU 21 HD23 LEU 21 -10.531 7.422 -0.836
211 H LYS 22 H LYS 22 -12.650 2.447 -1.248
212 HA LYS 22 HA LYS 22 -15.192 3.305 -2.320
213 HB2 LYS 22 HB2 LYS 22 -13.186 1.238 -3.198
214 HB3 LYS 22 HB3 LYS 22 -14.705 1.509 -4.041
215 HG2 LYS 22 HG2 LYS 22 -14.062 3.807 -4.503
216 HG3 LYS 22 HG3 LYS 22 -12.560 3.576 -3.606
217 HD2 LYS 22 HD2 LYS 22 -12.221 3.418 -6.035
218 HD3 LYS 22 HD3 LYS 22 -11.822 1.911 -5.215
219 HE2 LYS 22 HE2 LYS 22 -13.080 1.579 -7.319
220 HE3 LYS 22 HE3 LYS 22 -13.910 0.925 -5.908
221 HZ1 LYS 22 HZ1 LYS 22 -14.517 3.623 -6.971
222 HZ2 LYS 22 HZ2 LYS 22 -15.448 2.664 -5.928
223 HZ3 LYS 22 HZ3 LYS 22 -15.289 2.229 -7.552
224 H LYS 23 H LYS 23 -14.029 0.735 -0.295
225 HA LYS 23 HA LYS 23 -16.645 -0.563 -0.551
226 HB2 LYS 23 HB2 LYS 23 -14.016 -1.735 0.354
227 HB3 LYS 23 HB3 LYS 23 -15.555 -2.576 0.464
228 HG2 LYS 23 HG2 LYS 23 -14.126 -1.702 -2.031
229 HG3 LYS 23 HG3 LYS 23 -14.399 -3.350 -1.471
230 HD2 LYS 23 HD2 LYS 23 -16.466 -1.385 -2.454
231 HD3 LYS 23 HD3 LYS 23 -15.952 -2.875 -3.239
232 HE2 LYS 23 HE2 LYS 23 -17.465 -2.631 -0.638
233 HE3 LYS 23 HE3 LYS 23 -18.100 -3.207 -2.177
234 HZ1 LYS 23 HZ1 LYS 23 -17.629 -5.095 -0.865
235 HZ2 LYS 23 HZ2 LYS 23 -16.091 -4.529 -0.443
236 HZ3 LYS 23 HZ3 LYS 23 -16.402 -5.023 -2.035
237 H ALA 24 H ALA 24 -17.965 -0.644 1.123
238 HA ALA 24 HA ALA 24 -16.969 0.335 3.708
239 HB1 ALA 24 HB1 ALA 24 -19.800 0.178 2.667
240 HB2 ALA 24 HB2 ALA 24 -18.812 1.635 2.782
241 HB3 ALA 24 HB3 ALA 24 -19.319 0.796 4.247
Start of MODEL 5
1 H1 LYS 1 H1 LYS 1 14.160 -0.169 -1.982
2 H2 LYS 1 H2 LYS 1 15.483 0.306 -1.025
3 H3 LYS 1 H3 LYS 1 14.056 1.224 -1.023
4 HA LYS 1 HA LYS 1 14.296 -1.557 -0.051
5 HB2 LYS 1 HB2 LYS 1 15.434 0.231 1.336
6 HB3 LYS 1 HB3 LYS 1 13.854 0.974 1.544
7 HG2 LYS 1 HG2 LYS 1 13.046 -1.061 2.643
8 HG3 LYS 1 HG3 LYS 1 14.643 -1.789 2.447
9 HD2 LYS 1 HD2 LYS 1 15.577 0.144 3.747
10 HD3 LYS 1 HD3 LYS 1 13.917 0.631 4.086
11 HE2 LYS 1 HE2 LYS 1 14.831 -0.654 5.937
12 HE3 LYS 1 HE3 LYS 1 13.505 -1.526 5.166
13 HZ1 LYS 1 HZ1 LYS 1 15.561 -2.858 5.723
14 HZ2 LYS 1 HZ2 LYS 1 16.341 -2.027 4.466
15 HZ3 LYS 1 HZ3 LYS 1 14.991 -2.997 4.131
16 H LYS 2 H LYS 2 12.306 1.405 -0.179
17 HA LYS 2 HA LYS 2 9.894 0.126 0.572
18 HB2 LYS 2 HB2 LYS 2 10.563 2.740 -0.732
19 HB3 LYS 2 HB3 LYS 2 8.889 2.211 -0.641
20 HG2 LYS 2 HG2 LYS 2 10.728 2.567 1.717
21 HG3 LYS 2 HG3 LYS 2 9.502 3.723 1.190
22 HD2 LYS 2 HD2 LYS 2 7.805 1.882 1.469
23 HD3 LYS 2 HD3 LYS 2 9.074 0.932 2.242
24 HE2 LYS 2 HE2 LYS 2 8.072 3.621 3.168
25 HE3 LYS 2 HE3 LYS 2 7.649 2.068 3.880
26 HZ1 LYS 2 HZ1 LYS 2 10.011 1.743 4.404
27 HZ2 LYS 2 HZ2 LYS 2 9.369 3.111 5.166
28 HZ3 LYS 2 HZ3 LYS 2 10.357 3.287 3.802
29 H LEU 3 H LEU 3 11.325 0.859 -2.589
30 HA LEU 3 HA LEU 3 8.962 -0.044 -3.973
31 HB2 LEU 3 HB2 LEU 3 11.626 0.991 -4.883
32 HB3 LEU 3 HB3 LEU 3 10.501 0.273 -6.020
33 HG LEU 3 HG LEU 3 8.804 1.992 -5.235
34 HD11 LEU 3 HD11 LEU 3 9.879 2.645 -3.149
35 HD12 LEU 3 HD12 LEU 3 9.688 4.034 -4.217
36 HD13 LEU 3 HD13 LEU 3 11.264 3.266 -4.044
37 HD21 LEU 3 HD21 LEU 3 9.751 3.748 -6.656
38 HD22 LEU 3 HD22 LEU 3 9.943 2.148 -7.371
39 HD23 LEU 3 HD23 LEU 3 11.317 2.942 -6.601
40 H LYS 4 H LYS 4 9.708 -2.117 -2.473
41 HA LYS 4 HA LYS 4 9.678 -4.173 -4.351
42 HB2 LYS 4 HB2 LYS 4 12.126 -3.611 -4.549
43 HB3 LYS 4 HB3 LYS 4 12.314 -4.102 -2.870
44 HG2 LYS 4 HG2 LYS 4 11.523 -6.348 -3.446
45 HG3 LYS 4 HG3 LYS 4 11.362 -5.853 -5.132
46 HD2 LYS 4 HD2 LYS 4 13.792 -5.338 -5.149
47 HD3 LYS 4 HD3 LYS 4 13.903 -5.992 -3.514
48 HE2 LYS 4 HE2 LYS 4 13.040 -8.151 -4.357
49 HE3 LYS 4 HE3 LYS 4 13.035 -7.484 -5.989
50 HZ1 LYS 4 HZ1 LYS 4 15.013 -8.750 -5.695
51 HZ2 LYS 4 HZ2 LYS 4 15.398 -7.946 -4.252
52 HZ3 LYS 4 HZ3 LYS 4 15.461 -7.112 -5.729
53 H LEU 5 H LEU 5 11.226 -3.833 -1.157
54 HA LEU 5 HA LEU 5 10.018 -6.249 -0.228
55 HB2 LEU 5 HB2 LEU 5 11.540 -4.107 1.265
56 HB3 LEU 5 HB3 LEU 5 11.010 -5.614 1.980
57 HG LEU 5 HG LEU 5 13.289 -5.916 1.502
58 HD11 LEU 5 HD11 LEU 5 11.949 -7.824 0.862
59 HD12 LEU 5 HD12 LEU 5 13.339 -7.660 -0.210
60 HD13 LEU 5 HD13 LEU 5 11.740 -7.158 -0.759
61 HD21 LEU 5 HD21 LEU 5 13.613 -3.999 0.033
62 HD22 LEU 5 HD22 LEU 5 12.784 -4.849 -1.271
63 HD23 LEU 5 HD23 LEU 5 14.323 -5.459 -0.659
64 H ALA 6 H ALA 6 9.247 -2.867 0.013
65 HA ALA 6 HA ALA 6 7.146 -3.379 1.963
66 HB1 ALA 6 HB1 ALA 6 7.973 -0.805 0.630
67 HB2 ALA 6 HB2 ALA 6 8.518 -1.369 2.208
68 HB3 ALA 6 HB3 ALA 6 6.820 -0.963 1.952
69 H LEU 7 H LEU 7 7.306 -4.131 -1.080
70 HA LEU 7 HA LEU 7 4.573 -3.209 -1.698
71 HB2 LEU 7 HB2 LEU 7 6.860 -3.645 -3.621
72 HB3 LEU 7 HB3 LEU 7 5.204 -3.333 -4.104
73 HG LEU 7 HG LEU 7 6.982 -1.431 -2.574
74 HD11 LEU 7 HD11 LEU 7 6.911 -0.098 -4.624
75 HD12 LEU 7 HD12 LEU 7 5.996 -1.380 -5.421
76 HD13 LEU 7 HD13 LEU 7 7.654 -1.675 -4.894
77 HD21 LEU 7 HD21 LEU 7 5.188 0.189 -2.886
78 HD22 LEU 7 HD22 LEU 7 4.629 -1.197 -1.948
79 HD23 LEU 7 HD23 LEU 7 4.191 -1.048 -3.651
80 H ALA 8 H ALA 8 6.956 -5.758 -1.846
81 HA ALA 8 HA ALA 8 5.549 -7.642 -3.345
82 HB1 ALA 8 HB1 ALA 8 7.930 -7.844 -2.824
83 HB2 ALA 8 HB2 ALA 8 7.042 -9.302 -2.375
84 HB3 ALA 8 HB3 ALA 8 7.531 -8.149 -1.131
85 H LYS 9 H LYS 9 5.144 -6.656 -0.035
86 HA LYS 9 HA LYS 9 3.616 -9.027 0.619
87 HB2 LYS 9 HB2 LYS 9 5.117 -7.870 2.284
88 HB3 LYS 9 HB3 LYS 9 3.954 -6.552 2.315
89 HG2 LYS 9 HG2 LYS 9 2.262 -7.958 3.220
90 HG3 LYS 9 HG3 LYS 9 3.243 -9.401 2.964
91 HD2 LYS 9 HD2 LYS 9 4.877 -8.559 4.595
92 HD3 LYS 9 HD3 LYS 9 3.858 -7.142 4.868
93 HE2 LYS 9 HE2 LYS 9 2.069 -8.544 5.688
94 HE3 LYS 9 HE3 LYS 9 2.996 -9.994 5.316
95 HZ1 LYS 9 HZ1 LYS 9 4.604 -9.403 6.976
96 HZ2 LYS 9 HZ2 LYS 9 3.065 -9.378 7.683
97 HZ3 LYS 9 HZ3 LYS 9 3.836 -7.923 7.277
98 H LEU 10 H LEU 10 2.383 -8.160 -1.426
99 HA LEU 10 HA LEU 10 0.289 -7.869 -2.202
100 HB2 LEU 10 HB2 LEU 10 -0.319 -7.879 0.737
101 HB3 LEU 10 HB3 LEU 10 -1.577 -7.626 -0.455
102 HG LEU 10 HG LEU 10 -1.649 -9.914 0.148
103 HD11 LEU 10 HD11 LEU 10 -0.199 -9.668 -2.474
104 HD12 LEU 10 HD12 LEU 10 -1.930 -9.462 -2.218
105 HD13 LEU 10 HD13 LEU 10 -1.183 -11.038 -1.957
106 HD21 LEU 10 HD21 LEU 10 0.278 -11.416 -0.016
107 HD22 LEU 10 HD22 LEU 10 0.545 -10.134 1.168
108 HD23 LEU 10 HD23 LEU 10 1.309 -10.044 -0.419
109 H ALA 11 H ALA 11 2.065 -5.519 -1.469
110 HA ALA 11 HA ALA 11 2.034 -3.250 -1.543
111 HB1 ALA 11 HB1 ALA 11 -0.571 -3.734 -2.980
112 HB2 ALA 11 HB2 ALA 11 1.031 -3.684 -3.714
113 HB3 ALA 11 HB3 ALA 11 0.345 -2.228 -2.993
114 HA PRO 12 HA PRO 12 -0.622 -3.237 2.284
115 HB2 PRO 12 HB2 PRO 12 1.150 -1.621 3.657
116 HB3 PRO 12 HB3 PRO 12 1.157 -3.387 3.687
117 HG2 PRO 12 HG2 PRO 12 2.829 -1.510 2.071
118 HG3 PRO 12 HG3 PRO 12 3.295 -3.023 2.871
119 HD2 PRO 12 HD2 PRO 12 2.876 -2.916 0.230
120 HD3 PRO 12 HD3 PRO 12 2.400 -4.337 1.182
121 H LEU 13 H LEU 13 0.880 -0.622 0.492
122 HA LEU 13 HA LEU 13 -0.699 1.419 1.797
123 HB2 LEU 13 HB2 LEU 13 1.588 1.870 0.985
124 HB3 LEU 13 HB3 LEU 13 1.050 1.583 -0.658
125 HG LEU 13 HG LEU 13 -0.477 3.531 -0.465
126 HD11 LEU 13 HD11 LEU 13 -0.156 5.094 1.402
127 HD12 LEU 13 HD12 LEU 13 0.908 3.927 2.186
128 HD13 LEU 13 HD13 LEU 13 -0.795 3.542 1.940
129 HD21 LEU 13 HD21 LEU 13 1.282 5.241 -0.572
130 HD22 LEU 13 HD22 LEU 13 1.708 3.794 -1.484
131 HD23 LEU 13 HD23 LEU 13 2.433 4.083 0.097
132 H TRP 14 H TRP 14 -0.920 -0.587 -1.010
133 HA TRP 14 HA TRP 14 -2.903 1.086 -2.305
134 HB2 TRP 14 HB2 TRP 14 -1.277 -0.069 -3.696
135 HB3 TRP 14 HB3 TRP 14 -1.772 -1.621 -3.032
136 HD1 TRP 14 HD1 TRP 14 -3.040 1.149 -5.390
137 HE1 TRP 14 HE1 TRP 14 -4.858 0.144 -6.914
138 HE3 TRP 14 HE3 TRP 14 -3.437 -3.478 -3.241
139 HZ2 TRP 14 HZ2 TRP 14 -6.268 -2.284 -7.164
140 HZ3 TRP 14 HZ3 TRP 14 -5.047 -5.080 -4.186
141 HH2 TRP 14 HH2 TRP 14 -6.431 -4.490 -6.106
142 H LYS 15 H LYS 15 -2.770 -2.157 -0.836
143 HA LYS 15 HA LYS 15 -5.478 -2.761 -1.400
144 HB2 LYS 15 HB2 LYS 15 -5.170 -4.693 0.070
145 HB3 LYS 15 HB3 LYS 15 -3.825 -4.513 -1.046
146 HG2 LYS 15 HG2 LYS 15 -2.501 -3.480 0.762
147 HG3 LYS 15 HG3 LYS 15 -3.844 -3.764 1.872
148 HD2 LYS 15 HD2 LYS 15 -3.679 -6.158 1.497
149 HD3 LYS 15 HD3 LYS 15 -2.390 -5.903 0.322
150 HE2 LYS 15 HE2 LYS 15 -1.410 -6.593 2.396
151 HE3 LYS 15 HE3 LYS 15 -1.015 -4.899 2.126
152 HZ1 LYS 15 HZ1 LYS 15 -2.576 -4.219 3.734
153 HZ2 LYS 15 HZ2 LYS 15 -1.747 -5.522 4.438
154 HZ3 LYS 15 HZ3 LYS 15 -3.302 -5.750 3.805
155 H ALA 16 H ALA 16 -4.090 -0.813 1.022
