Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
531542 | 2l96 RC | 17438 | 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 -5.826 29.068 -8.793
2 H2 LYS 1 H2 LYS 1 -5.950 29.465 -7.147
3 H3 LYS 1 H3 LYS 1 -7.004 28.330 -7.830
4 HA LYS 1 HA LYS 1 -5.233 26.798 -8.212
5 HB2 LYS 1 HB2 LYS 1 -3.475 28.876 -6.893
6 HB3 LYS 1 HB3 LYS 1 -2.968 27.275 -7.416
7 HG2 LYS 1 HG2 LYS 1 -3.520 27.920 -9.744
8 HG3 LYS 1 HG3 LYS 1 -3.875 29.551 -9.167
9 HD2 LYS 1 HD2 LYS 1 -1.536 29.621 -8.244
10 HD3 LYS 1 HD3 LYS 1 -1.231 28.102 -9.093
11 HE2 LYS 1 HE2 LYS 1 -0.445 29.945 -10.436
12 HE3 LYS 1 HE3 LYS 1 -1.848 29.213 -11.215
13 HZ1 LYS 1 HZ1 LYS 1 -2.011 31.604 -11.278
14 HZ2 LYS 1 HZ2 LYS 1 -1.849 31.704 -9.594
15 HZ3 LYS 1 HZ3 LYS 1 -3.225 30.984 -10.268
16 H LYS 2 H LYS 2 -6.046 25.371 -6.843
17 HA LYS 2 HA LYS 2 -5.269 25.557 -4.056
18 HB2 LYS 2 HB2 LYS 2 -7.469 26.617 -4.040
19 HB3 LYS 2 HB3 LYS 2 -8.162 25.237 -4.889
20 HG2 LYS 2 HG2 LYS 2 -7.826 23.821 -3.003
21 HG3 LYS 2 HG3 LYS 2 -6.870 25.052 -2.177
22 HD2 LYS 2 HD2 LYS 2 -9.170 24.862 -1.298
23 HD3 LYS 2 HD3 LYS 2 -8.811 26.463 -1.942
24 HE2 LYS 2 HE2 LYS 2 -11.053 25.665 -2.579
25 HE3 LYS 2 HE3 LYS 2 -10.018 25.963 -3.973
26 HZ1 LYS 2 HZ1 LYS 2 -9.812 23.267 -3.069
27 HZ2 LYS 2 HZ2 LYS 2 -10.208 23.863 -4.605
28 HZ3 LYS 2 HZ3 LYS 2 -11.419 23.670 -3.432
29 H LEU 3 H LEU 3 -4.068 23.795 -4.031
30 HA LEU 3 HA LEU 3 -4.720 21.486 -5.617
31 HB2 LEU 3 HB2 LEU 3 -2.446 22.023 -3.707
32 HB3 LEU 3 HB3 LEU 3 -2.597 20.578 -4.686
33 HG LEU 3 HG LEU 3 -2.276 23.388 -5.739
34 HD11 LEU 3 HD11 LEU 3 -0.064 22.591 -6.456
35 HD12 LEU 3 HD12 LEU 3 -0.354 21.070 -5.610
36 HD13 LEU 3 HD13 LEU 3 -0.249 22.578 -4.702
37 HD21 LEU 3 HD21 LEU 3 -3.609 21.990 -7.229
38 HD22 LEU 3 HD22 LEU 3 -2.358 20.747 -7.194
39 HD23 LEU 3 HD23 LEU 3 -2.018 22.320 -7.917
40 H LYS 4 H LYS 4 -5.877 19.872 -4.980
41 HA LYS 4 HA LYS 4 -6.320 19.409 -2.113
42 HB2 LYS 4 HB2 LYS 4 -8.247 18.068 -2.811
43 HB3 LYS 4 HB3 LYS 4 -8.332 19.684 -3.503
44 HG2 LYS 4 HG2 LYS 4 -7.522 18.825 -5.634
45 HG3 LYS 4 HG3 LYS 4 -7.390 17.209 -4.939
46 HD2 LYS 4 HD2 LYS 4 -9.825 17.247 -4.497
47 HD3 LYS 4 HD3 LYS 4 -9.919 18.810 -5.314
48 HE2 LYS 4 HE2 LYS 4 -9.062 17.785 -7.361
49 HE3 LYS 4 HE3 LYS 4 -8.962 16.228 -6.542
50 HZ1 LYS 4 HZ1 LYS 4 -10.958 16.302 -7.828
51 HZ2 LYS 4 HZ2 LYS 4 -11.428 17.773 -7.140
52 HZ3 LYS 4 HZ3 LYS 4 -11.397 16.365 -6.189
53 H LEU 5 H LEU 5 -3.979 18.631 -3.885
54 HA LEU 5 HA LEU 5 -4.075 15.816 -4.263
55 HB2 LEU 5 HB2 LEU 5 -1.730 17.715 -4.204
56 HB3 LEU 5 HB3 LEU 5 -1.648 16.037 -4.710
57 HG LEU 5 HG LEU 5 -3.271 18.188 -6.077
58 HD11 LEU 5 HD11 LEU 5 -0.891 18.560 -6.368
59 HD12 LEU 5 HD12 LEU 5 -1.607 17.973 -7.871
60 HD13 LEU 5 HD13 LEU 5 -0.670 16.878 -6.851
61 HD21 LEU 5 HD21 LEU 5 -3.569 16.508 -7.835
62 HD22 LEU 5 HD22 LEU 5 -4.263 15.973 -6.303
63 HD23 LEU 5 HD23 LEU 5 -2.715 15.325 -6.844
64 H ALA 6 H ALA 6 -4.292 14.544 -2.575
65 HA ALA 6 HA ALA 6 -2.384 14.839 -0.349
66 HB1 ALA 6 HB1 ALA 6 -4.037 13.686 1.072
67 HB2 ALA 6 HB2 ALA 6 -5.168 13.669 -0.283
68 HB3 ALA 6 HB3 ALA 6 -4.657 15.205 0.421
69 HA PRO 7 HA PRO 7 -1.328 11.025 -2.758
70 HB2 PRO 7 HB2 PRO 7 1.338 11.137 -2.140
71 HB3 PRO 7 HB3 PRO 7 0.609 11.958 -3.525
72 HG2 PRO 7 HG2 PRO 7 1.322 13.058 -0.831
73 HG3 PRO 7 HG3 PRO 7 1.557 13.783 -2.433
74 HD2 PRO 7 HD2 PRO 7 -0.465 14.524 -0.827
75 HD3 PRO 7 HD3 PRO 7 -0.653 14.455 -2.591
76 H ALA 8 H ALA 8 -0.543 11.979 0.538
77 HA ALA 8 HA ALA 8 0.390 9.405 1.359
78 HB1 ALA 8 HB1 ALA 8 -0.648 11.643 3.093
79 HB2 ALA 8 HB2 ALA 8 1.004 11.527 2.490
80 HB3 ALA 8 HB3 ALA 8 0.380 10.301 3.594
81 H LYS 9 H LYS 9 -2.692 10.627 0.709
82 HA LYS 9 HA LYS 9 -4.013 8.804 2.578
83 HB2 LYS 9 HB2 LYS 9 -5.095 10.966 0.766
84 HB3 LYS 9 HB3 LYS 9 -6.104 9.932 1.767
85 HG2 LYS 9 HG2 LYS 9 -3.950 11.740 2.836
86 HG3 LYS 9 HG3 LYS 9 -5.658 12.165 2.744
87 HD2 LYS 9 HD2 LYS 9 -6.212 10.281 4.199
88 HD3 LYS 9 HD3 LYS 9 -4.506 9.842 4.284
89 HE2 LYS 9 HE2 LYS 9 -5.653 12.477 5.203
90 HE3 LYS 9 HE3 LYS 9 -5.314 11.109 6.261
91 HZ1 LYS 9 HZ1 LYS 9 -3.331 12.638 4.660
92 HZ2 LYS 9 HZ2 LYS 9 -2.973 11.246 5.556
93 HZ3 LYS 9 HZ3 LYS 9 -3.499 12.652 6.349
94 H LEU 10 H LEU 10 -2.856 8.714 -0.559
95 HA LEU 10 HA LEU 10 -4.844 6.682 -1.312
96 HB2 LEU 10 HB2 LEU 10 -3.822 8.890 -3.097
97 HB3 LEU 10 HB3 LEU 10 -4.800 7.540 -3.638
98 HG LEU 10 HG LEU 10 -5.688 9.636 -1.654
99 HD11 LEU 10 HD11 LEU 10 -5.434 10.590 -3.857
100 HD12 LEU 10 HD12 LEU 10 -7.146 10.399 -3.484
101 HD13 LEU 10 HD13 LEU 10 -6.348 9.263 -4.571
102 HD21 LEU 10 HD21 LEU 10 -7.909 8.640 -1.982
103 HD22 LEU 10 HD22 LEU 10 -6.771 7.499 -1.268
104 HD23 LEU 10 HD23 LEU 10 -7.189 7.376 -2.978
105 H ALA 11 H ALA 11 -1.585 7.980 -1.821
106 HA ALA 11 HA ALA 11 -0.979 5.734 -3.597
107 HB1 ALA 11 HB1 ALA 11 0.607 8.238 -3.074
108 HB2 ALA 11 HB2 ALA 11 -0.524 7.994 -4.407
109 HB3 ALA 11 HB3 ALA 11 0.942 7.019 -4.306
110 H LEU 12 H LEU 12 -0.811 6.103 -0.386
111 HA LEU 12 HA LEU 12 1.891 5.160 0.017
112 HB2 LEU 12 HB2 LEU 12 -0.431 5.501 1.904
113 HB3 LEU 12 HB3 LEU 12 1.081 4.761 2.398
114 HG LEU 12 HG LEU 12 0.647 7.601 1.484
115 HD11 LEU 12 HD11 LEU 12 1.517 8.136 3.706
116 HD12 LEU 12 HD12 LEU 12 1.639 6.413 4.069
117 HD13 LEU 12 HD13 LEU 12 0.058 7.148 3.799
118 HD21 LEU 12 HD21 LEU 12 3.053 7.924 1.782
119 HD22 LEU 12 HD22 LEU 12 2.722 6.751 0.507
120 HD23 LEU 12 HD23 LEU 12 3.248 6.202 2.097
121 H LEU 13 H LEU 13 1.511 3.444 -1.589
122 HA LEU 13 HA LEU 13 0.014 1.139 -0.626
123 HB2 LEU 13 HB2 LEU 13 1.606 1.520 -3.168
124 HB3 LEU 13 HB3 LEU 13 0.582 0.145 -2.798
125 HG LEU 13 HG LEU 13 -0.386 2.987 -3.138
126 HD11 LEU 13 HD11 LEU 13 0.403 2.025 -5.236
127 HD12 LEU 13 HD12 LEU 13 -1.354 2.180 -5.231
128 HD13 LEU 13 HD13 LEU 13 -0.607 0.603 -4.972
129 HD21 LEU 13 HD21 LEU 13 -1.747 1.660 -1.589
130 HD22 LEU 13 HD22 LEU 13 -1.921 0.411 -2.822
131 HD23 LEU 13 HD23 LEU 13 -2.610 2.012 -3.086
132 H TRP 14 H TRP 14 2.994 2.404 -0.149
133 HA TRP 14 HA TRP 14 4.838 1.686 0.939
134 HB2 TRP 14 HB2 TRP 14 3.342 -0.929 1.128
135 HB3 TRP 14 HB3 TRP 14 4.893 -0.615 1.905
136 HD1 TRP 14 HD1 TRP 14 4.822 1.634 3.649
137 HE1 TRP 14 HE1 TRP 14 2.986 2.228 5.358
138 HE3 TRP 14 HE3 TRP 14 0.978 -1.116 1.688
139 HZ2 TRP 14 HZ2 TRP 14 0.272 1.610 5.803
140 HZ3 TRP 14 HZ3 TRP 14 -1.205 -1.059 2.823
141 HH2 TRP 14 HH2 TRP 14 -1.548 0.273 4.835
142 H LYS 15 H LYS 15 3.732 -0.077 -1.831
143 HA LYS 15 HA LYS 15 6.073 -1.440 -2.515
144 HB2 LYS 15 HB2 LYS 15 3.949 -0.143 -4.226
145 HB3 LYS 15 HB3 LYS 15 5.250 -1.128 -4.890
146 HG2 LYS 15 HG2 LYS 15 4.476 -3.052 -3.654
147 HG3 LYS 15 HG3 LYS 15 3.244 -2.077 -2.851
148 HD2 LYS 15 HD2 LYS 15 2.096 -1.724 -4.938
149 HD3 LYS 15 HD3 LYS 15 3.391 -2.523 -5.832
150 HE2 LYS 15 HE2 LYS 15 1.398 -3.958 -5.488
151 HE3 LYS 15 HE3 LYS 15 2.874 -4.631 -4.796
152 HZ1 LYS 15 HZ1 LYS 15 0.826 -3.130 -3.252
153 HZ2 LYS 15 HZ2 LYS 15 2.185 -3.935 -2.626
154 HZ3 LYS 15 HZ3 LYS 15 0.925 -4.818 -3.325
155 H ALA 16 H ALA 16 7.867 -0.874 -3.712
156 HA ALA 16 HA ALA 16 9.624 0.401 -4.362
157 HB1 ALA 16 HB1 ALA 16 9.304 2.663 -5.190
158 HB2 ALA 16 HB2 ALA 16 7.668 2.689 -4.529
159 HB3 ALA 16 HB3 ALA 16 8.072 1.581 -5.842
160 H LEU 17 H LEU 17 7.522 2.175 -2.125
161 HA LEU 17 HA LEU 17 9.475 3.701 -0.847
162 HB2 LEU 17 HB2 LEU 17 7.098 4.122 -0.587
163 HB3 LEU 17 HB3 LEU 17 6.887 2.590 0.236
164 HG LEU 17 HG LEU 17 8.335 3.426 2.081
165 HD11 LEU 17 HD11 LEU 17 9.609 5.081 0.856
166 HD12 LEU 17 HD12 LEU 17 8.769 5.838 2.207
167 HD13 LEU 17 HD13 LEU 17 8.150 6.027 0.567
168 HD21 LEU 17 HD21 LEU 17 6.646 4.902 3.037
169 HD22 LEU 17 HD22 LEU 17 5.897 3.532 2.215
170 HD23 LEU 17 HD23 LEU 17 5.921 5.119 1.447
171 H ALA 18 H ALA 18 7.969 0.715 0.419
172 HA ALA 18 HA ALA 18 9.785 0.473 2.579
173 HB1 ALA 18 HB1 ALA 18 7.564 -0.536 2.633
174 HB2 ALA 18 HB2 ALA 18 8.809 -1.752 2.905
175 HB3 ALA 18 HB3 ALA 18 8.019 -1.634 1.333
176 H LEU 19 H LEU 19 9.980 -0.421 -0.731
177 HA LEU 19 HA LEU 19 12.009 -2.407 -0.435
178 HB2 LEU 19 HB2 LEU 19 10.995 -0.824 -2.779
179 HB3 LEU 19 HB3 LEU 19 12.394 -1.866 -2.926
180 HG LEU 19 HG LEU 19 10.512 -3.063 -3.737
181 HD11 LEU 19 HD11 LEU 19 12.091 -4.374 -2.439