156 HA ALA 16 HA ALA 16 -6.416 -1.111 2.773
157 HB1 ALA 16 HB1 ALA 16 -4.207 -1.207 3.821
158 HB2 ALA 16 HB2 ALA 16 -5.136 0.175 4.401
159 HB3 ALA 16 HB3 ALA 16 -3.852 0.410 3.216
160 H LEU 17 H LEU 17 -5.253 0.888 0.293
161 HA LEU 17 HA LEU 17 -6.428 3.322 1.332
162 HB2 LEU 17 HB2 LEU 17 -4.334 3.381 0.025
163 HB3 LEU 17 HB3 LEU 17 -5.190 2.733 -1.361
164 HG LEU 17 HG LEU 17 -6.608 4.763 -1.400
165 HD11 LEU 17 HD11 LEU 17 -6.432 5.362 0.954
166 HD12 LEU 17 HD12 LEU 17 -5.944 6.702 -0.084
167 HD13 LEU 17 HD13 LEU 17 -4.722 5.732 0.737
168 HD21 LEU 17 HD21 LEU 17 -4.899 6.249 -2.290
169 HD22 LEU 17 HD22 LEU 17 -4.617 4.585 -2.807
170 HD23 LEU 17 HD23 LEU 17 -3.643 5.285 -1.514
171 H ALA 18 H ALA 18 -6.944 1.056 -1.320
172 HA ALA 18 HA ALA 18 -9.289 2.453 -2.207
173 HB1 ALA 18 HB1 ALA 18 -9.438 0.678 -3.906
174 HB2 ALA 18 HB2 ALA 18 -8.104 -0.165 -3.122
175 HB3 ALA 18 HB3 ALA 18 -7.839 1.416 -3.853
176 H LEU 19 H LEU 19 -8.569 0.115 0.100
177 HA LEU 19 HA LEU 19 -10.822 -1.557 -0.026
178 HB2 LEU 19 HB2 LEU 19 -8.780 -2.063 1.261
179 HB3 LEU 19 HB3 LEU 19 -9.170 -0.768 2.377
180 HG LEU 19 HG LEU 19 -11.184 -1.968 3.087
181 HD11 LEU 19 HD11 LEU 19 -11.678 -3.139 1.006
182 HD12 LEU 19 HD12 LEU 19 -11.578 -4.265 2.360
183 HD13 LEU 19 HD13 LEU 19 -10.242 -4.138 1.215
184 HD21 LEU 19 HD21 LEU 19 -9.093 -2.333 4.283
185 HD22 LEU 19 HD22 LEU 19 -8.680 -3.646 3.184
186 HD23 LEU 19 HD23 LEU 19 -10.068 -3.803 4.260
187 H LYS 20 H LYS 20 -10.215 1.388 1.899
188 HA LYS 20 HA LYS 20 -12.986 1.207 2.863
189 HB2 LYS 20 HB2 LYS 20 -10.500 2.339 3.974
190 HB3 LYS 20 HB3 LYS 20 -11.965 3.254 4.299
191 HG2 LYS 20 HG2 LYS 20 -11.631 1.779 6.120
192 HG3 LYS 20 HG3 LYS 20 -12.986 1.151 5.181
193 HD2 LYS 20 HD2 LYS 20 -11.429 -0.431 4.084
194 HD3 LYS 20 HD3 LYS 20 -10.140 0.154 5.138
195 HE2 LYS 20 HE2 LYS 20 -12.698 -1.190 6.003
196 HE3 LYS 20 HE3 LYS 20 -11.088 -1.902 6.018
197 HZ1 LYS 20 HZ1 LYS 20 -12.027 0.386 7.669
198 HZ2 LYS 20 HZ2 LYS 20 -10.428 -0.172 7.628
199 HZ3 LYS 20 HZ3 LYS 20 -11.663 -1.180 8.214
200 H LEU 21 H LEU 21 -11.536 2.633 0.332
201 HA LEU 21 HA LEU 21 -12.963 5.164 0.602
202 HB2 LEU 21 HB2 LEU 21 -11.013 4.172 -1.466
203 HB3 LEU 21 HB3 LEU 21 -11.868 5.698 -1.606
204 HG LEU 21 HG LEU 21 -9.888 4.939 0.543
205 HD11 LEU 21 HD11 LEU 21 -9.767 6.980 -1.668
206 HD12 LEU 21 HD12 LEU 21 -8.866 5.466 -1.596
207 HD13 LEU 21 HD13 LEU 21 -8.547 6.738 -0.419
208 HD21 LEU 21 HD21 LEU 21 -10.177 7.215 1.376
209 HD22 LEU 21 HD22 LEU 21 -11.685 6.307 1.471
210 HD23 LEU 21 HD23 LEU 21 -11.450 7.495 0.190
211 H LYS 22 H LYS 22 -13.426 2.085 -0.718
212 HA LYS 22 HA LYS 22 -15.702 3.118 -2.256
213 HB2 LYS 22 HB2 LYS 22 -13.862 0.882 -3.125
214 HB3 LYS 22 HB3 LYS 22 -15.350 1.341 -3.944
215 HG2 LYS 22 HG2 LYS 22 -14.364 3.622 -4.258
216 HG3 LYS 22 HG3 LYS 22 -12.844 2.974 -3.643
217 HD2 LYS 22 HD2 LYS 22 -12.783 2.937 -6.040
218 HD3 LYS 22 HD3 LYS 22 -12.903 1.276 -5.453
219 HE2 LYS 22 HE2 LYS 22 -15.262 1.223 -5.953
220 HE3 LYS 22 HE3 LYS 22 -15.244 2.932 -6.391
221 HZ1 LYS 22 HZ1 LYS 22 -13.812 0.752 -7.813
222 HZ2 LYS 22 HZ2 LYS 22 -13.739 2.399 -8.217
223 HZ3 LYS 22 HZ3 LYS 22 -15.203 1.558 -8.361
224 H LYS 23 H LYS 23 -14.308 0.373 -0.514
225 HA LYS 23 HA LYS 23 -16.960 -0.803 -0.285
226 HB2 LYS 23 HB2 LYS 23 -14.288 -1.863 0.656
227 HB3 LYS 23 HB3 LYS 23 -15.819 -2.722 0.754
228 HG2 LYS 23 HG2 LYS 23 -14.381 -1.897 -1.759
229 HG3 LYS 23 HG3 LYS 23 -14.541 -3.534 -1.120
230 HD2 LYS 23 HD2 LYS 23 -16.997 -3.350 -1.390
231 HD3 LYS 23 HD3 LYS 23 -16.768 -1.763 -2.125
232 HE2 LYS 23 HE2 LYS 23 -17.027 -3.380 -3.877
233 HE3 LYS 23 HE3 LYS 23 -15.351 -2.832 -3.860
234 HZ1 LYS 23 HZ1 LYS 23 -14.773 -4.848 -2.607
235 HZ2 LYS 23 HZ2 LYS 23 -15.445 -5.214 -4.122
236 HZ3 LYS 23 HZ3 LYS 23 -16.382 -5.372 -2.717
237 H ALA 24 H ALA 24 -17.973 0.620 1.084
238 HA ALA 24 HA ALA 24 -17.131 0.473 3.881
239 HB1 ALA 24 HB1 ALA 24 -17.847 3.053 2.483
240 HB2 ALA 24 HB2 ALA 24 -16.238 2.594 3.046
241 HB3 ALA 24 HB3 ALA 24 -17.537 2.867 4.209
Start of MODEL 6
1 H1 LYS 1 H1 LYS 1 14.733 -8.822 -6.646
2 H2 LYS 1 H2 LYS 1 14.704 -10.362 -7.359
3 H3 LYS 1 H3 LYS 1 15.871 -9.987 -6.186
4 HA LYS 1 HA LYS 1 12.956 -10.030 -5.674
5 HB2 LYS 1 HB2 LYS 1 13.495 -12.137 -4.393
6 HB3 LYS 1 HB3 LYS 1 13.585 -12.283 -6.145
7 HG2 LYS 1 HG2 LYS 1 16.011 -12.080 -6.047
8 HG3 LYS 1 HG3 LYS 1 15.928 -11.911 -4.293
9 HD2 LYS 1 HD2 LYS 1 15.108 -14.133 -4.038
10 HD3 LYS 1 HD3 LYS 1 14.875 -14.310 -5.778
11 HE2 LYS 1 HE2 LYS 1 17.542 -13.900 -4.433
12 HE3 LYS 1 HE3 LYS 1 16.897 -15.467 -4.920
13 HZ1 LYS 1 HZ1 LYS 1 18.414 -14.601 -6.580
14 HZ2 LYS 1 HZ2 LYS 1 17.491 -13.191 -6.740
15 HZ3 LYS 1 HZ3 LYS 1 16.844 -14.683 -7.212
16 H LYS 2 H LYS 2 12.638 -10.377 -3.248
17 HA LYS 2 HA LYS 2 12.789 -9.537 -1.148
18 HB2 LYS 2 HB2 LYS 2 15.714 -10.071 -1.663
19 HB3 LYS 2 HB3 LYS 2 15.050 -9.672 -0.086
20 HG2 LYS 2 HG2 LYS 2 13.572 -11.690 -0.313
21 HG3 LYS 2 HG3 LYS 2 14.508 -12.113 -1.750
22 HD2 LYS 2 HD2 LYS 2 15.680 -11.680 0.998
23 HD3 LYS 2 HD3 LYS 2 15.298 -13.257 0.308
24 HE2 LYS 2 HE2 LYS 2 16.931 -12.998 -1.399
25 HE3 LYS 2 HE3 LYS 2 17.168 -11.296 -1.004
26 HZ1 LYS 2 HZ1 LYS 2 18.928 -12.829 -0.163
27 HZ2 LYS 2 HZ2 LYS 2 17.774 -13.504 0.882
28 HZ3 LYS 2 HZ3 LYS 2 18.199 -11.868 1.029
29 H LEU 3 H LEU 3 12.610 -7.550 -3.093
30 HA LEU 3 HA LEU 3 13.723 -5.357 -1.539
31 HB2 LEU 3 HB2 LEU 3 15.362 -5.743 -3.332
32 HB3 LEU 3 HB3 LEU 3 14.092 -5.578 -4.530
33 HG LEU 3 HG LEU 3 13.764 -3.223 -3.803
34 HD11 LEU 3 HD11 LEU 3 16.224 -3.729 -2.139
35 HD12 LEU 3 HD12 LEU 3 14.598 -3.423 -1.526
36 HD13 LEU 3 HD13 LEU 3 15.459 -2.163 -2.410
37 HD21 LEU 3 HD21 LEU 3 15.157 -3.739 -5.727
38 HD22 LEU 3 HD22 LEU 3 16.557 -3.942 -4.675
39 HD23 LEU 3 HD23 LEU 3 15.804 -2.357 -4.841
40 H LYS 4 H LYS 4 12.310 -5.288 -4.766
41 HA LYS 4 HA LYS 4 10.173 -3.616 -3.715
42 HB2 LYS 4 HB2 LYS 4 9.670 -3.171 -6.106
43 HB3 LYS 4 HB3 LYS 4 11.317 -2.758 -5.652
44 HG2 LYS 4 HG2 LYS 4 12.022 -4.979 -6.598
45 HG3 LYS 4 HG3 LYS 4 10.388 -5.135 -7.243
46 HD2 LYS 4 HD2 LYS 4 11.836 -4.253 -8.953
47 HD3 LYS 4 HD3 LYS 4 10.709 -2.992 -8.448
48 HE2 LYS 4 HE2 LYS 4 12.446 -2.043 -6.995
49 HE3 LYS 4 HE3 LYS 4 13.567 -3.292 -7.532
50 HZ1 LYS 4 HZ1 LYS 4 13.324 -2.431 -9.806
51 HZ2 LYS 4 HZ2 LYS 4 13.961 -1.274 -8.745
52 HZ3 LYS 4 HZ3 LYS 4 12.334 -1.182 -9.221
53 H LEU 5 H LEU 5 10.679 -6.722 -5.254
54 HA LEU 5 HA LEU 5 7.941 -7.343 -5.644
55 HB2 LEU 5 HB2 LEU 5 9.800 -8.500 -6.800
56 HB3 LEU 5 HB3 LEU 5 10.292 -9.206 -5.272
57 HG LEU 5 HG LEU 5 8.130 -10.408 -5.158
58 HD11 LEU 5 HD11 LEU 5 6.793 -8.867 -6.492
59 HD12 LEU 5 HD12 LEU 5 6.709 -10.505 -7.140
60 HD13 LEU 5 HD13 LEU 5 7.719 -9.295 -7.931
61 HD21 LEU 5 HD21 LEU 5 8.638 -12.034 -6.914
62 HD22 LEU 5 HD22 LEU 5 10.100 -11.504 -6.081
63 HD23 LEU 5 HD23 LEU 5 9.718 -10.871 -7.682
64 H ALA 6 H ALA 6 10.043 -7.388 -2.916
65 HA ALA 6 HA ALA 6 8.600 -9.238 -1.310
66 HB1 ALA 6 HB1 ALA 6 9.935 -8.378 0.540
67 HB2 ALA 6 HB2 ALA 6 10.474 -7.029 -0.461
68 HB3 ALA 6 HB3 ALA 6 10.945 -8.679 -0.873
69 H LEU 7 H LEU 7 7.918 -6.112 -2.339
70 HA LEU 7 HA LEU 7 6.088 -5.648 -0.082
71 HB2 LEU 7 HB2 LEU 7 7.870 -3.942 -0.362
72 HB3 LEU 7 HB3 LEU 7 7.276 -3.619 -1.979
73 HG LEU 7 HG LEU 7 5.116 -2.879 -1.008
74 HD11 LEU 7 HD11 LEU 7 5.163 -4.146 1.060
75 HD12 LEU 7 HD12 LEU 7 5.004 -2.421 1.396
76 HD13 LEU 7 HD13 LEU 7 6.560 -3.222 1.615
77 HD21 LEU 7 HD21 LEU 7 6.869 -1.264 -1.558
78 HD22 LEU 7 HD22 LEU 7 7.548 -1.451 0.059
79 HD23 LEU 7 HD23 LEU 7 5.941 -0.755 -0.149
80 H ALA 8 H ALA 8 6.471 -5.908 -3.518
81 HA ALA 8 HA ALA 8 3.876 -4.971 -4.235
82 HB1 ALA 8 HB1 ALA 8 4.380 -5.883 -6.445
83 HB2 ALA 8 HB2 ALA 8 5.791 -6.712 -5.786
84 HB3 ALA 8 HB3 ALA 8 5.740 -4.950 -5.816
85 H LYS 9 H LYS 9 4.755 -7.635 -2.537
86 HA LYS 9 HA LYS 9 2.538 -9.259 -3.573
87 HB2 LYS 9 HB2 LYS 9 4.723 -10.080 -1.649
88 HB3 LYS 9 HB3 LYS 9 3.475 -11.129 -2.298
89 HG2 LYS 9 HG2 LYS 9 5.702 -9.819 -3.843
90 HG3 LYS 9 HG3 LYS 9 5.571 -11.524 -3.419
91 HD2 LYS 9 HD2 LYS 9 3.698 -9.995 -5.225
92 HD3 LYS 9 HD3 LYS 9 4.946 -11.124 -5.748
93 HE2 LYS 9 HE2 LYS 9 3.756 -12.868 -4.336
94 HE3 LYS 9 HE3 LYS 9 2.430 -11.711 -4.211
95 HZ1 LYS 9 HZ1 LYS 9 1.942 -13.140 -6.014
96 HZ2 LYS 9 HZ2 LYS 9 3.495 -12.986 -6.662
97 HZ3 LYS 9 HZ3 LYS 9 2.429 -11.666 -6.707
98 H LEU 10 H LEU 10 3.118 -6.925 -1.462
99 HA LEU 10 HA LEU 10 1.164 -7.914 0.506