182 HD12 LEU 19 HD12 LEU 19 10.453 -5.000 -2.248
183 HD13 LEU 19 HD13 LEU 19 11.184 -4.036 -0.963
184 HD21 LEU 19 HD21 LEU 19 8.732 -1.771 -2.692
185 HD22 LEU 19 HD22 LEU 19 9.134 -2.463 -1.121
186 HD23 LEU 19 HD23 LEU 19 8.509 -3.496 -2.407
187 H LYS 20 H LYS 20 12.046 1.014 -1.455
188 HA LYS 20 HA LYS 20 14.891 1.120 -1.534
189 HB2 LYS 20 HB2 LYS 20 12.744 3.210 -1.648
190 HB3 LYS 20 HB3 LYS 20 14.444 3.652 -1.575
191 HG2 LYS 20 HG2 LYS 20 13.156 1.934 -3.684
192 HG3 LYS 20 HG3 LYS 20 13.644 3.621 -3.869
193 HD2 LYS 20 HD2 LYS 20 15.969 3.006 -3.477
194 HD3 LYS 20 HD3 LYS 20 15.500 1.324 -3.233
195 HE2 LYS 20 HE2 LYS 20 15.131 2.900 -5.777
196 HE3 LYS 20 HE3 LYS 20 16.406 1.721 -5.481
197 HZ1 LYS 20 HZ1 LYS 20 13.490 1.158 -5.522
198 HZ2 LYS 20 HZ2 LYS 20 14.705 0.017 -5.196
199 HZ3 LYS 20 HZ3 LYS 20 14.605 0.743 -6.731
200 H LEU 21 H LEU 21 12.564 1.504 0.992
201 HA LEU 21 HA LEU 21 14.287 2.844 2.821
202 HB2 LEU 21 HB2 LEU 21 11.894 1.062 3.277
203 HB3 LEU 21 HB3 LEU 21 12.723 1.928 4.558
204 HG LEU 21 HG LEU 21 11.316 3.193 2.207
205 HD11 LEU 21 HD11 LEU 21 9.689 3.955 3.846
206 HD12 LEU 21 HD12 LEU 21 10.546 3.079 5.115
207 HD13 LEU 21 HD13 LEU 21 9.769 2.194 3.803
208 HD21 LEU 21 HD21 LEU 21 11.704 5.301 3.412
209 HD22 LEU 21 HD22 LEU 21 13.209 4.526 2.918
210 HD23 LEU 21 HD23 LEU 21 12.678 4.430 4.597
211 H LYS 22 H LYS 22 14.054 -0.377 1.650
212 HA LYS 22 HA LYS 22 16.002 -1.317 3.639
213 HB2 LYS 22 HB2 LYS 22 14.510 -2.845 1.490
214 HB3 LYS 22 HB3 LYS 22 15.642 -3.554 2.633
215 HG2 LYS 22 HG2 LYS 22 14.180 -2.944 4.479
216 HG3 LYS 22 HG3 LYS 22 13.051 -2.197 3.344
217 HD2 LYS 22 HD2 LYS 22 12.737 -4.374 2.247
218 HD3 LYS 22 HD3 LYS 22 13.841 -5.113 3.407
219 HE2 LYS 22 HE2 LYS 22 11.559 -5.542 4.072
220 HE3 LYS 22 HE3 LYS 22 12.323 -4.454 5.229
221 HZ1 LYS 22 HZ1 LYS 22 10.455 -3.664 3.057
222 HZ2 LYS 22 HZ2 LYS 22 11.223 -2.589 4.126
223 HZ3 LYS 22 HZ3 LYS 22 10.100 -3.716 4.713
224 H LYS 23 H LYS 23 16.032 0.415 1.002
225 HA LYS 23 HA LYS 23 17.430 0.934 -0.679
226 HB2 LYS 23 HB2 LYS 23 19.063 0.897 1.229
227 HB3 LYS 23 HB3 LYS 23 19.482 -0.745 0.765
228 HG2 LYS 23 HG2 LYS 23 20.275 0.019 -1.384
229 HG3 LYS 23 HG3 LYS 23 19.757 1.663 -1.019
230 HD2 LYS 23 HD2 LYS 23 22.182 1.342 -0.722
231 HD3 LYS 23 HD3 LYS 23 21.368 1.826 0.766
232 HE2 LYS 23 HE2 LYS 23 21.454 -0.397 1.623
233 HE3 LYS 23 HE3 LYS 23 22.012 -1.036 0.077
234 HZ1 LYS 23 HZ1 LYS 23 23.794 -0.777 1.759
235 HZ2 LYS 23 HZ2 LYS 23 23.550 0.902 1.731
236 HZ3 LYS 23 HZ3 LYS 23 24.083 0.095 0.338
237 H ALA 24 H ALA 24 15.717 -1.133 -1.205
238 HA ALA 24 HA ALA 24 17.258 -3.062 -2.766
239 HB1 ALA 24 HB1 ALA 24 15.381 -3.911 -1.436
240 HB2 ALA 24 HB2 ALA 24 15.121 -4.173 -3.161
241 HB3 ALA 24 HB3 ALA 24 14.278 -2.867 -2.331
Start of MODEL 2
1 H1 LYS 1 H1 LYS 1 -15.921 -6.132 8.723
2 H2 LYS 1 H2 LYS 1 -14.442 -6.954 8.596
3 H3 LYS 1 H3 LYS 1 -14.503 -5.277 8.352
4 HA LYS 1 HA LYS 1 -15.166 -4.957 10.654
5 HB2 LYS 1 HB2 LYS 1 -14.644 -7.934 10.829
6 HB3 LYS 1 HB3 LYS 1 -14.903 -6.873 12.208
7 HG2 LYS 1 HG2 LYS 1 -17.161 -6.382 11.410
8 HG3 LYS 1 HG3 LYS 1 -16.901 -7.441 10.022
9 HD2 LYS 1 HD2 LYS 1 -18.162 -8.591 11.760
10 HD3 LYS 1 HD3 LYS 1 -16.577 -9.337 11.547
11 HE2 LYS 1 HE2 LYS 1 -15.745 -8.085 13.488
12 HE3 LYS 1 HE3 LYS 1 -17.346 -7.381 13.708
13 HZ1 LYS 1 HZ1 LYS 1 -16.705 -10.276 13.842
14 HZ2 LYS 1 HZ2 LYS 1 -18.236 -9.587 14.091
15 HZ3 LYS 1 HZ3 LYS 1 -16.972 -9.267 15.178
16 H LYS 2 H LYS 2 -13.403 -3.660 10.541
17 HA LYS 2 HA LYS 2 -11.272 -2.930 10.785
18 HB2 LYS 2 HB2 LYS 2 -10.987 -5.535 12.299
19 HB3 LYS 2 HB3 LYS 2 -9.793 -4.242 12.295
20 HG2 LYS 2 HG2 LYS 2 -11.361 -2.733 13.331
21 HG3 LYS 2 HG3 LYS 2 -12.636 -3.950 13.247
22 HD2 LYS 2 HD2 LYS 2 -11.363 -5.392 14.750
23 HD3 LYS 2 HD3 LYS 2 -10.066 -4.197 14.809
24 HE2 LYS 2 HE2 LYS 2 -11.559 -2.588 15.840
25 HE3 LYS 2 HE3 LYS 2 -12.903 -3.723 15.715
26 HZ1 LYS 2 HZ1 LYS 2 -10.429 -4.214 17.283
27 HZ2 LYS 2 HZ2 LYS 2 -11.822 -5.189 17.245
28 HZ3 LYS 2 HZ3 LYS 2 -11.885 -3.642 17.936
29 H LEU 3 H LEU 3 -11.688 -3.846 8.347
30 HA LEU 3 HA LEU 3 -9.806 -5.876 7.570