100 HB2 LEU 10 HB2 LEU 10 3.316 -5.817 0.871
101 HB3 LEU 10 HB3 LEU 10 2.149 -6.294 2.087
102 HG LEU 10 HG LEU 10 4.272 -8.108 0.935
103 HD11 LEU 10 HD11 LEU 10 4.133 -6.702 3.598
104 HD12 LEU 10 HD12 LEU 10 5.239 -6.315 2.281
105 HD13 LEU 10 HD13 LEU 10 5.361 -7.869 3.108
106 HD21 LEU 10 HD21 LEU 10 3.633 -9.615 2.743
107 HD22 LEU 10 HD22 LEU 10 2.263 -9.291 1.683
108 HD23 LEU 10 HD23 LEU 10 2.373 -8.489 3.249
109 H ALA 11 H ALA 11 2.434 -5.052 -1.149
110 HA ALA 11 HA ALA 11 1.510 -3.019 -1.653
111 HB1 ALA 11 HB1 ALA 11 -0.517 -3.171 -3.002
112 HB2 ALA 11 HB2 ALA 11 -0.798 -4.809 -2.407
113 HB3 ALA 11 HB3 ALA 11 0.615 -4.463 -3.404
114 HA PRO 12 HA PRO 12 -1.148 -3.261 2.280
115 HB2 PRO 12 HB2 PRO 12 0.366 -1.679 3.895
116 HB3 PRO 12 HB3 PRO 12 0.615 -3.420 3.737
117 HG2 PRO 12 HG2 PRO 12 2.089 -1.169 2.432
118 HG3 PRO 12 HG3 PRO 12 2.729 -2.662 3.146
119 HD2 PRO 12 HD2 PRO 12 2.412 -2.340 0.479
120 HD3 PRO 12 HD3 PRO 12 2.236 -3.914 1.277
121 H LEU 13 H LEU 13 0.522 -0.479 0.902
122 HA LEU 13 HA LEU 13 -1.078 1.536 2.014
123 HB2 LEU 13 HB2 LEU 13 1.060 2.013 0.967
124 HB3 LEU 13 HB3 LEU 13 0.456 1.466 -0.584
125 HG LEU 13 HG LEU 13 -1.185 3.357 -0.540
126 HD11 LEU 13 HD11 LEU 13 -1.235 3.726 1.870
127 HD12 LEU 13 HD12 LEU 13 -0.784 5.197 1.010
128 HD13 LEU 13 HD13 LEU 13 0.450 4.244 1.831
129 HD21 LEU 13 HD21 LEU 13 1.732 4.109 -0.373
130 HD22 LEU 13 HD22 LEU 13 0.458 5.062 -1.135
131 HD23 LEU 13 HD23 LEU 13 0.902 3.491 -1.801
132 H TRP 14 H TRP 14 -1.456 -0.427 -0.881
133 HA TRP 14 HA TRP 14 -3.616 1.242 -1.843
134 HB2 TRP 14 HB2 TRP 14 -2.381 -1.256 -3.013
135 HB3 TRP 14 HB3 TRP 14 -3.571 -0.236 -3.817
136 HD1 TRP 14 HD1 TRP 14 -2.741 2.293 -4.472
137 HE1 TRP 14 HE1 TRP 14 -0.391 3.187 -5.046
138 HE3 TRP 14 HE3 TRP 14 0.057 -1.542 -2.582
139 HZ2 TRP 14 HZ2 TRP 14 2.289 2.355 -4.751
140 HZ3 TRP 14 HZ3 TRP 14 2.508 -1.418 -2.774
141 HH2 TRP 14 HH2 TRP 14 3.599 0.490 -3.837
142 H LYS 15 H LYS 15 -3.216 -1.795 -0.182
143 HA LYS 15 HA LYS 15 -5.735 -2.921 -0.657
144 HB2 LYS 15 HB2 LYS 15 -4.088 -3.051 1.878
145 HB3 LYS 15 HB3 LYS 15 -5.446 -4.099 1.496
146 HG2 LYS 15 HG2 LYS 15 -4.176 -4.888 -0.498
147 HG3 LYS 15 HG3 LYS 15 -2.794 -3.963 0.088
148 HD2 LYS 15 HD2 LYS 15 -2.478 -6.191 0.837
149 HD3 LYS 15 HD3 LYS 15 -2.992 -5.261 2.245
150 HE2 LYS 15 HE2 LYS 15 -4.147 -7.404 2.165
151 HE3 LYS 15 HE3 LYS 15 -5.285 -6.076 1.940
152 HZ1 LYS 15 HZ1 LYS 15 -5.658 -7.928 0.390
153 HZ2 LYS 15 HZ2 LYS 15 -4.114 -7.686 -0.268
154 HZ3 LYS 15 HZ3 LYS 15 -5.299 -6.482 -0.417
155 H ALA 16 H ALA 16 -4.708 -0.419 1.594
156 HA ALA 16 HA ALA 16 -7.441 -0.245 2.633
157 HB1 ALA 16 HB1 ALA 16 -5.649 -0.361 4.290
158 HB2 ALA 16 HB2 ALA 16 -6.504 1.179 4.388
159 HB3 ALA 16 HB3 ALA 16 -4.921 1.097 3.615
160 H LEU 17 H LEU 17 -5.506 1.161 0.278
161 HA LEU 17 HA LEU 17 -6.583 3.834 0.494
162 HB2 LEU 17 HB2 LEU 17 -4.320 3.491 -0.388
163 HB3 LEU 17 HB3 LEU 17 -4.966 2.510 -1.688
164 HG LEU 17 HG LEU 17 -6.169 4.505 -2.547
165 HD11 LEU 17 HD11 LEU 17 -6.325 5.748 -0.448
166 HD12 LEU 17 HD12 LEU 17 -5.571 6.709 -1.719
167 HD13 LEU 17 HD13 LEU 17 -4.577 5.981 -0.456
168 HD21 LEU 17 HD21 LEU 17 -4.193 5.604 -3.461
169 HD22 LEU 17 HD22 LEU 17 -4.008 3.850 -3.460
170 HD23 LEU 17 HD23 LEU 17 -3.189 4.824 -2.238
171 H ALA 18 H ALA 18 -7.120 0.894 -1.312
172 HA ALA 18 HA ALA 18 -9.258 2.185 -2.811
173 HB1 ALA 18 HB1 ALA 18 -9.242 0.220 -4.235
174 HB2 ALA 18 HB2 ALA 18 -8.072 -0.558 -3.170
175 HB3 ALA 18 HB3 ALA 18 -7.615 0.883 -4.078
176 H LEU 19 H LEU 19 -8.728 -0.678 -0.753
177 HA LEU 19 HA LEU 19 -11.470 -1.480 -1.073
178 HB2 LEU 19 HB2 LEU 19 -9.497 -3.033 -0.876
179 HB3 LEU 19 HB3 LEU 19 -9.429 -2.615 0.824
180 HG LEU 19 HG LEU 19 -11.711 -3.523 1.123
181 HD11 LEU 19 HD11 LEU 19 -11.404 -4.375 -1.754
182 HD12 LEU 19 HD12 LEU 19 -12.544 -3.178 -1.139
183 HD13 LEU 19 HD13 LEU 19 -12.700 -4.869 -0.666
184 HD21 LEU 19 HD21 LEU 19 -9.747 -5.433 -0.139
185 HD22 LEU 19 HD22 LEU 19 -11.091 -5.874 0.915
186 HD23 LEU 19 HD23 LEU 19 -9.751 -4.919 1.549
187 H LYS 20 H LYS 20 -9.798 0.548 1.120
188 HA LYS 20 HA LYS 20 -11.991 0.306 3.059
189 HB2 LYS 20 HB2 LYS 20 -9.200 1.399 3.316
190 HB3 LYS 20 HB3 LYS 20 -10.445 1.752 4.507
191 HG2 LYS 20 HG2 LYS 20 -9.496 -0.999 3.741
192 HG3 LYS 20 HG3 LYS 20 -9.011 -0.109 5.185
193 HD2 LYS 20 HD2 LYS 20 -11.446 -0.014 5.817
194 HD3 LYS 20 HD3 LYS 20 -11.764 -1.120 4.483
195 HE2 LYS 20 HE2 LYS 20 -9.963 -1.654 6.839
196 HE3 LYS 20 HE3 LYS 20 -11.584 -2.307 6.609
197 HZ1 LYS 20 HZ1 LYS 20 -9.214 -2.847 4.899
198 HZ2 LYS 20 HZ2 LYS 20 -10.780 -3.424 4.598
199 HZ3 LYS 20 HZ3 LYS 20 -9.945 -3.926 5.985
200 H LEU 21 H LEU 21 -11.228 2.081 0.438
201 HA LEU 21 HA LEU 21 -12.478 4.516 1.521
202 HB2 LEU 21 HB2 LEU 21 -10.258 4.846 0.509
203 HB3 LEU 21 HB3 LEU 21 -10.847 4.169 -0.996
204 HG LEU 21 HG LEU 21 -12.462 6.052 -1.166
205 HD11 LEU 21 HD11 LEU 21 -10.962 7.119 1.221
206 HD12 LEU 21 HD12 LEU 21 -12.651 6.612 1.188
207 HD13 LEU 21 HD13 LEU 21 -12.134 8.017 0.255
208 HD21 LEU 21 HD21 LEU 21 -10.339 6.137 -2.345
209 HD22 LEU 21 HD22 LEU 21 -9.561 6.833 -0.922
210 HD23 LEU 21 HD23 LEU 21 -10.804 7.743 -1.781
211 H LYS 22 H LYS 22 -12.495 2.248 -1.184
212 HA LYS 22 HA LYS 22 -14.912 3.368 -2.288
213 HB2 LYS 22 HB2 LYS 22 -13.187 2.450 -3.759
214 HB3 LYS 22 HB3 LYS 22 -13.356 0.875 -3.003
215 HG2 LYS 22 HG2 LYS 22 -14.471 0.951 -5.157
216 HG3 LYS 22 HG3 LYS 22 -15.624 0.690 -3.848
217 HD2 LYS 22 HD2 LYS 22 -16.253 3.039 -3.905
218 HD3 LYS 22 HD3 LYS 22 -15.058 3.341 -5.169
219 HE2 LYS 22 HE2 LYS 22 -17.357 1.414 -5.442
220 HE3 LYS 22 HE3 LYS 22 -17.400 3.087 -5.997
221 HZ1 LYS 22 HZ1 LYS 22 -15.749 2.670 -7.583
222 HZ2 LYS 22 HZ2 LYS 22 -16.809 1.350 -7.706
223 HZ3 LYS 22 HZ3 LYS 22 -15.327 1.179 -6.900
224 H LYS 23 H LYS 23 -14.016 0.775 -0.137
225 HA LYS 23 HA LYS 23 -16.783 -0.189 -0.161
226 HB2 LYS 23 HB2 LYS 23 -14.229 -1.525 0.713
227 HB3 LYS 23 HB3 LYS 23 -15.815 -2.166 1.108
228 HG2 LYS 23 HG2 LYS 23 -14.655 -1.782 -1.638
229 HG3 LYS 23 HG3 LYS 23 -14.957 -3.312 -0.811
230 HD2 LYS 23 HD2 LYS 23 -17.408 -2.508 -0.710
231 HD3 LYS 23 HD3 LYS 23 -16.923 -1.362 -1.959
232 HE2 LYS 23 HE2 LYS 23 -17.847 -3.300 -3.023
233 HE3 LYS 23 HE3 LYS 23 -16.109 -3.272 -3.318
234 HZ1 LYS 23 HZ1 LYS 23 -17.325 -4.837 -1.115
235 HZ2 LYS 23 HZ2 LYS 23 -15.759 -4.979 -1.751
236 HZ3 LYS 23 HZ3 LYS 23 -17.098 -5.478 -2.667
237 H ALA 24 H ALA 24 -18.012 -0.104 1.610
238 HA ALA 24 HA ALA 24 -16.769 0.700 4.147
239 HB1 ALA 24 HB1 ALA 24 -17.779 2.688 3.122
240 HB2 ALA 24 HB2 ALA 24 -18.615 2.224 4.602
241 HB3 ALA 24 HB3 ALA 24 -19.331 1.852 3.032
Start of MODEL 7
1 H1 LYS 1 H1 LYS 1 16.128 1.652 -5.798
2 H2 LYS 1 H2 LYS 1 16.461 0.071 -6.310
3 H3 LYS 1 H3 LYS 1 17.407 0.785 -5.096
4 HA LYS 1 HA LYS 1 15.836 -0.826 -4.217
5 HB2 LYS 1 HB2 LYS 1 14.874 0.589 -2.452
6 HB3 LYS 1 HB3 LYS 1 16.557 0.978 -2.763
7 HG2 LYS 1 HG2 LYS 1 14.342 2.560 -4.019
8 HG3 LYS 1 HG3 LYS 1 14.899 2.893 -2.383
9 HD2 LYS 1 HD2 LYS 1 17.177 3.229 -3.239
10 HD3 LYS 1 HD3 LYS 1 16.595 2.932 -4.877
11 HE2 LYS 1 HE2 LYS 1 15.738 5.175 -3.050
12 HE3 LYS 1 HE3 LYS 1 16.799 5.319 -4.450
13 HZ1 LYS 1 HZ1 LYS 1 14.655 5.999 -5.121
14 HZ2 LYS 1 HZ2 LYS 1 13.913 4.643 -4.431
15 HZ3 LYS 1 HZ3 LYS 1 14.894 4.462 -5.802
16 H LYS 2 H LYS 2 14.767 0.080 -6.873
17 HA LYS 2 HA LYS 2 11.956 0.568 -6.319
18 HB2 LYS 2 HB2 LYS 2 13.218 1.679 -8.207
19 HB3 LYS 2 HB3 LYS 2 13.299 0.109 -8.989
20 HG2 LYS 2 HG2 LYS 2 11.509 1.480 -9.908
21 HG3 LYS 2 HG3 LYS 2 10.874 0.029 -9.133
22 HD2 LYS 2 HD2 LYS 2 10.180 1.271 -7.212
23 HD3 LYS 2 HD3 LYS 2 11.028 2.713 -7.769
24 HE2 LYS 2 HE2 LYS 2 8.587 2.837 -8.117
25 HE3 LYS 2 HE3 LYS 2 9.505 2.953 -9.618
26 HZ1 LYS 2 HZ1 LYS 2 8.342 0.401 -8.658
27 HZ2 LYS 2 HZ2 LYS 2 8.923 0.770 -10.211
28 HZ3 LYS 2 HZ3 LYS 2 7.485 1.475 -9.652
29 H LEU 3 H LEU 3 12.101 -1.566 -5.098
30 HA LEU 3 HA LEU 3 10.717 -3.541 -6.620
31 HB2 LEU 3 HB2 LEU 3 13.022 -4.092 -7.275
32 HB3 LEU 3 HB3 LEU 3 13.463 -4.260 -5.586
33 HG LEU 3 HG LEU 3 11.873 -6.159 -5.392
34 HD11 LEU 3 HD11 LEU 3 10.979 -7.178 -7.419
35 HD12 LEU 3 HD12 LEU 3 11.634 -5.856 -8.384
36 HD13 LEU 3 HD13 LEU 3 10.356 -5.544 -7.210
37 HD21 LEU 3 HD21 LEU 3 14.236 -6.565 -5.798
38 HD22 LEU 3 HD22 LEU 3 13.977 -6.425 -7.535
39 HD23 LEU 3 HD23 LEU 3 13.246 -7.758 -6.641
40 H LYS 4 H LYS 4 12.838 -3.615 -3.746
41 HA LYS 4 HA LYS 4 10.778 -5.003 -2.263
42 HB2 LYS 4 HB2 LYS 4 13.499 -4.041 -1.374
43 HB3 LYS 4 HB3 LYS 4 12.455 -5.143 -0.490
44 HG2 LYS 4 HG2 LYS 4 12.698 -6.816 -2.216
45 HG3 LYS 4 HG3 LYS 4 13.649 -5.699 -3.195
46 HD2 LYS 4 HD2 LYS 4 15.344 -5.614 -1.409
47 HD3 LYS 4 HD3 LYS 4 14.409 -6.795 -0.491
48 HE2 LYS 4 HE2 LYS 4 14.697 -8.439 -2.244
49 HE3 LYS 4 HE3 LYS 4 15.534 -7.255 -3.251
50 HZ1 LYS 4 HZ1 LYS 4 16.481 -8.211 -0.602
51 HZ2 LYS 4 HZ2 LYS 4 17.296 -7.140 -1.639
52 HZ3 LYS 4 HZ3 LYS 4 17.065 -8.755 -2.099
53 H LEU 5 H LEU 5 12.643 -2.002 -1.854
54 HA LEU 5 HA LEU 5 11.221 -1.051 0.373
55 HB2 LEU 5 HB2 LEU 5 13.431 -0.204 -0.404
56 HB3 LEU 5 HB3 LEU 5 12.619 0.583 -1.745
57 HG LEU 5 HG LEU 5 11.323 1.932 -0.086
58 HD11 LEU 5 HD11 LEU 5 11.513 0.431 1.815
59 HD12 LEU 5 HD12 LEU 5 12.145 2.030 2.211
60 HD13 LEU 5 HD13 LEU 5 13.256 0.701 1.870
61 HD21 LEU 5 HD21 LEU 5 13.158 3.435 0.451
62 HD22 LEU 5 HD22 LEU 5 13.300 2.828 -1.198
63 HD23 LEU 5 HD23 LEU 5 14.321 2.164 0.078
64 H ALA 6 H ALA 6 10.744 -0.600 -3.073
65 HA ALA 6 HA ALA 6 8.553 1.222 -2.791
66 HB1 ALA 6 HB1 ALA 6 10.004 1.231 -4.759
67 HB2 ALA 6 HB2 ALA 6 8.315 0.981 -5.204
68 HB3 ALA 6 HB3 ALA 6 9.436 -0.383 -5.186
69 H LEU 7 H LEU 7 8.673 -1.856 -1.897
70 HA LEU 7 HA LEU 7 5.834 -2.291 -2.554
71 HB2 LEU 7 HB2 LEU 7 7.364 -3.796 -3.848
72 HB3 LEU 7 HB3 LEU 7 7.929 -4.456 -2.325
73 HG LEU 7 HG LEU 7 5.654 -5.282 -1.847
74 HD11 LEU 7 HD11 LEU 7 5.019 -4.236 -4.604
75 HD12 LEU 7 HD12 LEU 7 4.375 -3.621 -3.081
76 HD13 LEU 7 HD13 LEU 7 3.961 -5.250 -3.623
77 HD21 LEU 7 HD21 LEU 7 7.269 -6.733 -2.972
78 HD22 LEU 7 HD22 LEU 7 6.726 -6.127 -4.539
79 HD23 LEU 7 HD23 LEU 7 5.624 -7.056 -3.524
80 H ALA 8 H ALA 8 7.843 -1.453 -0.239
81 HA ALA 8 HA ALA 8 6.408 -2.951 1.847
82 HB1 ALA 8 HB1 ALA 8 8.802 -3.474 1.812
83 HB2 ALA 8 HB2 ALA 8 8.333 -2.651 3.301
84 HB3 ALA 8 HB3 ALA 8 9.175 -1.763 2.028
85 H LYS 9 H LYS 9 7.550 0.152 0.728
86 HA LYS 9 HA LYS 9 6.477 1.525 3.044
87 HB2 LYS 9 HB2 LYS 9 7.815 2.608 0.558
88 HB3 LYS 9 HB3 LYS 9 7.322 3.574 1.942
89 HG2 LYS 9 HG2 LYS 9 9.376 1.374 1.968
90 HG3 LYS 9 HG3 LYS 9 9.708 3.106 1.984
91 HD2 LYS 9 HD2 LYS 9 8.492 3.277 4.137
92 HD3 LYS 9 HD3 LYS 9 8.272 1.524 4.118
93 HE2 LYS 9 HE2 LYS 9 10.704 1.227 4.099
94 HE3 LYS 9 HE3 LYS 9 10.918 2.976 4.136
95 HZ1 LYS 9 HZ1 LYS 9 9.731 2.984 6.285
96 HZ2 LYS 9 HZ2 LYS 9 11.182 2.105 6.326
97 HZ3 LYS 9 HZ3 LYS 9 9.697 1.286 6.252
98 H LEU 10 H LEU 10 4.315 1.212 2.923
99 HA LEU 10 HA LEU 10 2.211 1.994 2.590
100 HB2 LEU 10 HB2 LEU 10 3.523 3.841 0.603
101 HB3 LEU 10 HB3 LEU 10 1.829 3.913 1.044
102 HG LEU 10 HG LEU 10 4.143 4.342 2.933
103 HD11 LEU 10 HD11 LEU 10 3.457 6.677 2.928
104 HD12 LEU 10 HD12 LEU 10 2.207 6.320 1.738
105 HD13 LEU 10 HD13 LEU 10 3.907 6.150 1.305
106 HD21 LEU 10 HD21 LEU 10 2.405 5.088 4.508
107 HD22 LEU 10 HD22 LEU 10 2.225 3.387 4.072
108 HD23 LEU 10 HD23 LEU 10 1.165 4.600 3.351
109 H ALA 11 H ALA 11 4.064 0.674 0.059
110 HA ALA 11 HA ALA 11 2.214 0.468 -1.997
111 HB1 ALA 11 HB1 ALA 11 4.272 -1.602 -1.280
112 HB2 ALA 11 HB2 ALA 11 4.593 -0.130 -2.193
113 HB3 ALA 11 HB3 ALA 11 3.517 -1.359 -2.851
114 HA PRO 12 HA PRO 12 0.503 -3.628 0.020
115 HB2 PRO 12 HB2 PRO 12 1.216 -3.210 2.860
116 HB3 PRO 12 HB3 PRO 12 1.269 -4.688 1.894
117 HG2 PRO 12 HG2 PRO 12 3.510 -3.438 2.609
118 HG3 PRO 12 HG3 PRO 12 3.349 -4.191 1.010
119 HD2 PRO 12 HD2 PRO 12 3.118 -1.302 1.775
120 HD3 PRO 12 HD3 PRO 12 3.944 -2.033 0.382
121 H LEU 13 H LEU 13 0.683 -0.526 1.595
122 HA LEU 13 HA LEU 13 -1.897 -0.768 2.859
123 HB2 LEU 13 HB2 LEU 13 0.048 1.522 2.613
124 HB3 LEU 13 HB3 LEU 13 -1.513 1.683 3.390
125 HG LEU 13 HG LEU 13 0.068 1.386 5.117
126 HD11 LEU 13 HD11 LEU 13 -0.620 -0.706 6.170
127 HD12 LEU 13 HD12 LEU 13 -1.277 -1.268 4.632
128 HD13 LEU 13 HD13 LEU 13 -1.987 0.134 5.435
129 HD21 LEU 13 HD21 LEU 13 1.120 -0.986 3.578
130 HD22 LEU 13 HD22 LEU 13 1.614 -0.541 5.212
131 HD23 LEU 13 HD23 LEU 13 1.946 0.547 3.864
132 H TRP 14 H TRP 14 -0.741 0.135 -0.206
133 HA TRP 14 HA TRP 14 -2.698 1.962 -1.030
134 HB2 TRP 14 HB2 TRP 14 -0.702 1.489 -2.364
135 HB3 TRP 14 HB3 TRP 14 -1.253 -0.162 -2.634
136 HD1 TRP 14 HD1 TRP 14 -2.817 -0.575 -4.657
137 HE1 TRP 14 HE1 TRP 14 -3.903 0.929 -6.452
138 HE3 TRP 14 HE3 TRP 14 -1.723 3.994 -2.637
139 HZ2 TRP 14 HZ2 TRP 14 -4.240 3.695 -6.932
140 HZ3 TRP 14 HZ3 TRP 14 -2.464 6.017 -3.825
141 HH2 TRP 14 HH2 TRP 14 -3.696 5.869 -5.928
142 H LYS 15 H LYS 15 -2.678 -1.538 -0.820
143 HA LYS 15 HA LYS 15 -5.143 -1.984 -2.133
144 HB2 LYS 15 HB2 LYS 15 -3.831 -3.694 -0.012
145 HB3 LYS 15 HB3 LYS 15 -5.057 -4.215 -1.160
146 HG2 LYS 15 HG2 LYS 15 -3.454 -3.710 -3.001
147 HG3 LYS 15 HG3 LYS 15 -2.229 -3.384 -1.774
148 HD2 LYS 15 HD2 LYS 15 -2.583 -5.695 -0.904
149 HD3 LYS 15 HD3 LYS 15 -3.660 -5.991 -2.272
150 HE2 LYS 15 HE2 LYS 15 -1.764 -5.370 -3.782
151 HE3 LYS 15 HE3 LYS 15 -0.723 -5.338 -2.359
152 HZ1 LYS 15 HZ1 LYS 15 -2.187 -7.673 -3.462
153 HZ2 LYS 15 HZ2 LYS 15 -1.395 -7.685 -1.962
154 HZ3 LYS 15 HZ3 LYS 15 -0.509 -7.454 -3.386
155 H ALA 16 H ALA 16 -4.235 -1.328 1.193
156 HA ALA 16 HA ALA 16 -6.841 -1.724 2.284
157 HB1 ALA 16 HB1 ALA 16 -5.928 -0.683 4.297
158 HB2 ALA 16 HB2 ALA 16 -4.492 -0.195 3.399
159 HB3 ALA 16 HB3 ALA 16 -4.829 -1.906 3.659
160 H LEU 17 H LEU 17 -5.262 0.867 0.651
161 HA LEU 17 HA LEU 17 -6.989 2.941 1.622
162 HB2 LEU 17 HB2 LEU 17 -4.707 3.427 0.816
163 HB3 LEU 17 HB3 LEU 17 -5.160 2.880 -0.787
164 HG LEU 17 HG LEU 17 -6.805 4.728 -0.923
165 HD11 LEU 17 HD11 LEU 17 -5.570 5.589 1.688
166 HD12 LEU 17 HD12 LEU 17 -7.225 5.025 1.456
167 HD13 LEU 17 HD13 LEU 17 -6.696 6.537 0.718
168 HD21 LEU 17 HD21 LEU 17 -3.976 5.574 -0.312
169 HD22 LEU 17 HD22 LEU 17 -5.164 6.518 -1.211
170 HD23 LEU 17 HD23 LEU 17 -4.570 4.991 -1.866
171 H ALA 18 H ALA 18 -6.716 0.866 -1.194
172 HA ALA 18 HA ALA 18 -8.979 1.895 -2.536
173 HB1 ALA 18 HB1 ALA 18 -7.246 0.601 -3.691
174 HB2 ALA 18 HB2 ALA 18 -8.844 -0.105 -3.926
175 HB3 ALA 18 HB3 ALA 18 -7.719 -0.834 -2.782
176 H LEU 19 H LEU 19 -8.471 -0.579 -0.129
177 HA LEU 19 HA LEU 19 -10.978 -1.819 -0.143
178 HB2 LEU 19 HB2 LEU 19 -8.998 -2.644 1.076
179 HB3 LEU 19 HB3 LEU 19 -9.130 -1.297 2.189
180 HG LEU 19 HG LEU 19 -11.376 -2.180 2.874
181 HD11 LEU 19 HD11 LEU 19 -11.887 -4.513 2.345
182 HD12 LEU 19 HD12 LEU 19 -10.505 -4.563 1.250
183 HD13 LEU 19 HD13 LEU 19 -11.871 -3.503 0.899
184 HD21 LEU 19 HD21 LEU 19 -9.418 -2.575 4.243
185 HD22 LEU 19 HD22 LEU 19 -8.985 -3.974 3.263
186 HD23 LEU 19 HD23 LEU 19 -10.448 -4.005 4.244
187 H LYS 20 H LYS 20 -9.810 0.979 1.709
188 HA LYS 20 HA LYS 20 -12.445 1.371 2.874
189 HB2 LYS 20 HB2 LYS 20 -9.835 2.849 3.250
190 HB3 LYS 20 HB3 LYS 20 -11.320 3.233 4.109
191 HG2 LYS 20 HG2 LYS 20 -11.325 1.024 5.126
192 HG3 LYS 20 HG3 LYS 20 -9.861 0.604 4.239
193 HD2 LYS 20 HD2 LYS 20 -9.204 1.198 6.455
194 HD3 LYS 20 HD3 LYS 20 -8.719 2.514 5.389
195 HE2 LYS 20 HE2 LYS 20 -11.326 2.581 6.880
196 HE3 LYS 20 HE3 LYS 20 -9.823 3.099 7.637
197 HZ1 LYS 20 HZ1 LYS 20 -11.037 4.254 5.181
198 HZ2 LYS 20 HZ2 LYS 20 -9.547 4.721 5.843
199 HZ3 LYS 20 HZ3 LYS 20 -10.983 4.976 6.712
200 H LEU 21 H LEU 21 -11.321 2.033 -0.041
201 HA LEU 21 HA LEU 21 -11.936 4.838 -0.263
202 HB2 LEU 21 HB2 LEU 21 -10.209 3.760 -1.661
203 HB3 LEU 21 HB3 LEU 21 -11.448 2.774 -2.414
204 HG LEU 21 HG LEU 21 -12.502 4.822 -3.318
205 HD11 LEU 21 HD11 LEU 21 -10.080 6.202 -2.171
206 HD12 LEU 21 HD12 LEU 21 -11.748 6.414 -1.642
207 HD13 LEU 21 HD13 LEU 21 -11.266 6.931 -3.256
208 HD21 LEU 21 HD21 LEU 21 -10.787 5.277 -5.004
209 HD22 LEU 21 HD22 LEU 21 -10.944 3.553 -4.679
210 HD23 LEU 21 HD23 LEU 21 -9.590 4.456 -4.001
211 H LYS 22 H LYS 22 -13.460 1.800 -1.304
212 HA LYS 22 HA LYS 22 -15.961 3.290 -1.696
213 HB2 LYS 22 HB2 LYS 22 -14.801 1.255 -3.607
214 HB3 LYS 22 HB3 LYS 22 -16.427 1.916 -3.718
215 HG2 LYS 22 HG2 LYS 22 -15.482 4.160 -3.998
216 HG3 LYS 22 HG3 LYS 22 -13.858 3.468 -3.942
217 HD2 LYS 22 HD2 LYS 22 -14.337 2.154 -5.933
218 HD3 LYS 22 HD3 LYS 22 -15.985 2.788 -5.969
219 HE2 LYS 22 HE2 LYS 22 -13.468 4.427 -6.226
220 HE3 LYS 22 HE3 LYS 22 -14.516 3.947 -7.559
221 HZ1 LYS 22 HZ1 LYS 22 -16.305 5.219 -6.600
222 HZ2 LYS 22 HZ2 LYS 22 -14.949 6.218 -6.802
223 HZ3 LYS 22 HZ3 LYS 22 -15.353 5.637 -5.260
224 H LYS 23 H LYS 23 -15.157 1.689 0.535
225 HA LYS 23 HA LYS 23 -17.302 -0.290 0.380