31 HB2 LEU 3 HB2 LEU 3 -11.483 -3.972 5.938
32 HB3 LEU 3 HB3 LEU 3 -10.481 -5.240 5.255
33 HG LEU 3 HG LEU 3 -12.822 -5.690 7.115
34 HD11 LEU 3 HD11 LEU 3 -12.570 -6.126 4.140
35 HD12 LEU 3 HD12 LEU 3 -13.524 -4.867 4.925
36 HD13 LEU 3 HD13 LEU 3 -13.956 -6.563 5.138
37 HD21 LEU 3 HD21 LEU 3 -12.532 -8.050 6.504
38 HD22 LEU 3 HD22 LEU 3 -11.116 -7.410 7.340
39 HD23 LEU 3 HD23 LEU 3 -11.085 -7.631 5.589
40 H LYS 4 H LYS 4 -8.225 -4.310 8.859
41 HA LYS 4 HA LYS 4 -6.903 -2.473 7.014
42 HB2 LYS 4 HB2 LYS 4 -7.121 -1.899 9.424
43 HB3 LYS 4 HB3 LYS 4 -6.153 -3.308 9.828
44 HG2 LYS 4 HG2 LYS 4 -4.275 -2.319 8.524
45 HG3 LYS 4 HG3 LYS 4 -5.252 -0.864 8.314
46 HD2 LYS 4 HD2 LYS 4 -5.342 -0.571 10.736
47 HD3 LYS 4 HD3 LYS 4 -4.405 -2.048 10.956
48 HE2 LYS 4 HE2 LYS 4 -2.555 -1.012 9.684
49 HE3 LYS 4 HE3 LYS 4 -3.486 0.482 9.603
50 HZ1 LYS 4 HZ1 LYS 4 -1.889 0.560 11.399
51 HZ2 LYS 4 HZ2 LYS 4 -2.538 -0.854 12.082
52 HZ3 LYS 4 HZ3 LYS 4 -3.467 0.564 12.028
53 H LEU 5 H LEU 5 -6.865 -5.717 7.944
54 HA LEU 5 HA LEU 5 -4.066 -6.169 7.319
55 HB2 LEU 5 HB2 LEU 5 -6.244 -8.106 8.110
56 HB3 LEU 5 HB3 LEU 5 -4.537 -8.486 7.973
57 HG LEU 5 HG LEU 5 -5.725 -6.534 9.948
58 HD11 LEU 5 HD11 LEU 5 -5.196 -8.217 11.626
59 HD12 LEU 5 HD12 LEU 5 -4.657 -9.321 10.361
60 HD13 LEU 5 HD13 LEU 5 -6.350 -8.836 10.445
61 HD21 LEU 5 HD21 LEU 5 -3.444 -5.951 9.303
62 HD22 LEU 5 HD22 LEU 5 -2.914 -7.594 9.662
63 HD23 LEU 5 HD23 LEU 5 -3.499 -6.553 10.960
64 H ALA 6 H ALA 6 -5.301 -5.173 5.144
65 HA ALA 6 HA ALA 6 -5.343 -7.496 3.343
66 HB1 ALA 6 HB1 ALA 6 -7.167 -5.095 3.129
67 HB2 ALA 6 HB2 ALA 6 -7.652 -6.709 3.646
68 HB3 ALA 6 HB3 ALA 6 -7.088 -6.443 1.995
69 HA PRO 7 HA PRO 7 -2.056 -4.339 2.404
70 HB2 PRO 7 HB2 PRO 7 -0.682 -6.755 1.399
71 HB3 PRO 7 HB3 PRO 7 -0.107 -5.512 2.514
72 HG2 PRO 7 HG2 PRO 7 -0.750 -7.955 3.378
73 HG3 PRO 7 HG3 PRO 7 -1.102 -6.512 4.347
74 HD2 PRO 7 HD2 PRO 7 -2.945 -8.148 2.647
75 HD3 PRO 7 HD3 PRO 7 -3.232 -7.428 4.244
76 H ALA 8 H ALA 8 -3.409 -6.900 0.446
77 HA ALA 8 HA ALA 8 -2.326 -6.247 -2.043
78 HB1 ALA 8 HB1 ALA 8 -4.135 -7.572 -2.997
79 HB2 ALA 8 HB2 ALA 8 -4.999 -7.518 -1.462
80 HB3 ALA 8 HB3 ALA 8 -3.457 -8.366 -1.575
81 H LYS 9 H LYS 9 -4.968 -4.787 -0.285
82 HA LYS 9 HA LYS 9 -5.257 -2.870 -2.474
83 HB2 LYS 9 HB2 LYS 9 -7.749 -2.845 -2.063
84 HB3 LYS 9 HB3 LYS 9 -7.119 -4.271 -2.870
85 HG2 LYS 9 HG2 LYS 9 -7.220 -5.512 -0.771
86 HG3 LYS 9 HG3 LYS 9 -7.854 -4.076 0.041
87 HD2 LYS 9 HD2 LYS 9 -9.835 -4.109 -1.292
88 HD3 LYS 9 HD3 LYS 9 -9.175 -5.363 -2.341
89 HE2 LYS 9 HE2 LYS 9 -9.174 -6.923 -0.452
90 HE3 LYS 9 HE3 LYS 9 -9.864 -5.668 0.575
91 HZ1 LYS 9 HZ1 LYS 9 -11.493 -7.296 -0.368
92 HZ2 LYS 9 HZ2 LYS 9 -11.185 -6.629 -1.896
93 HZ3 LYS 9 HZ3 LYS 9 -11.853 -5.666 -0.674
94 H LEU 10 H LEU 10 -3.818 -2.648 -0.047
95 HA LEU 10 HA LEU 10 -5.054 -0.188 0.891
96 HB2 LEU 10 HB2 LEU 10 -5.796 -1.912 2.499
97 HB3 LEU 10 HB3 LEU 10 -4.121 -2.326 2.814
98 HG LEU 10 HG LEU 10 -3.747 -0.045 3.702
99 HD11 LEU 10 HD11 LEU 10 -5.656 1.393 4.166
100 HD12 LEU 10 HD12 LEU 10 -6.726 0.250 3.354
101 HD13 LEU 10 HD13 LEU 10 -5.489 1.106 2.434
102 HD21 LEU 10 HD21 LEU 10 -4.280 -1.865 5.222
103 HD22 LEU 10 HD22 LEU 10 -6.004 -1.579 4.986
104 HD23 LEU 10 HD23 LEU 10 -5.009 -0.360 5.783
105 H ALA 11 H ALA 11 -2.336 -2.318 1.754
106 HA ALA 11 HA ALA 11 -0.495 -0.064 1.582
107 HB1 ALA 11 HB1 ALA 11 -0.290 -1.617 3.473
108 HB2 ALA 11 HB2 ALA 11 1.169 -1.599 2.482
109 HB3 ALA 11 HB3 ALA 11 0.030 -2.939 2.349
110 H LEU 12 H LEU 12 -1.624 -0.575 -0.819
111 HA LEU 12 HA LEU 12 -0.330 -2.585 -2.355
112 HB2 LEU 12 HB2 LEU 12 -2.579 -1.754 -2.859
113 HB3 LEU 12 HB3 LEU 12 -1.918 -0.173 -3.232
114 HG LEU 12 HG LEU 12 -0.681 -1.157 -5.133
115 HD11 LEU 12 HD11 LEU 12 -0.440 -3.422 -4.279
116 HD12 LEU 12 HD12 LEU 12 -1.212 -3.428 -5.865
117 HD13 LEU 12 HD13 LEU 12 -2.182 -3.670 -4.412
118 HD21 LEU 12 HD21 LEU 12 -2.906 -0.165 -5.453
119 HD22 LEU 12 HD22 LEU 12 -3.639 -1.746 -5.175
120 HD23 LEU 12 HD23 LEU 12 -2.602 -1.487 -6.579
121 H LEU 13 H LEU 13 -0.069 0.970 -2.392
122 HA LEU 13 HA LEU 13 2.169 0.797 -4.235
123 HB2 LEU 13 HB2 LEU 13 0.326 2.468 -4.484
124 HB3 LEU 13 HB3 LEU 13 0.884 3.241 -3.014
125 HG LEU 13 HG LEU 13 3.049 3.725 -4.118
126 HD11 LEU 13 HD11 LEU 13 3.233 3.455 -6.548
127 HD12 LEU 13 HD12 LEU 13 1.687 2.607 -6.566
128 HD13 LEU 13 HD13 LEU 13 3.068 1.899 -5.731
129 HD21 LEU 13 HD21 LEU 13 2.198 5.475 -5.607
130 HD22 LEU 13 HD22 LEU 13 1.278 5.393 -4.103
131 HD23 LEU 13 HD23 LEU 13 0.607 4.712 -5.585
132 H TRP 14 H TRP 14 1.829 0.579 -0.984
133 HA TRP 14 HA TRP 14 3.835 2.306 0.008
134 HB2 TRP 14 HB2 TRP 14 2.017 1.308 1.383
135 HB3 TRP 14 HB3 TRP 14 2.790 -0.264 1.222
136 HD1 TRP 14 HD1 TRP 14 3.789 3.258 2.544
137 HE1 TRP 14 HE1 TRP 14 5.241 2.926 4.649
138 HE3 TRP 14 HE3 TRP 14 3.948 -1.854 2.619
139 HZ2 TRP 14 HZ2 TRP 14 6.307 0.779 6.132
140 HZ3 TRP 14 HZ3 TRP 14 5.206 -2.968 4.415
141 HH2 TRP 14 HH2 TRP 14 6.361 -1.679 6.137
142 H LYS 15 H LYS 15 4.019 -0.572 -1.771
143 HA LYS 15 HA LYS 15 6.310 -1.826 -0.827
144 HB2 LYS 15 HB2 LYS 15 5.510 -1.473 -3.721
145 HB3 LYS 15 HB3 LYS 15 6.618 -2.684 -3.096
146 HG2 LYS 15 HG2 LYS 15 4.728 -3.610 -1.760
147 HG3 LYS 15 HG3 LYS 15 3.657 -2.492 -2.611
148 HD2 LYS 15 HD2 LYS 15 4.425 -3.475 -4.754
149 HD3 LYS 15 HD3 LYS 15 5.362 -4.657 -3.842
150 HE2 LYS 15 HE2 LYS 15 3.326 -5.709 -4.470
151 HE3 LYS 15 HE3 LYS 15 3.220 -5.361 -2.746
152 HZ1 LYS 15 HZ1 LYS 15 1.172 -4.807 -3.916
153 HZ2 LYS 15 HZ2 LYS 15 2.015 -3.721 -4.910
154 HZ3 LYS 15 HZ3 LYS 15 1.885 -3.419 -3.249
155 H ALA 16 H ALA 16 5.974 0.924 -3.025
156 HA ALA 16 HA ALA 16 8.657 1.179 -3.779
157 HB1 ALA 16 HB1 ALA 16 6.583 3.357 -3.523
158 HB2 ALA 16 HB2 ALA 16 6.805 2.307 -4.921
159 HB3 ALA 16 HB3 ALA 16 8.075 3.441 -4.463
160 H LEU 17 H LEU 17 6.912 2.400 -0.991
161 HA LEU 17 HA LEU 17 9.000 4.134 -0.102
162 HB2 LEU 17 HB2 LEU 17 6.568 3.035 1.310
163 HB3 LEU 17 HB3 LEU 17 7.684 4.163 2.047
164 HG LEU 17 HG LEU 17 7.125 5.751 0.130
165 HD11 LEU 17 HD11 LEU 17 6.112 4.120 -1.372
166 HD12 LEU 17 HD12 LEU 17 4.986 5.417 -0.973
167 HD13 LEU 17 HD13 LEU 17 4.821 3.839 -0.203
168 HD21 LEU 17 HD21 LEU 17 5.099 6.526 1.235
169 HD22 LEU 17 HD22 LEU 17 6.322 6.041 2.411
170 HD23 LEU 17 HD23 LEU 17 4.954 4.980 2.069
171 H ALA 18 H ALA 18 7.793 0.972 1.000
172 HA ALA 18 HA ALA 18 9.703 0.689 3.070
173 HB1 ALA 18 HB1 ALA 18 7.587 -0.502 3.094
174 HB2 ALA 18 HB2 ALA 18 8.940 -1.630 3.192
175 HB3 ALA 18 HB3 ALA 18 8.074 -1.420 1.670
176 H LEU 19 H LEU 19 9.763 -0.103 -0.320
177 HA LEU 19 HA LEU 19 11.877 -1.978 -0.237
178 HB2 LEU 19 HB2 LEU 19 10.417 -1.832 -2.156
179 HB3 LEU 19 HB3 LEU 19 10.915 -0.178 -2.459
180 HG LEU 19 HG LEU 19 13.214 -1.003 -2.937
181 HD11 LEU 19 HD11 LEU 19 11.920 -3.717 -2.733
182 HD12 LEU 19 HD12 LEU 19 13.147 -3.063 -1.647
183 HD13 LEU 19 HD13 LEU 19 13.547 -3.391 -3.333
184 HD21 LEU 19 HD21 LEU 19 11.024 -2.230 -4.606
185 HD22 LEU 19 HD22 LEU 19 12.682 -1.928 -5.126
186 HD23 LEU 19 HD23 LEU 19 11.620 -0.574 -4.733
187 H LYS 20 H LYS 20 11.829 1.545 -0.627
188 HA LYS 20 HA LYS 20 14.565 1.645 -1.443
189 HB2 LYS 20 HB2 LYS 20 12.654 3.830 -0.631
190 HB3 LYS 20 HB3 LYS 20 14.280 4.119 -1.242
191 HG2 LYS 20 HG2 LYS 20 13.627 2.837 -3.300
192 HG3 LYS 20 HG3 LYS 20 11.970 2.847 -2.694
193 HD2 LYS 20 HD2 LYS 20 12.301 4.651 -4.284
194 HD3 LYS 20 HD3 LYS 20 12.006 5.300 -2.671
195 HE2 LYS 20 HE2 LYS 20 14.367 5.709 -2.358
196 HE3 LYS 20 HE3 LYS 20 14.735 4.942 -3.901
197 HZ1 LYS 20 HZ1 LYS 20 13.016 7.345 -3.665
198 HZ2 LYS 20 HZ2 LYS 20 13.706 6.694 -5.071
199 HZ3 LYS 20 HZ3 LYS 20 14.694 7.428 -3.901
200 H LEU 21 H LEU 21 13.144 1.339 1.604
201 HA LEU 21 HA LEU 21 15.388 2.529 3.008
202 HB2 LEU 21 HB2 LEU 21 12.913 1.086 3.867
203 HB3 LEU 21 HB3 LEU 21 14.263 1.212 4.978
204 HG LEU 21 HG LEU 21 14.152 3.717 4.682
205 HD11 LEU 21 HD11 LEU 21 11.521 3.060 3.371
206 HD12 LEU 21 HD12 LEU 21 12.928 3.764 2.577
207 HD13 LEU 21 HD13 LEU 21 12.079 4.669 3.830
208 HD21 LEU 21 HD21 LEU 21 11.734 2.334 5.824
209 HD22 LEU 21 HD22 LEU 21 12.252 3.978 6.192
210 HD23 LEU 21 HD23 LEU 21 13.267 2.610 6.652
211 H LYS 22 H LYS 22 14.487 -0.503 1.671