226 HB2 LYS 23 HB2 LYS 23 -14.505 -0.766 1.359
227 HB3 LYS 23 HB3 LYS 23 -15.852 -1.728 1.958
228 HG2 LYS 23 HG2 LYS 23 -16.339 -2.537 -0.230
229 HG3 LYS 23 HG3 LYS 23 -15.178 -1.428 -0.958
230 HD2 LYS 23 HD2 LYS 23 -13.347 -2.590 0.065
231 HD3 LYS 23 HD3 LYS 23 -14.450 -3.600 1.000
232 HE2 LYS 23 HE2 LYS 23 -13.489 -4.755 -0.962
233 HE3 LYS 23 HE3 LYS 23 -15.248 -4.668 -1.004
234 HZ1 LYS 23 HZ1 LYS 23 -15.134 -2.897 -2.590
235 HZ2 LYS 23 HZ2 LYS 23 -14.168 -4.177 -3.149
236 HZ3 LYS 23 HZ3 LYS 23 -13.444 -2.808 -2.462
237 H ALA 24 H ALA 24 -18.751 0.724 1.556
238 HA ALA 24 HA ALA 24 -18.276 0.919 4.405
239 HB1 ALA 24 HB1 ALA 24 -19.191 3.191 4.579
240 HB2 ALA 24 HB2 ALA 24 -19.256 3.302 2.820
241 HB3 ALA 24 HB3 ALA 24 -17.697 3.172 3.638
Start of MODEL 8
1 H1 LYS 1 H1 LYS 1 10.109 5.548 2.717
2 H2 LYS 1 H2 LYS 1 11.708 6.111 2.850
3 H3 LYS 1 H3 LYS 1 11.231 4.707 3.667
4 HA LYS 1 HA LYS 1 10.875 3.549 1.607
5 HB2 LYS 1 HB2 LYS 1 11.630 4.623 -0.511
6 HB3 LYS 1 HB3 LYS 1 10.210 5.381 0.189
7 HG2 LYS 1 HG2 LYS 1 11.487 7.236 0.968
8 HG3 LYS 1 HG3 LYS 1 13.003 6.440 0.543
9 HD2 LYS 1 HD2 LYS 1 12.462 8.109 -1.121
10 HD3 LYS 1 HD3 LYS 1 12.337 6.499 -1.830
11 HE2 LYS 1 HE2 LYS 1 10.476 7.828 -2.571
12 HE3 LYS 1 HE3 LYS 1 9.892 6.581 -1.471
13 HZ1 LYS 1 HZ1 LYS 1 8.892 8.770 -1.065
14 HZ2 LYS 1 HZ2 LYS 1 10.425 9.399 -0.693
15 HZ3 LYS 1 HZ3 LYS 1 9.741 8.193 0.286
16 H LYS 2 H LYS 2 12.586 3.117 3.491
17 HA LYS 2 HA LYS 2 15.295 3.670 3.029
18 HB2 LYS 2 HB2 LYS 2 14.264 2.746 5.133
19 HB3 LYS 2 HB3 LYS 2 14.175 1.185 4.330
20 HG2 LYS 2 HG2 LYS 2 16.560 1.073 4.154
21 HG3 LYS 2 HG3 LYS 2 16.725 2.718 4.770
22 HD2 LYS 2 HD2 LYS 2 15.657 1.964 6.890
23 HD3 LYS 2 HD3 LYS 2 15.700 0.311 6.270
24 HE2 LYS 2 HE2 LYS 2 18.125 0.413 6.117
25 HE3 LYS 2 HE3 LYS 2 18.105 2.093 6.648
26 HZ1 LYS 2 HZ1 LYS 2 17.261 -0.262 8.251
27 HZ2 LYS 2 HZ2 LYS 2 17.155 1.350 8.762
28 HZ3 LYS 2 HZ3 LYS 2 18.672 0.653 8.468
29 H LEU 3 H LEU 3 16.331 3.233 1.228
30 HA LEU 3 HA LEU 3 17.157 2.193 -0.603
31 HB2 LEU 3 HB2 LEU 3 16.395 -0.327 0.876
32 HB3 LEU 3 HB3 LEU 3 17.453 -0.250 -0.521
33 HG LEU 3 HG LEU 3 18.013 0.976 2.184
34 HD11 LEU 3 HD11 LEU 3 18.167 -1.454 2.207
35 HD12 LEU 3 HD12 LEU 3 19.766 -0.722 2.335
36 HD13 LEU 3 HD13 LEU 3 19.233 -1.410 0.801
37 HD21 LEU 3 HD21 LEU 3 19.729 0.843 -0.293
38 HD22 LEU 3 HD22 LEU 3 20.227 1.469 1.279
39 HD23 LEU 3 HD23 LEU 3 18.966 2.292 0.360
40 H LYS 4 H LYS 4 14.257 2.806 -0.303
41 HA LYS 4 HA LYS 4 12.269 2.580 -1.345
42 HB2 LYS 4 HB2 LYS 4 14.129 1.580 -3.470
43 HB3 LYS 4 HB3 LYS 4 12.391 1.517 -3.717
44 HG2 LYS 4 HG2 LYS 4 13.170 3.516 -4.716
45 HG3 LYS 4 HG3 LYS 4 12.316 3.970 -3.242
46 HD2 LYS 4 HD2 LYS 4 14.303 5.282 -3.354
47 HD3 LYS 4 HD3 LYS 4 14.542 4.069 -2.094
48 HE2 LYS 4 HE2 LYS 4 16.546 4.221 -3.413
49 HE3 LYS 4 HE3 LYS 4 15.766 2.674 -3.740
50 HZ1 LYS 4 HZ1 LYS 4 15.550 5.094 -5.450
51 HZ2 LYS 4 HZ2 LYS 4 14.869 3.575 -5.781
52 HZ3 LYS 4 HZ3 LYS 4 16.554 3.764 -5.765
53 H LEU 5 H LEU 5 13.599 0.209 0.151
54 HA LEU 5 HA LEU 5 12.067 -2.026 -0.899
55 HB2 LEU 5 HB2 LEU 5 14.350 -2.362 0.031
56 HB3 LEU 5 HB3 LEU 5 13.767 -1.830 1.595
57 HG LEU 5 HG LEU 5 12.231 -3.772 1.661
58 HD11 LEU 5 HD11 LEU 5 12.531 -5.592 0.061
59 HD12 LEU 5 HD12 LEU 5 13.663 -4.603 -0.861
60 HD13 LEU 5 HD13 LEU 5 11.970 -4.123 -0.737
61 HD21 LEU 5 HD21 LEU 5 14.409 -3.897 2.738
62 HD22 LEU 5 HD22 LEU 5 15.137 -4.448 1.228
63 HD23 LEU 5 HD23 LEU 5 13.956 -5.460 2.060
64 H ALA 6 H ALA 6 12.203 -0.015 2.001
65 HA ALA 6 HA ALA 6 9.604 -0.919 2.889
66 HB1 ALA 6 HB1 ALA 6 11.319 -0.285 4.526
67 HB2 ALA 6 HB2 ALA 6 9.880 0.725 4.676
68 HB3 ALA 6 HB3 ALA 6 11.323 1.358 3.883
69 H LEU 7 H LEU 7 9.338 -0.159 0.368
70 HA LEU 7 HA LEU 7 7.574 2.147 0.565
71 HB2 LEU 7 HB2 LEU 7 9.689 3.125 -0.169
72 HB3 LEU 7 HB3 LEU 7 9.802 1.953 -1.468
73 HG LEU 7 HG LEU 7 7.688 2.932 -2.420
74 HD11 LEU 7 HD11 LEU 7 8.218 5.070 -0.366
75 HD12 LEU 7 HD12 LEU 7 6.840 3.970 -0.391
76 HD13 LEU 7 HD13 LEU 7 7.038 5.165 -1.674
77 HD21 LEU 7 HD21 LEU 7 10.035 4.804 -2.137
78 HD22 LEU 7 HD22 LEU 7 8.797 4.873 -3.391
79 HD23 LEU 7 HD23 LEU 7 9.895 3.496 -3.311
80 H ALA 8 H ALA 8 9.018 0.147 -2.003
81 HA ALA 8 HA ALA 8 6.369 -0.281 -3.135
82 HB1 ALA 8 HB1 ALA 8 9.089 -1.023 -4.211
83 HB2 ALA 8 HB2 ALA 8 8.176 0.427 -4.629
84 HB3 ALA 8 HB3 ALA 8 7.557 -1.163 -5.076
85 H LYS 9 H LYS 9 6.795 -1.536 -0.693
86 HA LYS 9 HA LYS 9 7.566 -4.275 -1.150
87 HB2 LYS 9 HB2 LYS 9 8.062 -3.097 0.978
88 HB3 LYS 9 HB3 LYS 9 6.339 -2.992 1.301
89 HG2 LYS 9 HG2 LYS 9 6.193 -5.419 1.401
90 HG3 LYS 9 HG3 LYS 9 7.914 -5.543 1.036
91 HD2 LYS 9 HD2 LYS 9 8.466 -4.382 3.093
92 HD3 LYS 9 HD3 LYS 9 6.753 -4.153 3.448
93 HE2 LYS 9 HE2 LYS 9 7.682 -6.011 4.736
94 HE3 LYS 9 HE3 LYS 9 6.454 -6.571 3.600
95 HZ1 LYS 9 HZ1 LYS 9 8.264 -8.071 3.482
96 HZ2 LYS 9 HZ2 LYS 9 9.402 -6.822 3.347
97 HZ3 LYS 9 HZ3 LYS 9 8.336 -7.137 2.068
98 H LEU 10 H LEU 10 5.886 -4.407 -2.894
99 HA LEU 10 HA LEU 10 4.029 -5.412 -3.704
100 HB2 LEU 10 HB2 LEU 10 3.883 -6.357 -0.858
101 HB3 LEU 10 HB3 LEU 10 2.620 -6.751 -2.004
102 HG LEU 10 HG LEU 10 4.326 -7.862 -3.441
103 HD11 LEU 10 HD11 LEU 10 6.155 -7.426 -1.082
104 HD12 LEU 10 HD12 LEU 10 6.316 -6.667 -2.666
105 HD13 LEU 10 HD13 LEU 10 6.503 -8.413 -2.501
106 HD21 LEU 10 HD21 LEU 10 2.953 -9.160 -1.931
107 HD22 LEU 10 HD22 LEU 10 4.086 -8.869 -0.612
108 HD23 LEU 10 HD23 LEU 10 4.580 -9.835 -2.003
109 H ALA 11 H ALA 11 3.989 -2.689 -2.496
110 HA ALA 11 HA ALA 11 2.572 -0.957 -2.126
111 HB1 ALA 11 HB1 ALA 11 0.681 -2.668 -3.730
112 HB2 ALA 11 HB2 ALA 11 1.903 -1.583 -4.390
113 HB3 ALA 11 HB3 ALA 11 0.549 -0.927 -3.471
114 HA PRO 12 HA PRO 12 0.416 -3.373 1.279
115 HB2 PRO 12 HB2 PRO 12 1.532 -2.052 3.378
116 HB3 PRO 12 HB3 PRO 12 2.270 -3.469 2.623
117 HG2 PRO 12 HG2 PRO 12 2.900 -0.572 2.245
118 HG3 PRO 12 HG3 PRO 12 4.005 -1.951 2.374
119 HD2 PRO 12 HD2 PRO 12 3.347 -0.809 0.001
120 HD3 PRO 12 HD3 PRO 12 3.742 -2.532 0.164
121 H LEU 13 H LEU 13 0.996 0.070 0.871
122 HA LEU 13 HA LEU 13 -1.173 0.861 2.573
123 HB2 LEU 13 HB2 LEU 13 -0.681 3.120 1.915
124 HB3 LEU 13 HB3 LEU 13 0.822 2.286 2.250
125 HG LEU 13 HG LEU 13 -0.223 2.668 -0.556
126 HD11 LEU 13 HD11 LEU 13 0.051 4.854 0.502
127 HD12 LEU 13 HD12 LEU 13 1.273 4.576 -0.738
128 HD13 LEU 13 HD13 LEU 13 1.697 4.425 0.968
129 HD21 LEU 13 HD21 LEU 13 1.463 0.933 -0.294
130 HD22 LEU 13 HD22 LEU 13 2.522 2.066 0.544
131 HD23 LEU 13 HD23 LEU 13 2.129 2.318 -1.157
132 H TRP 14 H TRP 14 -0.868 -0.131 -0.671
133 HA TRP 14 HA TRP 14 -3.067 1.352 -1.741
134 HB2 TRP 14 HB2 TRP 14 -1.187 0.463 -3.126
135 HB3 TRP 14 HB3 TRP 14 -1.789 -1.165 -2.829
136 HD1 TRP 14 HD1 TRP 14 -3.454 2.108 -4.126
137 HE1 TRP 14 HE1 TRP 14 -4.871 1.511 -6.195
138 HE3 TRP 14 HE3 TRP 14 -2.505 -2.913 -4.322
139 HZ2 TRP 14 HZ2 TRP 14 -5.486 -0.795 -7.706
140 HZ3 TRP 14 HZ3 TRP 14 -3.546 -4.241 -6.110
141 HH2 TRP 14 HH2 TRP 14 -5.008 -3.200 -7.766
142 H LYS 15 H LYS 15 -2.635 -1.744 -0.195
143 HA LYS 15 HA LYS 15 -5.081 -2.961 -0.699
144 HB2 LYS 15 HB2 LYS 15 -3.364 -2.951 1.783
145 HB3 LYS 15 HB3 LYS 15 -4.789 -3.966 1.614
146 HG2 LYS 15 HG2 LYS 15 -3.790 -5.126 -0.250
147 HG3 LYS 15 HG3 LYS 15 -2.394 -4.047 -0.208
148 HD2 LYS 15 HD2 LYS 15 -1.914 -6.205 0.860
149 HD3 LYS 15 HD3 LYS 15 -1.797 -4.866 2.001
150 HE2 LYS 15 HE2 LYS 15 -2.933 -6.781 3.004
151 HE3 LYS 15 HE3 LYS 15 -4.022 -5.402 2.865
152 HZ1 LYS 15 HZ1 LYS 15 -3.932 -7.527 0.813
153 HZ2 LYS 15 HZ2 LYS 15 -5.161 -6.391 1.099
154 HZ3 LYS 15 HZ3 LYS 15 -4.911 -7.664 2.189
155 H ALA 16 H ALA 16 -4.242 -0.863 2.054
156 HA ALA 16 HA ALA 16 -7.064 -0.487 2.647
157 HB1 ALA 16 HB1 ALA 16 -4.591 0.522 4.060
158 HB2 ALA 16 HB2 ALA 16 -5.548 -0.891 4.505
159 HB3 ALA 16 HB3 ALA 16 -6.248 0.722 4.631
160 H LEU 17 H LEU 17 -6.183 0.517 0.187
161 HA LEU 17 HA LEU 17 -6.665 3.387 0.625
162 HB2 LEU 17 HB2 LEU 17 -4.418 3.006 -0.272
163 HB3 LEU 17 HB3 LEU 17 -5.092 2.076 -1.595
164 HG LEU 17 HG LEU 17 -6.239 4.114 -2.412
165 HD11 LEU 17 HD11 LEU 17 -4.685 5.471 -0.213
166 HD12 LEU 17 HD12 LEU 17 -6.440 5.318 -0.313
167 HD13 LEU 17 HD13 LEU 17 -5.570 6.290 -1.499
168 HD21 LEU 17 HD21 LEU 17 -3.258 4.355 -2.046
169 HD22 LEU 17 HD22 LEU 17 -4.220 5.240 -3.229
170 HD23 LEU 17 HD23 LEU 17 -4.088 3.484 -3.335
171 H ALA 18 H ALA 18 -6.971 0.778 -1.782
172 HA ALA 18 HA ALA 18 -9.232 2.187 -2.959
173 HB1 ALA 18 HB1 ALA 18 -7.810 -0.300 -3.902
174 HB2 ALA 18 HB2 ALA 18 -7.476 1.344 -4.445
175 HB3 ALA 18 HB3 ALA 18 -9.036 0.600 -4.794
176 H LEU 19 H LEU 19 -8.820 -0.039 -0.551
177 HA LEU 19 HA LEU 19 -11.200 -1.583 -1.201
178 HB2 LEU 19 HB2 LEU 19 -9.269 -2.724 -0.210
179 HB3 LEU 19 HB3 LEU 19 -9.370 -1.685 1.198
180 HG LEU 19 HG LEU 19 -11.612 -2.640 1.694
181 HD11 LEU 19 HD11 LEU 19 -12.299 -4.689 0.565
182 HD12 LEU 19 HD12 LEU 19 -10.927 -4.553 -0.534
183 HD13 LEU 19 HD13 LEU 19 -12.207 -3.340 -0.568
184 HD21 LEU 19 HD21 LEU 19 -10.784 -4.769 2.531
185 HD22 LEU 19 HD22 LEU 19 -9.597 -3.491 2.786
186 HD23 LEU 19 HD23 LEU 19 -9.377 -4.651 1.475
187 H LYS 20 H LYS 20 -10.075 0.518 1.447
188 HA LYS 20 HA LYS 20 -12.775 0.472 2.547
189 HB2 LYS 20 HB2 LYS 20 -10.180 1.502 3.692
190 HB3 LYS 20 HB3 LYS 20 -11.728 1.577 4.524
191 HG2 LYS 20 HG2 LYS 20 -10.319 -0.941 3.647
192 HG3 LYS 20 HG3 LYS 20 -10.404 -0.312 5.294
193 HD2 LYS 20 HD2 LYS 20 -12.800 -0.598 5.326
194 HD3 LYS 20 HD3 LYS 20 -12.797 -1.089 3.632
195 HE2 LYS 20 HE2 LYS 20 -12.996 -3.032 5.047
196 HE3 LYS 20 HE3 LYS 20 -11.438 -3.051 4.229
197 HZ1 LYS 20 HZ1 LYS 20 -10.373 -2.296 6.231
198 HZ2 LYS 20 HZ2 LYS 20 -11.304 -3.669 6.586
199 HZ3 LYS 20 HZ3 LYS 20 -11.867 -2.129 7.018
200 H LEU 21 H LEU 21 -11.155 2.369 0.408
201 HA LEU 21 HA LEU 21 -12.620 4.779 1.202
202 HB2 LEU 21 HB2 LEU 21 -10.210 4.959 0.539
203 HB3 LEU 21 HB3 LEU 21 -10.658 4.424 -1.068
204 HG LEU 21 HG LEU 21 -12.081 6.441 -1.311
205 HD11 LEU 21 HD11 LEU 21 -11.812 8.271 0.299
206 HD12 LEU 21 HD12 LEU 21 -10.864 7.207 1.338
207 HD13 LEU 21 HD13 LEU 21 -12.564 6.854 1.030
208 HD21 LEU 21 HD21 LEU 21 -10.246 8.016 -1.597
209 HD22 LEU 21 HD22 LEU 21 -9.775 6.407 -2.147
210 HD23 LEU 21 HD23 LEU 21 -9.207 7.009 -0.589
211 H LYS 22 H LYS 22 -13.397 2.072 -0.161
212 HA LYS 22 HA LYS 22 -15.175 3.320 -2.149
213 HB2 LYS 22 HB2 LYS 22 -13.469 1.872 -3.224
214 HB3 LYS 22 HB3 LYS 22 -14.033 0.518 -2.254
215 HG2 LYS 22 HG2 LYS 22 -16.225 0.667 -3.325
216 HG3 LYS 22 HG3 LYS 22 -15.655 2.022 -4.297
217 HD2 LYS 22 HD2 LYS 22 -14.317 -0.671 -4.335
218 HD3 LYS 22 HD3 LYS 22 -15.666 -0.275 -5.396
219 HE2 LYS 22 HE2 LYS 22 -13.692 0.096 -6.645
220 HE3 LYS 22 HE3 LYS 22 -14.309 1.685 -6.207
221 HZ1 LYS 22 HZ1 LYS 22 -11.875 1.419 -5.947
222 HZ2 LYS 22 HZ2 LYS 22 -12.153 0.282 -4.728
223 HZ3 LYS 22 HZ3 LYS 22 -12.655 1.888 -4.520
224 H LYS 23 H LYS 23 -14.766 0.420 -0.129
225 HA LYS 23 HA LYS 23 -17.516 0.768 0.797
226 HB2 LYS 23 HB2 LYS 23 -16.275 -1.861 -0.039
227 HB3 LYS 23 HB3 LYS 23 -17.816 -1.697 0.788
228 HG2 LYS 23 HG2 LYS 23 -18.647 -0.371 -1.140
229 HG3 LYS 23 HG3 LYS 23 -17.131 -0.722 -1.974
230 HD2 LYS 23 HD2 LYS 23 -18.845 -2.277 -2.687
231 HD3 LYS 23 HD3 LYS 23 -17.607 -3.135 -1.766
232 HE2 LYS 23 HE2 LYS 23 -19.044 -3.033 0.226
233 HE3 LYS 23 HE3 LYS 23 -20.280 -2.202 -0.716
234 HZ1 LYS 23 HZ1 LYS 23 -20.359 -4.178 -2.176
235 HZ2 LYS 23 HZ2 LYS 23 -20.831 -4.501 -0.580
236 HZ3 LYS 23 HZ3 LYS 23 -19.299 -4.975 -1.117
237 H ALA 24 H ALA 24 -17.854 -0.822 2.734
238 HA ALA 24 HA ALA 24 -15.494 -1.380 4.278
239 HB1 ALA 24 HB1 ALA 24 -17.430 0.707 5.276
240 HB2 ALA 24 HB2 ALA 24 -15.780 1.009 4.732
241 HB3 ALA 24 HB3 ALA 24 -16.068 0.037 6.175
Start of MODEL 9
1 H1 LYS 1 H1 LYS 1 5.923 0.733 -16.843
2 H2 LYS 1 H2 LYS 1 4.303 1.177 -16.659
3 H3 LYS 1 H3 LYS 1 4.711 -0.442 -16.959
4 HA LYS 1 HA LYS 1 5.779 -0.646 -14.849
5 HB2 LYS 1 HB2 LYS 1 4.941 2.225 -14.379
6 HB3 LYS 1 HB3 LYS 1 5.795 1.189 -13.247
7 HG2 LYS 1 HG2 LYS 1 7.709 1.106 -14.771
8 HG3 LYS 1 HG3 LYS 1 6.855 2.172 -15.888
9 HD2 LYS 1 HD2 LYS 1 8.374 3.515 -14.625
10 HD3 LYS 1 HD3 LYS 1 6.744 3.869 -14.040
11 HE2 LYS 1 HE2 LYS 1 7.082 2.411 -12.138
12 HE3 LYS 1 HE3 LYS 1 8.673 1.949 -12.745
13 HZ1 LYS 1 HZ1 LYS 1 9.324 4.316 -12.543
14 HZ2 LYS 1 HZ2 LYS 1 8.953 3.580 -11.061
15 HZ3 LYS 1 HZ3 LYS 1 7.837 4.630 -11.784
16 H LYS 2 H LYS 2 2.821 1.130 -15.624
17 HA LYS 2 HA LYS 2 1.480 0.105 -13.258
18 HB2 LYS 2 HB2 LYS 2 0.452 1.878 -15.484
19 HB3 LYS 2 HB3 LYS 2 -0.423 1.483 -14.011
20 HG2 LYS 2 HG2 LYS 2 1.319 2.605 -12.691
21 HG3 LYS 2 HG3 LYS 2 2.165 3.016 -14.183
22 HD2 LYS 2 HD2 LYS 2 -0.634 3.892 -13.463
23 HD3 LYS 2 HD3 LYS 2 0.814 4.892 -13.338
24 HE2 LYS 2 HE2 LYS 2 1.159 4.679 -15.757
25 HE3 LYS 2 HE3 LYS 2 -0.298 3.694 -15.872
26 HZ1 LYS 2 HZ1 LYS 2 -0.212 6.512 -14.930
27 HZ2 LYS 2 HZ2 LYS 2 -1.606 5.558 -15.112
28 HZ3 LYS 2 HZ3 LYS 2 -0.705 6.009 -16.473
29 H LEU 3 H LEU 3 2.125 -2.069 -14.674
30 HA LEU 3 HA LEU 3 -0.484 -2.883 -15.784
31 HB2 LEU 3 HB2 LEU 3 2.267 -3.881 -16.516
32 HB3 LEU 3 HB3 LEU 3 0.779 -4.656 -17.028
33 HG LEU 3 HG LEU 3 1.697 -1.878 -17.780
34 HD11 LEU 3 HD11 LEU 3 1.384 -4.395 -19.416
35 HD12 LEU 3 HD12 LEU 3 2.912 -3.682 -18.900
36 HD13 LEU 3 HD13 LEU 3 1.871 -2.813 -20.025
37 HD21 LEU 3 HD21 LEU 3 -0.799 -3.382 -18.573
38 HD22 LEU 3 HD22 LEU 3 -0.269 -1.836 -19.237
39 HD23 LEU 3 HD23 LEU 3 -0.727 -1.955 -17.539
40 H LYS 4 H LYS 4 2.443 -4.504 -14.545
41 HA LYS 4 HA LYS 4 0.684 -5.921 -12.666
42 HB2 LYS 4 HB2 LYS 4 2.305 -7.876 -12.915
43 HB3 LYS 4 HB3 LYS 4 1.188 -7.576 -14.236
44 HG2 LYS 4 HG2 LYS 4 3.112 -6.262 -15.306
45 HG3 LYS 4 HG3 LYS 4 4.135 -7.077 -14.122
46 HD2 LYS 4 HD2 LYS 4 3.432 -9.245 -14.940
47 HD3 LYS 4 HD3 LYS 4 2.291 -8.488 -16.051
48 HE2 LYS 4 HE2 LYS 4 4.111 -9.019 -17.402
49 HE3 LYS 4 HE3 LYS 4 4.346 -7.311 -17.044
50 HZ1 LYS 4 HZ1 LYS 4 5.734 -9.617 -15.797
51 HZ2 LYS 4 HZ2 LYS 4 5.867 -8.027 -15.231
52 HZ3 LYS 4 HZ3 LYS 4 6.415 -8.421 -16.790
53 H LEU 5 H LEU 5 3.378 -3.932 -13.016
54 HA LEU 5 HA LEU 5 4.596 -4.701 -10.519
55 HB2 LEU 5 HB2 LEU 5 4.960 -2.293 -12.291
56 HB3 LEU 5 HB3 LEU 5 5.829 -2.517 -10.785
57 HG LEU 5 HG LEU 5 5.999 -4.311 -13.206
58 HD11 LEU 5 HD11 LEU 5 7.120 -2.158 -13.506
59 HD12 LEU 5 HD12 LEU 5 8.283 -3.477 -13.378
60 HD13 LEU 5 HD13 LEU 5 8.005 -2.408 -12.002
61 HD21 LEU 5 HD21 LEU 5 6.225 -5.550 -11.113
62 HD22 LEU 5 HD22 LEU 5 7.475 -4.424 -10.584
63 HD23 LEU 5 HD23 LEU 5 7.758 -5.463 -11.981
64 H ALA 6 H ALA 6 2.459 -2.123 -11.651
65 HA ALA 6 HA ALA 6 2.209 -0.975 -9.019
66 HB1 ALA 6 HB1 ALA 6 0.638 -0.425 -11.535
67 HB2 ALA 6 HB2 ALA 6 2.098 0.423 -11.025
68 HB3 ALA 6 HB3 ALA 6 0.625 0.550 -10.063
69 H LEU 7 H LEU 7 1.562 -3.699 -9.049
70 HA LEU 7 HA LEU 7 -1.175 -3.559 -8.052
71 HB2 LEU 7 HB2 LEU 7 -0.984 -4.428 -10.515
72 HB3 LEU 7 HB3 LEU 7 -0.371 -5.887 -9.765
73 HG LEU 7 HG LEU 7 -3.070 -4.693 -9.123
74 HD11 LEU 7 HD11 LEU 7 -2.364 -6.911 -11.034
75 HD12 LEU 7 HD12 LEU 7 -2.991 -5.320 -11.465
76 HD13 LEU 7 HD13 LEU 7 -3.997 -6.448 -10.555
77 HD21 LEU 7 HD21 LEU 7 -3.544 -6.878 -8.171
78 HD22 LEU 7 HD22 LEU 7 -2.130 -6.165 -7.392
79 HD23 LEU 7 HD23 LEU 7 -1.927 -7.436 -8.598
80 H ALA 8 H ALA 8 -0.229 -3.672 -6.025
81 HA ALA 8 HA ALA 8 0.197 -4.754 -4.081
82 HB1 ALA 8 HB1 ALA 8 -1.152 -6.612 -4.891
83 HB2 ALA 8 HB2 ALA 8 0.235 -7.197 -3.972
84 HB3 ALA 8 HB3 ALA 8 0.247 -7.276 -5.734
85 H LYS 9 H LYS 9 2.217 -5.493 -6.832
86 HA LYS 9 HA LYS 9 4.443 -6.419 -5.326
87 HB2 LYS 9 HB2 LYS 9 4.422 -5.280 -8.125
88 HB3 LYS 9 HB3 LYS 9 5.686 -6.272 -7.411
89 HG2 LYS 9 HG2 LYS 9 2.857 -7.155 -7.973
90 HG3 LYS 9 HG3 LYS 9 4.281 -7.561 -8.933
91 HD2 LYS 9 HD2 LYS 9 5.237 -8.773 -7.072
92 HD3 LYS 9 HD3 LYS 9 3.906 -8.283 -6.025
93 HE2 LYS 9 HE2 LYS 9 3.553 -10.554 -6.756
94 HE3 LYS 9 HE3 LYS 9 2.342 -9.506 -7.493
95 HZ1 LYS 9 HZ1 LYS 9 4.803 -10.521 -8.816
96 HZ2 LYS 9 HZ2 LYS 9 3.660 -9.493 -9.532
97 HZ3 LYS 9 HZ3 LYS 9 3.224 -11.069 -9.095
98 H LEU 10 H LEU 10 4.233 -3.446 -7.291
99 HA LEU 10 HA LEU 10 6.045 -2.161 -5.365
100 HB2 LEU 10 HB2 LEU 10 5.428 -1.523 -8.249
101 HB3 LEU 10 HB3 LEU 10 6.391 -0.487 -7.215
102 HG LEU 10 HG LEU 10 7.086 -3.315 -8.013
103 HD11 LEU 10 HD11 LEU 10 8.273 -0.662 -8.816
104 HD12 LEU 10 HD12 LEU 10 7.327 -1.737 -9.846
105 HD13 LEU 10 HD13 LEU 10 8.910 -2.246 -9.255
106 HD21 LEU 10 HD21 LEU 10 9.227 -2.863 -6.904
107 HD22 LEU 10 HD22 LEU 10 7.878 -2.812 -5.769
108 HD23 LEU 10 HD23 LEU 10 8.604 -1.311 -6.345
109 H ALA 11 H ALA 11 2.989 -2.508 -5.409
110 HA ALA 11 HA ALA 11 2.439 0.207 -4.518
111 HB1 ALA 11 HB1 ALA 11 1.776 0.244 -6.868
112 HB2 ALA 11 HB2 ALA 11 0.370 0.382 -5.811
113 HB3 ALA 11 HB3 ALA 11 0.732 -1.153 -6.602
114 HA PRO 12 HA PRO 12 0.364 -3.100 -2.001
115 HB2 PRO 12 HB2 PRO 12 2.110 -2.714 0.204
116 HB3 PRO 12 HB3 PRO 12 2.079 -4.084 -0.905