212 HA LYS 22 HA LYS 22 16.623 -1.929 3.062
213 HB2 LYS 22 HB2 LYS 22 14.737 -2.911 0.908
214 HB3 LYS 22 HB3 LYS 22 15.815 -3.904 1.875
215 HG2 LYS 22 HG2 LYS 22 14.533 -3.383 3.873
216 HG3 LYS 22 HG3 LYS 22 13.476 -2.326 2.933
217 HD2 LYS 22 HD2 LYS 22 12.832 -4.263 1.542
218 HD3 LYS 22 HD3 LYS 22 13.826 -5.301 2.563
219 HE2 LYS 22 HE2 LYS 22 11.504 -5.472 3.219
220 HE3 LYS 22 HE3 LYS 22 12.437 -4.693 4.497
221 HZ1 LYS 22 HZ1 LYS 22 11.419 -2.697 4.154
222 HZ2 LYS 22 HZ2 LYS 22 10.150 -3.731 3.699
223 HZ3 LYS 22 HZ3 LYS 22 11.111 -2.996 2.517
224 H LYS 23 H LYS 23 15.748 -0.601 -0.020
225 HA LYS 23 HA LYS 23 16.936 0.081 -1.808
226 HB2 LYS 23 HB2 LYS 23 19.340 -0.803 -0.215
227 HB3 LYS 23 HB3 LYS 23 19.430 0.001 -1.777
228 HG2 LYS 23 HG2 LYS 23 18.228 1.936 -0.803
229 HG3 LYS 23 HG3 LYS 23 18.281 1.134 0.768
230 HD2 LYS 23 HD2 LYS 23 20.707 1.851 -0.878
231 HD3 LYS 23 HD3 LYS 23 20.076 2.820 0.455
232 HE2 LYS 23 HE2 LYS 23 20.505 1.062 2.018
233 HE3 LYS 23 HE3 LYS 23 20.938 -0.055 0.724
234 HZ1 LYS 23 HZ1 LYS 23 22.877 0.879 1.877
235 HZ2 LYS 23 HZ2 LYS 23 22.421 2.435 1.381
236 HZ3 LYS 23 HZ3 LYS 23 22.859 1.270 0.228
237 H ALA 24 H ALA 24 16.982 -3.100 -0.670
238 HA ALA 24 HA ALA 24 17.209 -4.105 -3.378
239 HB1 ALA 24 HB1 ALA 24 19.529 -4.152 -2.572
240 HB2 ALA 24 HB2 ALA 24 18.890 -5.779 -2.811
241 HB3 ALA 24 HB3 ALA 24 19.019 -5.117 -1.182
Start of MODEL 3
1 H1 LYS 1 H1 LYS 1 -23.912 -1.056 2.287
2 H2 LYS 1 H2 LYS 1 -24.251 0.034 3.539
3 H3 LYS 1 H3 LYS 1 -23.379 -1.384 3.867
4 HA LYS 1 HA LYS 1 -22.489 0.901 2.204
5 HB2 LYS 1 HB2 LYS 1 -22.443 1.263 4.667
6 HB3 LYS 1 HB3 LYS 1 -21.433 -0.166 4.837
7 HG2 LYS 1 HG2 LYS 1 -20.002 1.713 4.943
8 HG3 LYS 1 HG3 LYS 1 -19.746 0.965 3.367
9 HD2 LYS 1 HD2 LYS 1 -19.852 3.374 3.126
10 HD3 LYS 1 HD3 LYS 1 -21.257 2.634 2.359
11 HE2 LYS 1 HE2 LYS 1 -22.639 3.189 4.271
12 HE3 LYS 1 HE3 LYS 1 -21.240 3.835 5.128
13 HZ1 LYS 1 HZ1 LYS 1 -22.672 5.545 4.073
14 HZ2 LYS 1 HZ2 LYS 1 -22.245 4.925 2.553
15 HZ3 LYS 1 HZ3 LYS 1 -21.058 5.599 3.557
16 H LYS 2 H LYS 2 -21.723 -0.118 0.423
17 HA LYS 2 HA LYS 2 -20.123 -2.539 0.726
18 HB2 LYS 2 HB2 LYS 2 -20.173 -2.607 -1.749
19 HB3 LYS 2 HB3 LYS 2 -21.779 -2.557 -1.037
20 HG2 LYS 2 HG2 LYS 2 -21.882 -0.141 -1.499
21 HG3 LYS 2 HG3 LYS 2 -20.303 -0.249 -2.278
22 HD2 LYS 2 HD2 LYS 2 -21.176 -1.744 -3.954
23 HD3 LYS 2 HD3 LYS 2 -22.738 -1.807 -3.134
24 HE2 LYS 2 HE2 LYS 2 -22.856 -0.307 -5.028
25 HE3 LYS 2 HE3 LYS 2 -23.019 0.601 -3.525
26 HZ1 LYS 2 HZ1 LYS 2 -21.558 1.755 -5.013
27 HZ2 LYS 2 HZ2 LYS 2 -20.579 0.381 -5.202
28 HZ3 LYS 2 HZ3 LYS 2 -20.642 1.171 -3.709
29 H LEU 3 H LEU 3 -19.623 0.745 0.671
30 HA LEU 3 HA LEU 3 -17.095 0.704 -0.727
31 HB2 LEU 3 HB2 LEU 3 -18.616 2.662 -0.818
32 HB3 LEU 3 HB3 LEU 3 -18.354 2.917 0.896
33 HG LEU 3 HG LEU 3 -15.954 3.313 0.453
34 HD11 LEU 3 HD11 LEU 3 -15.195 3.656 -1.838
35 HD12 LEU 3 HD12 LEU 3 -16.765 3.129 -2.442
36 HD13 LEU 3 HD13 LEU 3 -15.726 1.994 -1.580
37 HD21 LEU 3 HD21 LEU 3 -16.221 5.508 -0.557
38 HD22 LEU 3 HD22 LEU 3 -17.533 5.178 0.575
39 HD23 LEU 3 HD23 LEU 3 -17.813 5.048 -1.161
40 H LYS 4 H LYS 4 -16.370 -1.061 0.808
41 HA LYS 4 HA LYS 4 -14.862 0.229 2.974
42 HB2 LYS 4 HB2 LYS 4 -15.306 -1.469 4.545
43 HB3 LYS 4 HB3 LYS 4 -16.868 -1.097 3.840
44 HG2 LYS 4 HG2 LYS 4 -15.160 -3.415 2.972
45 HG3 LYS 4 HG3 LYS 4 -16.398 -3.523 4.220
46 HD2 LYS 4 HD2 LYS 4 -18.100 -2.861 2.598
47 HD3 LYS 4 HD3 LYS 4 -16.861 -2.714 1.348
48 HE2 LYS 4 HE2 LYS 4 -16.343 -5.098 1.592
49 HE3 LYS 4 HE3 LYS 4 -17.595 -5.243 2.825
50 HZ1 LYS 4 HZ1 LYS 4 -19.257 -4.660 1.185
51 HZ2 LYS 4 HZ2 LYS 4 -18.351 -5.987 0.634
52 HZ3 LYS 4 HZ3 LYS 4 -18.059 -4.444 -0.001
53 H LEU 5 H LEU 5 -14.518 -0.975 0.122
54 HA LEU 5 HA LEU 5 -12.134 -2.566 0.773
55 HB2 LEU 5 HB2 LEU 5 -13.932 -4.059 0.018
56 HB3 LEU 5 HB3 LEU 5 -14.121 -3.107 -1.441
57 HG LEU 5 HG LEU 5 -11.844 -3.750 -2.145
58 HD11 LEU 5 HD11 LEU 5 -10.686 -5.554 -0.948
59 HD12 LEU 5 HD12 LEU 5 -11.904 -5.478 0.326
60 HD13 LEU 5 HD13 LEU 5 -10.843 -4.100 0.037
61 HD21 LEU 5 HD21 LEU 5 -12.372 -6.062 -2.692