117 HG2 PRO 12 HG2 PRO 12 4.149 -2.232 -0.676
118 HG3 PRO 12 HG3 PRO 12 3.901 -3.343 -2.033
119 HD2 PRO 12 HD2 PRO 12 3.186 -0.457 -1.788
120 HD3 PRO 12 HD3 PRO 12 3.770 -1.361 -3.202
121 H LEU 13 H LEU 13 0.427 0.039 -2.171
122 HA LEU 13 HA LEU 13 -0.374 0.770 0.511
123 HB2 LEU 13 HB2 LEU 13 -0.410 2.390 -2.034
124 HB3 LEU 13 HB3 LEU 13 -0.659 3.017 -0.416
125 HG LEU 13 HG LEU 13 1.904 1.790 -1.439
126 HD11 LEU 13 HD11 LEU 13 1.193 4.661 -0.847
127 HD12 LEU 13 HD12 LEU 13 1.422 3.958 -2.448
128 HD13 LEU 13 HD13 LEU 13 2.781 4.061 -1.327
129 HD21 LEU 13 HD21 LEU 13 2.861 2.599 0.667
130 HD22 LEU 13 HD22 LEU 13 1.592 1.406 0.947
131 HD23 LEU 13 HD23 LEU 13 1.260 3.121 1.193
132 H TRP 14 H TRP 14 -1.859 0.171 -2.610
133 HA TRP 14 HA TRP 14 -4.327 1.403 -2.147
134 HB2 TRP 14 HB2 TRP 14 -3.631 -0.897 -3.982
135 HB3 TRP 14 HB3 TRP 14 -5.146 -0.003 -4.028
136 HD1 TRP 14 HD1 TRP 14 -1.758 -0.001 -5.481
137 HE1 TRP 14 HE1 TRP 14 -1.339 2.174 -6.795
138 HE3 TRP 14 HE3 TRP 14 -5.730 2.736 -3.801
139 HZ2 TRP 14 HZ2 TRP 14 -2.532 4.714 -7.078
140 HZ3 TRP 14 HZ3 TRP 14 -6.018 5.032 -4.640
141 HH2 TRP 14 HH2 TRP 14 -4.452 5.997 -6.243
142 H LYS 15 H LYS 15 -3.112 -1.676 -1.092
143 HA LYS 15 HA LYS 15 -5.606 -2.980 -0.748
144 HB2 LYS 15 HB2 LYS 15 -4.383 -4.606 0.593
145 HB3 LYS 15 HB3 LYS 15 -3.507 -4.225 -0.882
146 HG2 LYS 15 HG2 LYS 15 -1.969 -2.833 0.322
147 HG3 LYS 15 HG3 LYS 15 -2.901 -3.025 1.810
148 HD2 LYS 15 HD2 LYS 15 -2.411 -5.412 1.819
149 HD3 LYS 15 HD3 LYS 15 -1.521 -5.249 0.304
150 HE2 LYS 15 HE2 LYS 15 0.102 -3.812 1.390
151 HE3 LYS 15 HE3 LYS 15 -0.808 -3.885 2.900
152 HZ1 LYS 15 HZ1 LYS 15 1.093 -5.411 2.874
153 HZ2 LYS 15 HZ2 LYS 15 0.428 -6.218 1.541
154 HZ3 LYS 15 HZ3 LYS 15 -0.383 -6.235 3.033
155 H ALA 16 H ALA 16 -4.206 -0.423 0.947
156 HA ALA 16 HA ALA 16 -6.327 -0.689 2.944
157 HB1 ALA 16 HB1 ALA 16 -4.297 -1.471 4.053
158 HB2 ALA 16 HB2 ALA 16 -4.839 0.060 4.741
159 HB3 ALA 16 HB3 ALA 16 -3.472 0.029 3.626
160 H LEU 17 H LEU 17 -5.654 0.883 0.464
161 HA LEU 17 HA LEU 17 -6.163 3.546 1.613
162 HB2 LEU 17 HB2 LEU 17 -3.950 3.430 0.545
163 HB3 LEU 17 HB3 LEU 17 -4.695 2.886 -0.944
164 HG LEU 17 HG LEU 17 -5.883 5.051 -1.115
165 HD11 LEU 17 HD11 LEU 17 -5.174 6.910 0.305
166 HD12 LEU 17 HD12 LEU 17 -4.195 5.803 1.269
167 HD13 LEU 17 HD13 LEU 17 -5.952 5.636 1.245
168 HD21 LEU 17 HD21 LEU 17 -2.886 5.249 -0.857
169 HD22 LEU 17 HD22 LEU 17 -3.925 6.375 -1.731
170 HD23 LEU 17 HD23 LEU 17 -3.775 4.706 -2.281
171 H ALA 18 H ALA 18 -6.801 1.264 -0.987
172 HA ALA 18 HA ALA 18 -9.135 2.864 -1.779
173 HB1 ALA 18 HB1 ALA 18 -9.091 1.662 -3.885
174 HB2 ALA 18 HB2 ALA 18 -7.768 0.650 -3.308
175 HB3 ALA 18 HB3 ALA 18 -7.510 2.375 -3.563
176 H LEU 19 H LEU 19 -8.194 0.019 -0.147
177 HA LEU 19 HA LEU 19 -10.231 -1.770 -0.828
178 HB2 LEU 19 HB2 LEU 19 -8.226 -2.382 0.459
179 HB3 LEU 19 HB3 LEU 19 -8.825 -1.460 1.825
180 HG LEU 19 HG LEU 19 -10.773 -2.991 1.953
181 HD11 LEU 19 HD11 LEU 19 -9.274 -4.543 -0.152
182 HD12 LEU 19 HD12 LEU 19 -10.827 -3.735 -0.359
183 HD13 LEU 19 HD13 LEU 19 -10.689 -5.113 0.733
184 HD21 LEU 19 HD21 LEU 19 -8.066 -4.306 2.115
185 HD22 LEU 19 HD22 LEU 19 -9.536 -4.875 2.906
186 HD23 LEU 19 HD23 LEU 19 -8.825 -3.329 3.371
187 H LYS 20 H LYS 20 -10.081 0.508 1.899
188 HA LYS 20 HA LYS 20 -12.954 0.134 2.312
189 HB2 LYS 20 HB2 LYS 20 -11.254 -0.024 4.224
190 HB3 LYS 20 HB3 LYS 20 -11.088 1.720 4.079
191 HG2 LYS 20 HG2 LYS 20 -13.433 2.018 4.593
192 HG3 LYS 20 HG3 LYS 20 -13.665 0.269 4.648
193 HD2 LYS 20 HD2 LYS 20 -12.105 0.126 6.529
194 HD3 LYS 20 HD3 LYS 20 -11.878 1.876 6.473
195 HE2 LYS 20 HE2 LYS 20 -14.245 2.202 6.964
196 HE3 LYS 20 HE3 LYS 20 -14.485 0.456 7.001
197 HZ1 LYS 20 HZ1 LYS 20 -14.241 1.464 9.220
198 HZ2 LYS 20 HZ2 LYS 20 -12.660 1.935 8.817
199 HZ3 LYS 20 HZ3 LYS 20 -13.062 0.290 8.898
200 H LEU 21 H LEU 21 -11.522 1.720 0.161
201 HA LEU 21 HA LEU 21 -12.690 4.364 0.637
202 HB2 LEU 21 HB2 LEU 21 -10.409 4.283 -0.279
203 HB3 LEU 21 HB3 LEU 21 -10.978 3.327 -1.634
204 HG LEU 21 HG LEU 21 -12.378 5.251 -2.350
205 HD11 LEU 21 HD11 LEU 21 -11.912 7.458 -1.385
206 HD12 LEU 21 HD12 LEU 21 -10.915 6.695 -0.146
207 HD13 LEU 21 HD13 LEU 21 -12.644 6.360 -0.216
208 HD21 LEU 21 HD21 LEU 21 -9.431 5.827 -2.069
209 HD22 LEU 21 HD22 LEU 21 -10.531 6.573 -3.229
210 HD23 LEU 21 HD23 LEU 21 -10.180 4.848 -3.331
211 H LYS 22 H LYS 22 -12.925 1.506 -1.365
212 HA LYS 22 HA LYS 22 -15.224 2.546 -2.817
213 HB2 LYS 22 HB2 LYS 22 -13.885 -0.166 -2.932
214 HB3 LYS 22 HB3 LYS 22 -15.123 0.415 -4.038
215 HG2 LYS 22 HG2 LYS 22 -13.636 2.067 -4.927
216 HG3 LYS 22 HG3 LYS 22 -12.420 1.699 -3.700
217 HD2 LYS 22 HD2 LYS 22 -12.215 -0.576 -4.608
218 HD3 LYS 22 HD3 LYS 22 -13.394 -0.176 -5.858
219 HE2 LYS 22 HE2 LYS 22 -10.777 1.267 -5.462
220 HE3 LYS 22 HE3 LYS 22 -11.020 -0.049 -6.609
221 HZ1 LYS 22 HZ1 LYS 22 -12.695 1.282 -7.732
222 HZ2 LYS 22 HZ2 LYS 22 -11.213 2.106 -7.675
223 HZ3 LYS 22 HZ3 LYS 22 -12.468 2.550 -6.627
224 H LYS 23 H LYS 23 -15.218 2.037 0.110
225 HA LYS 23 HA LYS 23 -17.535 0.285 0.240
226 HB2 LYS 23 HB2 LYS 23 -15.572 -1.118 0.747
227 HB3 LYS 23 HB3 LYS 23 -15.107 0.000 2.019
228 HG2 LYS 23 HG2 LYS 23 -17.143 -0.524 3.248
229 HG3 LYS 23 HG3 LYS 23 -17.643 -1.622 1.961
230 HD2 LYS 23 HD2 LYS 23 -15.631 -2.980 2.365
231 HD3 LYS 23 HD3 LYS 23 -15.186 -1.899 3.688
232 HE2 LYS 23 HE2 LYS 23 -16.287 -3.915 4.523
233 HE3 LYS 23 HE3 LYS 23 -17.245 -2.474 4.863
234 HZ1 LYS 23 HZ1 LYS 23 -18.582 -4.340 4.043
235 HZ2 LYS 23 HZ2 LYS 23 -17.715 -4.324 2.585
236 HZ3 LYS 23 HZ3 LYS 23 -18.675 -2.992 3.016
237 H ALA 24 H ALA 24 -19.008 0.872 1.771
238 HA ALA 24 HA ALA 24 -18.282 2.872 3.774
239 HB1 ALA 24 HB1 ALA 24 -20.239 4.250 3.242
240 HB2 ALA 24 HB2 ALA 24 -20.589 3.212 1.859
241 HB3 ALA 24 HB3 ALA 24 -19.112 4.176 1.888
Start of MODEL 10
1 H1 LYS 1 H1 LYS 1 16.994 -7.834 -0.409
2 H2 LYS 1 H2 LYS 1 15.989 -6.715 0.369
3 H3 LYS 1 H3 LYS 1 16.900 -6.240 -0.979
4 HA LYS 1 HA LYS 1 14.610 -6.541 -1.600
5 HB2 LYS 1 HB2 LYS 1 16.477 -7.135 -3.164
6 HB3 LYS 1 HB3 LYS 1 16.329 -8.804 -2.638
7 HG2 LYS 1 HG2 LYS 1 14.196 -9.031 -3.623
8 HG3 LYS 1 HG3 LYS 1 14.050 -7.290 -3.877
9 HD2 LYS 1 HD2 LYS 1 15.927 -7.383 -5.466
10 HD3 LYS 1 HD3 LYS 1 16.027 -9.127 -5.228
11 HE2 LYS 1 HE2 LYS 1 13.488 -7.811 -6.134
12 HE3 LYS 1 HE3 LYS 1 14.754 -8.251 -7.279
13 HZ1 LYS 1 HZ1 LYS 1 14.543 -10.518 -6.704
14 HZ2 LYS 1 HZ2 LYS 1 12.970 -9.947 -6.968
15 HZ3 LYS 1 HZ3 LYS 1 13.533 -10.183 -5.384
16 H LYS 2 H LYS 2 15.796 -8.852 0.585
17 HA LYS 2 HA LYS 2 13.512 -10.623 0.258
18 HB2 LYS 2 HB2 LYS 2 15.757 -10.726 2.273
19 HB3 LYS 2 HB3 LYS 2 14.554 -11.975 2.002
20 HG2 LYS 2 HG2 LYS 2 15.417 -12.297 -0.270
21 HG3 LYS 2 HG3 LYS 2 16.648 -11.071 0.040
22 HD2 LYS 2 HD2 LYS 2 17.443 -12.458 1.952
23 HD3 LYS 2 HD3 LYS 2 16.313 -13.715 1.451
24 HE2 LYS 2 HE2 LYS 2 18.514 -14.210 0.593
25 HE3 LYS 2 HE3 LYS 2 17.435 -13.803 -0.742
26 HZ1 LYS 2 HZ1 LYS 2 18.386 -11.629 -0.874
27 HZ2 LYS 2 HZ2 LYS 2 19.655 -12.756 -0.898
28 HZ3 LYS 2 HZ3 LYS 2 19.320 -11.883 0.519
29 H LEU 3 H LEU 3 14.963 -9.112 3.169
30 HA LEU 3 HA LEU 3 12.417 -9.486 4.497
31 HB2 LEU 3 HB2 LEU 3 15.118 -8.611 5.482
32 HB3 LEU 3 HB3 LEU 3 13.700 -8.609 6.509
33 HG LEU 3 HG LEU 3 13.490 -11.103 5.907
34 HD11 LEU 3 HD11 LEU 3 15.579 -12.211 5.328
35 HD12 LEU 3 HD12 LEU 3 16.358 -10.641 5.130
36 HD13 LEU 3 HD13 LEU 3 15.047 -11.118 4.050
37 HD21 LEU 3 HD21 LEU 3 15.798 -10.134 7.585
38 HD22 LEU 3 HD22 LEU 3 15.047 -11.728 7.682
39 HD23 LEU 3 HD23 LEU 3 14.121 -10.289 8.109
40 H LYS 4 H LYS 4 12.627 -7.407 2.450
41 HA LYS 4 HA LYS 4 11.275 -5.400 4.100
42 HB2 LYS 4 HB2 LYS 4 13.403 -4.868 2.067
43 HB3 LYS 4 HB3 LYS 4 12.070 -3.734 2.196
44 HG2 LYS 4 HG2 LYS 4 13.702 -2.817 3.556
45 HG3 LYS 4 HG3 LYS 4 12.646 -3.649 4.695
46 HD2 LYS 4 HD2 LYS 4 14.215 -5.579 4.638
47 HD3 LYS 4 HD3 LYS 4 15.293 -4.617 3.628
48 HE2 LYS 4 HE2 LYS 4 14.411 -3.971 6.438
49 HE3 LYS 4 HE3 LYS 4 16.008 -4.526 5.940
50 HZ1 LYS 4 HZ1 LYS 4 16.145 -2.481 4.549
51 HZ2 LYS 4 HZ2 LYS 4 16.120 -2.193 6.217
52 HZ3 LYS 4 HZ3 LYS 4 14.722 -1.932 5.293
53 H LEU 5 H LEU 5 11.926 -6.353 0.741
54 HA LEU 5 HA LEU 5 9.476 -5.487 -0.320
55 HB2 LEU 5 HB2 LEU 5 11.420 -5.955 -1.715
56 HB3 LEU 5 HB3 LEU 5 11.356 -7.650 -1.274
57 HG LEU 5 HG LEU 5 9.156 -7.825 -2.419
58 HD11 LEU 5 HD11 LEU 5 8.454 -5.506 -2.248
59 HD12 LEU 5 HD12 LEU 5 8.472 -6.025 -3.933
60 HD13 LEU 5 HD13 LEU 5 9.773 -5.010 -3.308
61 HD21 LEU 5 HD21 LEU 5 11.257 -8.426 -3.541
62 HD22 LEU 5 HD22 LEU 5 11.395 -6.774 -4.143
63 HD23 LEU 5 HD23 LEU 5 10.059 -7.797 -4.670
64 H ALA 6 H ALA 6 10.509 -8.614 0.973
65 HA ALA 6 HA ALA 6 7.941 -9.822 0.447
66 HB1 ALA 6 HB1 ALA 6 8.859 -11.787 1.592
67 HB2 ALA 6 HB2 ALA 6 10.280 -10.852 2.053
68 HB3 ALA 6 HB3 ALA 6 9.956 -11.183 0.352
69 H LEU 7 H LEU 7 8.550 -7.465 2.459
70 HA LEU 7 HA LEU 7 6.883 -8.595 4.613
71 HB2 LEU 7 HB2 LEU 7 8.862 -6.322 4.744
72 HB3 LEU 7 HB3 LEU 7 7.747 -6.725 6.034
73 HG LEU 7 HG LEU 7 10.041 -8.395 5.013
74 HD11 LEU 7 HD11 LEU 7 10.824 -8.188 7.321
75 HD12 LEU 7 HD12 LEU 7 9.428 -7.179 7.702
76 HD13 LEU 7 HD13 LEU 7 10.639 -6.610 6.555
77 HD21 LEU 7 HD21 LEU 7 9.378 -10.083 6.635
78 HD22 LEU 7 HD22 LEU 7 8.100 -9.830 5.447
79 HD23 LEU 7 HD23 LEU 7 7.953 -9.135 7.061
80 H ALA 8 H ALA 8 7.574 -5.504 2.959
81 HA ALA 8 HA ALA 8 5.039 -4.356 3.495
82 HB1 ALA 8 HB1 ALA 8 5.598 -2.760 1.723
83 HB2 ALA 8 HB2 ALA 8 6.946 -3.782 1.224
84 HB3 ALA 8 HB3 ALA 8 6.968 -3.005 2.807
85 H LYS 9 H LYS 9 6.343 -5.951 0.588
86 HA LYS 9 HA LYS 9 5.439 -7.479 -0.801
87 HB2 LYS 9 HB2 LYS 9 4.698 -8.436 1.414
88 HB3 LYS 9 HB3 LYS 9 3.142 -7.668 1.141
89 HG2 LYS 9 HG2 LYS 9 2.711 -9.034 -0.757
90 HG3 LYS 9 HG3 LYS 9 4.367 -9.652 -0.760
91 HD2 LYS 9 HD2 LYS 9 3.965 -10.670 1.444
92 HD3 LYS 9 HD3 LYS 9 2.301 -10.090 1.395
93 HE2 LYS 9 HE2 LYS 9 3.512 -11.948 -0.639
94 HE3 LYS 9 HE3 LYS 9 2.594 -12.486 0.764
95 HZ1 LYS 9 HZ1 LYS 9 0.799 -10.901 -0.183
96 HZ2 LYS 9 HZ2 LYS 9 1.005 -12.436 -0.865
97 HZ3 LYS 9 HZ3 LYS 9 1.649 -11.079 -1.642
98 H LEU 10 H LEU 10 5.206 -5.493 -2.096
99 HA LEU 10 HA LEU 10 4.132 -4.559 -3.851
100 HB2 LEU 10 HB2 LEU 10 1.771 -6.234 -3.007
101 HB3 LEU 10 HB3 LEU 10 1.877 -5.317 -4.497
102 HG LEU 10 HG LEU 10 3.644 -7.644 -3.739
103 HD11 LEU 10 HD11 LEU 10 1.372 -8.328 -4.248
104 HD12 LEU 10 HD12 LEU 10 2.481 -8.822 -5.525
105 HD13 LEU 10 HD13 LEU 10 1.427 -7.427 -5.765
106 HD21 LEU 10 HD21 LEU 10 4.475 -7.488 -6.033
107 HD22 LEU 10 HD22 LEU 10 4.832 -6.025 -5.114
108 HD23 LEU 10 HD23 LEU 10 3.512 -6.033 -6.284
109 H ALA 11 H ALA 11 4.050 -3.572 -1.052
110 HA ALA 11 HA ALA 11 3.476 -1.611 -0.076
111 HB1 ALA 11 HB1 ALA 11 2.513 0.179 -1.411
112 HB2 ALA 11 HB2 ALA 11 2.135 -0.969 -2.697
113 HB3 ALA 11 HB3 ALA 11 3.814 -0.631 -2.279
114 HA PRO 12 HA PRO 12 -0.583 -3.049 1.362
115 HB2 PRO 12 HB2 PRO 12 -0.246 -2.146 3.904
116 HB3 PRO 12 HB3 PRO 12 0.413 -3.685 3.335
117 HG2 PRO 12 HG2 PRO 12 1.779 -1.040 3.655
118 HG3 PRO 12 HG3 PRO 12 2.365 -2.660 4.074
119 HD2 PRO 12 HD2 PRO 12 3.129 -1.370 1.822
120 HD3 PRO 12 HD3 PRO 12 2.977 -3.136 1.903
121 H LEU 13 H LEU 13 0.889 0.068 1.337
122 HA LEU 13 HA LEU 13 -1.105 1.653 2.501
123 HB2 LEU 13 HB2 LEU 13 0.826 2.362 0.286
124 HB3 LEU 13 HB3 LEU 13 -0.096 3.515 1.233
125 HG LEU 13 HG LEU 13 2.001 1.649 2.350
126 HD11 LEU 13 HD11 LEU 13 2.951 3.375 0.878
127 HD12 LEU 13 HD12 LEU 13 3.395 3.616 2.568
128 HD13 LEU 13 HD13 LEU 13 2.142 4.617 1.837
129 HD21 LEU 13 HD21 LEU 13 0.264 2.229 3.965
130 HD22 LEU 13 HD22 LEU 13 0.507 3.941 3.617
131 HD23 LEU 13 HD23 LEU 13 1.797 3.004 4.370
132 H TRP 14 H TRP 14 -0.673 0.508 -0.793
133 HA TRP 14 HA TRP 14 -2.811 2.033 -1.899
134 HB2 TRP 14 HB2 TRP 14 -0.945 1.235 -3.276
135 HB3 TRP 14 HB3 TRP 14 -1.394 -0.431 -2.943
136 HD1 TRP 14 HD1 TRP 14 -2.928 -1.540 -4.674
137 HE1 TRP 14 HE1 TRP 14 -4.362 -0.716 -6.648
138 HE3 TRP 14 HE3 TRP 14 -2.456 3.506 -3.977
139 HZ2 TRP 14 HZ2 TRP 14 -5.195 1.740 -7.751
140 HZ3 TRP 14 HZ3 TRP 14 -3.611 5.022 -5.535
141 HH2 TRP 14 HH2 TRP 14 -4.949 4.156 -7.382
142 H LYS 15 H LYS 15 -2.444 -1.292 -0.795
143 HA LYS 15 HA LYS 15 -4.895 -2.275 -1.736
144 HB2 LYS 15 HB2 LYS 15 -3.354 -3.237 0.676
145 HB3 LYS 15 HB3 LYS 15 -4.502 -4.164 -0.278
146 HG2 LYS 15 HG2 LYS 15 -1.890 -3.083 -1.308
147 HG3 LYS 15 HG3 LYS 15 -2.152 -4.736 -0.750
148 HD2 LYS 15 HD2 LYS 15 -3.834 -5.055 -2.500
149 HD3 LYS 15 HD3 LYS 15 -3.575 -3.397 -3.048
150 HE2 LYS 15 HE2 LYS 15 -2.377 -5.062 -4.420
151 HE3 LYS 15 HE3 LYS 15 -1.297 -3.904 -3.645
152 HZ1 LYS 15 HZ1 LYS 15 -1.877 -6.599 -2.542
153 HZ2 LYS 15 HZ2 LYS 15 -0.686 -5.513 -2.022
154 HZ3 LYS 15 HZ3 LYS 15 -0.548 -6.258 -3.534
155 H ALA 16 H ALA 16 -3.995 -1.024 1.469
156 HA ALA 16 HA ALA 16 -6.465 -1.754 2.669
157 HB1 ALA 16 HB1 ALA 16 -5.686 -0.498 4.608
158 HB2 ALA 16 HB2 ALA 16 -4.387 0.204 3.643
159 HB3 ALA 16 HB3 ALA 16 -4.409 -1.530 3.962
160 H LEU 17 H LEU 17 -5.328 1.175 1.119
161 HA LEU 17 HA LEU 17 -7.602 2.690 2.084
162 HB2 LEU 17 HB2 LEU 17 -5.193 3.357 0.434
163 HB3 LEU 17 HB3 LEU 17 -6.572 4.437 0.439
164 HG LEU 17 HG LEU 17 -4.902 5.209 2.014
165 HD11 LEU 17 HD11 LEU 17 -6.271 5.376 4.010
166 HD12 LEU 17 HD12 LEU 17 -7.284 4.049 3.446
167 HD13 LEU 17 HD13 LEU 17 -7.253 5.574 2.560
168 HD21 LEU 17 HD21 LEU 17 -5.232 2.539 3.372
169 HD22 LEU 17 HD22 LEU 17 -4.300 3.904 3.991
170 HD23 LEU 17 HD23 LEU 17 -3.804 3.098 2.502
171 H ALA 18 H ALA 18 -6.814 0.697 -0.553
172 HA ALA 18 HA ALA 18 -8.735 1.842 -2.365
173 HB1 ALA 18 HB1 ALA 18 -8.238 -0.070 -3.798
174 HB2 ALA 18 HB2 ALA 18 -7.317 -0.818 -2.495
175 HB3 ALA 18 HB3 ALA 18 -6.751 0.684 -3.222
176 H LEU 19 H LEU 19 -8.534 -0.973 -0.219
177 HA LEU 19 HA LEU 19 -11.050 -2.071 -0.913
178 HB2 LEU 19 HB2 LEU 19 -9.417 -2.359 1.610
179 HB3 LEU 19 HB3 LEU 19 -10.836 -3.319 1.234
180 HG LEU 19 HG LEU 19 -8.272 -3.287 -0.363
181 HD11 LEU 19 HD11 LEU 19 -7.997 -5.572 0.475
182 HD12 LEU 19 HD12 LEU 19 -9.427 -5.366 1.487
183 HD13 LEU 19 HD13 LEU 19 -7.990 -4.386 1.781
184 HD21 LEU 19 HD21 LEU 19 -9.255 -5.151 -1.590
185 HD22 LEU 19 HD22 LEU 19 -10.237 -3.696 -1.757
186 HD23 LEU 19 HD23 LEU 19 -10.748 -4.983 -0.664
187 H LYS 20 H LYS 20 -10.099 0.475 1.248
188 HA LYS 20 HA LYS 20 -12.886 0.717 2.136
189 HB2 LYS 20 HB2 LYS 20 -10.327 1.643 3.403
190 HB3 LYS 20 HB3 LYS 20 -11.886 2.312 3.871
191 HG2 LYS 20 HG2 LYS 20 -12.602 -0.116 4.245
192 HG3 LYS 20 HG3 LYS 20 -10.878 -0.488 4.191
193 HD2 LYS 20 HD2 LYS 20 -10.438 0.924 6.059
194 HD3 LYS 20 HD3 LYS 20 -12.075 1.583 6.012
195 HE2 LYS 20 HE2 LYS 20 -11.315 -1.264 6.664
196 HE3 LYS 20 HE3 LYS 20 -11.851 -0.039 7.812
197 HZ1 LYS 20 HZ1 LYS 20 -13.448 -1.254 5.618
198 HZ2 LYS 20 HZ2 LYS 20 -13.972 0.069 6.543
199 HZ3 LYS 20 HZ3 LYS 20 -13.694 -1.430 7.289
200 H LEU 21 H LEU 21 -11.622 1.644 -0.422
201 HA LEU 21 HA LEU 21 -11.921 4.527 -0.241
202 HB2 LEU 21 HB2 LEU 21 -10.264 3.529 -1.772
203 HB3 LEU 21 HB3 LEU 21 -11.558 2.732 -2.645
204 HG LEU 21 HG LEU 21 -12.462 4.957 -3.273
205 HD11 LEU 21 HD11 LEU 21 -9.918 6.000 -2.038
206 HD12 LEU 21 HD12 LEU 21 -11.545 6.241 -1.402
207 HD13 LEU 21 HD13 LEU 21 -11.094 6.939 -2.958
208 HD21 LEU 21 HD21 LEU 21 -9.587 4.465 -4.033
209 HD22 LEU 21 HD22 LEU 21 -10.733 5.468 -4.921
210 HD23 LEU 21 HD23 LEU 21 -11.002 3.730 -4.787
211 H LYS 22 H LYS 22 -13.605 1.767 -1.653
212 HA LYS 22 HA LYS 22 -15.924 3.477 -2.205
213 HB2 LYS 22 HB2 LYS 22 -16.681 1.423 -3.546
214 HB3 LYS 22 HB3 LYS 22 -15.343 2.371 -4.182
215 HG2 LYS 22 HG2 LYS 22 -13.772 0.725 -3.216
216 HG3 LYS 22 HG3 LYS 22 -15.152 -0.246 -2.702
217 HD2 LYS 22 HD2 LYS 22 -15.827 -0.626 -4.953
218 HD3 LYS 22 HD3 LYS 22 -14.677 0.567 -5.560
219 HE2 LYS 22 HE2 LYS 22 -13.830 -1.653 -5.975
220 HE3 LYS 22 HE3 LYS 22 -12.826 -0.854 -4.769
221 HZ1 LYS 22 HZ1 LYS 22 -13.993 -2.090 -3.040
222 HZ2 LYS 22 HZ2 LYS 22 -13.271 -3.137 -4.163
223 HZ3 LYS 22 HZ3 LYS 22 -14.944 -2.864 -4.216
224 H LYS 23 H LYS 23 -14.897 1.877 0.306
225 HA LYS 23 HA LYS 23 -17.539 1.526 1.351
226 HB2 LYS 23 HB2 LYS 23 -17.238 -0.677 0.312
227 HB3 LYS 23 HB3 LYS 23 -15.731 -0.897 1.198
228 HG2 LYS 23 HG2 LYS 23 -16.918 -0.888 3.297
229 HG3 LYS 23 HG3 LYS 23 -18.436 -0.548 2.466
230 HD2 LYS 23 HD2 LYS 23 -18.213 -2.700 1.268
231 HD3 LYS 23 HD3 LYS 23 -16.762 -3.041 2.216
232 HE2 LYS 23 HE2 LYS 23 -18.791 -4.131 3.128
233 HE3 LYS 23 HE3 LYS 23 -18.033 -3.016 4.261
234 HZ1 LYS 23 HZ1 LYS 23 -20.489 -2.832 4.145
235 HZ2 LYS 23 HZ2 LYS 23 -20.350 -2.301 2.540
236 HZ3 LYS 23 HZ3 LYS 23 -19.686 -1.378 3.804
237 H ALA 24 H ALA 24 -17.409 2.497 3.239
238 HA ALA 24 HA ALA 24 -14.857 2.685 4.614
239 HB1 ALA 24 HB1 ALA 24 -16.230 4.698 4.371
240 HB2 ALA 24 HB2 ALA 24 -15.973 4.290 6.068
241 HB3 ALA 24 HB3 ALA 24 -17.518 3.930 5.300