62 HD22 LEU 5 HD22 LEU 5 -13.792 -5.032 -2.877
63 HD23 LEU 5 HD23 LEU 5 -13.637 -6.075 -1.463
64 H ALA 6 H ALA 6 -10.669 -0.954 0.382
65 HA ALA 6 HA ALA 6 -10.285 -0.259 -2.423
66 HB1 ALA 6 HB1 ALA 6 -11.588 1.607 -1.556
67 HB2 ALA 6 HB2 ALA 6 -9.939 2.120 -1.921
68 HB3 ALA 6 HB3 ALA 6 -10.426 1.831 -0.250
69 HA PRO 7 HA PRO 7 -6.479 -1.511 0.000
70 HB2 PRO 7 HB2 PRO 7 -5.935 -3.088 -2.430
71 HB3 PRO 7 HB3 PRO 7 -5.959 -3.597 -0.739
72 HG2 PRO 7 HG2 PRO 7 -7.884 -4.327 -2.458
73 HG3 PRO 7 HG3 PRO 7 -8.230 -3.986 -0.753
74 HD2 PRO 7 HD2 PRO 7 -8.670 -2.256 -3.159
75 HD3 PRO 7 HD3 PRO 7 -9.728 -2.523 -1.758
76 H ALA 8 H ALA 8 -7.013 -0.415 -3.270
77 HA ALA 8 HA ALA 8 -4.296 0.177 -3.889
78 HB1 ALA 8 HB1 ALA 8 -6.822 1.268 -5.130
79 HB2 ALA 8 HB2 ALA 8 -5.972 -0.193 -5.633
80 HB3 ALA 8 HB3 ALA 8 -5.199 1.382 -5.809
81 H LYS 9 H LYS 9 -6.612 1.693 -1.924
82 HA LYS 9 HA LYS 9 -5.299 4.300 -2.132
83 HB2 LYS 9 HB2 LYS 9 -7.740 3.509 -0.533
84 HB3 LYS 9 HB3 LYS 9 -7.143 5.144 -0.782
85 HG2 LYS 9 HG2 LYS 9 -7.581 4.901 -3.201
86 HG3 LYS 9 HG3 LYS 9 -8.257 3.302 -2.888
87 HD2 LYS 9 HD2 LYS 9 -10.082 4.833 -3.035
88 HD3 LYS 9 HD3 LYS 9 -9.894 4.396 -1.336
89 HE2 LYS 9 HE2 LYS 9 -8.644 6.477 -0.956
90 HE3 LYS 9 HE3 LYS 9 -8.876 6.915 -2.647
91 HZ1 LYS 9 HZ1 LYS 9 -10.939 6.665 -0.535
92 HZ2 LYS 9 HZ2 LYS 9 -11.325 6.771 -2.184
93 HZ3 LYS 9 HZ3 LYS 9 -10.517 8.049 -1.423
94 H LEU 10 H LEU 10 -4.723 1.525 -0.569
95 HA LEU 10 HA LEU 10 -3.782 2.892 1.860
96 HB2 LEU 10 HB2 LEU 10 -5.038 0.151 1.707
97 HB3 LEU 10 HB3 LEU 10 -4.314 0.845 3.143
98 HG LEU 10 HG LEU 10 -6.742 1.933 1.717
99 HD11 LEU 10 HD11 LEU 10 -7.203 -0.182 2.820
100 HD12 LEU 10 HD12 LEU 10 -7.968 1.152 3.683
101 HD13 LEU 10 HD13 LEU 10 -6.489 0.426 4.313
102 HD21 LEU 10 HD21 LEU 10 -6.950 3.383 3.679
103 HD22 LEU 10 HD22 LEU 10 -5.453 3.687 2.796
104 HD23 LEU 10 HD23 LEU 10 -5.420 2.760 4.297
105 H ALA 11 H ALA 11 -3.517 -0.410 0.533
106 HA ALA 11 HA ALA 11 -0.796 -0.522 1.515
107 HB1 ALA 11 HB1 ALA 11 -2.294 -2.389 1.911
108 HB2 ALA 11 HB2 ALA 11 -0.906 -2.892 0.946
109 HB3 ALA 11 HB3 ALA 11 -2.472 -2.634 0.175
110 H LEU 12 H LEU 12 -1.980 0.710 -1.230
111 HA LEU 12 HA LEU 12 -0.238 -0.501 -3.159
112 HB2 LEU 12 HB2 LEU 12 -2.375 0.612 -3.760
113 HB3 LEU 12 HB3 LEU 12 -1.676 2.150 -3.291
114 HG LEU 12 HG LEU 12 0.041 1.873 -5.072
115 HD11 LEU 12 HD11 LEU 12 0.000 -0.563 -5.219
116 HD12 LEU 12 HD12 LEU 12 -0.294 0.184 -6.790
117 HD13 LEU 12 HD13 LEU 12 -1.637 -0.500 -5.872
118 HD21 LEU 12 HD21 LEU 12 -2.825 1.747 -6.007
119 HD22 LEU 12 HD22 LEU 12 -1.459 2.362 -6.939
120 HD23 LEU 12 HD23 LEU 12 -1.976 3.193 -5.471
121 H LEU 13 H LEU 13 -0.114 2.274 -1.032
122 HA LEU 13 HA LEU 13 2.411 3.179 -2.154
123 HB2 LEU 13 HB2 LEU 13 0.668 4.810 -1.474
124 HB3 LEU 13 HB3 LEU 13 0.810 4.246 0.178
125 HG LEU 13 HG LEU 13 3.161 5.027 0.218
126 HD11 LEU 13 HD11 LEU 13 2.496 6.199 -2.476
127 HD12 LEU 13 HD12 LEU 13 3.643 4.897 -2.164
128 HD13 LEU 13 HD13 LEU 13 3.957 6.516 -1.540
129 HD21 LEU 13 HD21 LEU 13 2.643 7.400 0.362
130 HD22 LEU 13 HD22 LEU 13 1.351 6.433 1.074
131 HD23 LEU 13 HD23 LEU 13 1.144 7.139 -0.529
132 H TRP 14 H TRP 14 3.063 0.852 -1.454
133 HA TRP 14 HA TRP 14 4.508 1.132 1.077
134 HB2 TRP 14 HB2 TRP 14 2.359 -0.152 1.450
135 HB3 TRP 14 HB3 TRP 14 2.997 -1.394 0.380
136 HD1 TRP 14 HD1 TRP 14 3.365 0.030 3.881
137 HE1 TRP 14 HE1 TRP 14 4.806 -1.564 5.300
138 HE3 TRP 14 HE3 TRP 14 4.926 -3.136 0.186
139 HZ2 TRP 14 HZ2 TRP 14 6.404 -3.855 4.895
140 HZ3 TRP 14 HZ3 TRP 14 6.414 -5.002 0.788
141 HH2 TRP 14 HH2 TRP 14 7.135 -5.350 3.094
142 H LYS 15 H LYS 15 4.015 -0.625 -1.933
143 HA LYS 15 HA LYS 15 6.196 -2.340 -1.825
144 HB2 LYS 15 HB2 LYS 15 4.761 -1.112 -4.173
145 HB3 LYS 15 HB3 LYS 15 6.024 -2.323 -4.353
146 HG2 LYS 15 HG2 LYS 15 4.712 -3.905 -3.051
147 HG3 LYS 15 HG3 LYS 15 3.452 -2.689 -2.832
148 HD2 LYS 15 HD2 LYS 15 2.898 -2.711 -5.132
149 HD3 LYS 15 HD3 LYS 15 4.361 -3.606 -5.551
150 HE2 LYS 15 HE2 LYS 15 2.119 -4.687 -3.848
151 HE3 LYS 15 HE3 LYS 15 2.296 -4.987 -5.578
152 HZ1 LYS 15 HZ1 LYS 15 4.290 -5.729 -3.498
153 HZ2 LYS 15 HZ2 LYS 15 4.403 -6.059 -5.159
154 HZ3 LYS 15 HZ3 LYS 15 3.193 -6.800 -4.228
155 H ALA 16 H ALA 16 6.015 0.754 -3.599
156 HA ALA 16 HA ALA 16 8.797 0.747 -4.218
157 HB1 ALA 16 HB1 ALA 16 6.838 3.038 -4.298
158 HB2 ALA 16 HB2 ALA 16 7.151 1.906 -5.615
159 HB3 ALA 16 HB3 ALA 16 8.422 2.999 -5.066
160 H LEU 17 H LEU 17 6.985 1.710 -1.487
161 HA LEU 17 HA LEU 17 8.796 3.661 -0.469
162 HB2 LEU 17 HB2 LEU 17 6.436 3.577 0.206
163 HB3 LEU 17 HB3 LEU 17 6.698 2.012 0.951
164 HG LEU 17 HG LEU 17 8.242 3.055 2.570
165 HD11 LEU 17 HD11 LEU 17 9.019 4.923 1.230
166 HD12 LEU 17 HD12 LEU 17 8.323 5.500 2.744
167 HD13 LEU 17 HD13 LEU 17 7.402 5.630 1.246
168 HD21 LEU 17 HD21 LEU 17 5.895 2.767 3.144
169 HD22 LEU 17 HD22 LEU 17 5.515 4.331 2.423
170 HD23 LEU 17 HD23 LEU 17 6.535 4.245 3.860
171 H ALA 18 H ALA 18 8.079 0.312 0.550
172 HA ALA 18 HA ALA 18 10.263 0.163 2.353
173 HB1 ALA 18 HB1 ALA 18 9.744 -2.202 2.505
174 HB2 ALA 18 HB2 ALA 18 8.741 -2.096 1.057
175 HB3 ALA 18 HB3 ALA 18 8.259 -1.248 2.525
176 H LEU 19 H LEU 19 9.946 -0.401 -1.049
177 HA LEU 19 HA LEU 19 12.063 -2.123 -1.564
178 HB2 LEU 19 HB2 LEU 19 10.363 -1.373 -3.210
179 HB3 LEU 19 HB3 LEU 19 11.154 0.189 -3.275
180 HG LEU 19 HG LEU 19 13.204 -0.923 -4.137
181 HD11 LEU 19 HD11 LEU 19 13.054 -3.227 -4.919
182 HD12 LEU 19 HD12 LEU 19 11.426 -3.355 -4.252
183 HD13 LEU 19 HD13 LEU 19 12.805 -3.133 -3.176
184 HD21 LEU 19 HD21 LEU 19 12.326 -1.349 -6.378
185 HD22 LEU 19 HD22 LEU 19 11.595 0.090 -5.664
186 HD23 LEU 19 HD23 LEU 19 10.689 -1.422 -5.724
187 H LYS 20 H LYS 20 12.082 1.424 -1.398
188 HA LYS 20 HA LYS 20 14.996 1.404 -1.568
189 HB2 LYS 20 HB2 LYS 20 14.736 3.908 -1.631
190 HB3 LYS 20 HB3 LYS 20 14.024 3.041 -2.982
191 HG2 LYS 20 HG2 LYS 20 11.818 3.292 -2.028
192 HG3 LYS 20 HG3 LYS 20 12.503 4.065 -0.595
193 HD2 LYS 20 HD2 LYS 20 13.253 5.936 -1.885
194 HD3 LYS 20 HD3 LYS 20 12.814 5.138 -3.395
195 HE2 LYS 20 HE2 LYS 20 10.832 5.850 -1.244
196 HE3 LYS 20 HE3 LYS 20 11.212 6.900 -2.607
197 HZ1 LYS 20 HZ1 LYS 20 10.434 5.227 -4.120
198 HZ2 LYS 20 HZ2 LYS 20 9.223 5.530 -2.972
199 HZ3 LYS 20 HZ3 LYS 20 10.170 4.132 -2.852
200 H LEU 21 H LEU 21 12.645 1.284 0.783
201 HA LEU 21 HA LEU 21 13.971 2.862 2.780
202 HB2 LEU 21 HB2 LEU 21 11.515 2.403 2.773
203 HB3 LEU 21 HB3 LEU 21 11.867 0.727 3.147
204 HG LEU 21 HG LEU 21 12.885 1.425 5.283
205 HD11 LEU 21 HD11 LEU 21 11.933 4.177 4.501
206 HD12 LEU 21 HD12 LEU 21 13.614 3.660 4.629
207 HD13 LEU 21 HD13 LEU 21 12.597 3.719 6.069
208 HD21 LEU 21 HD21 LEU 21 10.080 2.423 4.807
209 HD22 LEU 21 HD22 LEU 21 10.794 2.102 6.387
210 HD23 LEU 21 HD23 LEU 21 10.552 0.780 5.245
211 H LYS 22 H LYS 22 13.876 -0.532 1.839
212 HA LYS 22 HA LYS 22 15.818 -1.217 3.900
213 HB2 LYS 22 HB2 LYS 22 15.633 -3.503 3.084
214 HB3 LYS 22 HB3 LYS 22 14.030 -2.830 3.344
215 HG2 LYS 22 HG2 LYS 22 13.870 -2.389 0.915
216 HG3 LYS 22 HG3 LYS 22 15.432 -3.178 0.702
217 HD2 LYS 22 HD2 LYS 22 13.023 -4.518 1.930
218 HD3 LYS 22 HD3 LYS 22 13.440 -4.632 0.222
219 HE2 LYS 22 HE2 LYS 22 14.343 -6.580 1.138
220 HE3 LYS 22 HE3 LYS 22 15.721 -5.489 1.044
221 HZ1 LYS 22 HZ1 LYS 22 14.118 -6.091 3.474
222 HZ2 LYS 22 HZ2 LYS 22 15.380 -4.968 3.405
223 HZ3 LYS 22 HZ3 LYS 22 15.705 -6.608 3.159
224 H LYS 23 H LYS 23 15.645 -0.301 0.625
225 HA LYS 23 HA LYS 23 17.141 0.175 -0.991
226 HB2 LYS 23 HB2 LYS 23 17.940 1.608 0.932
227 HB3 LYS 23 HB3 LYS 23 19.159 0.381 1.245
228 HG2 LYS 23 HG2 LYS 23 20.032 2.279 -0.047
229 HG3 LYS 23 HG3 LYS 23 20.151 0.756 -0.929
230 HD2 LYS 23 HD2 LYS 23 19.383 2.410 -2.461
231 HD3 LYS 23 HD3 LYS 23 18.015 1.362 -2.088
232 HE2 LYS 23 HE2 LYS 23 17.183 3.569 -2.045
233 HE3 LYS 23 HE3 LYS 23 17.333 3.071 -0.361
234 HZ1 LYS 23 HZ1 LYS 23 19.387 4.318 -0.194
235 HZ2 LYS 23 HZ2 LYS 23 18.141 5.329 -0.750
236 HZ3 LYS 23 HZ3 LYS 23 19.301 4.740 -1.836
237 H ALA 24 H ALA 24 16.728 -2.547 -0.652
238 HA ALA 24 HA ALA 24 19.396 -3.651 -1.208
239 HB1 ALA 24 HB1 ALA 24 18.361 -4.608 0.805
240 HB2 ALA 24 HB2 ALA 24 18.579 -5.813 -0.465
241 HB3 ALA 24 HB3 ALA 24 16.982 -5.127 -0.163
Start of MODEL 4
1 H1 LYS 1 H1 LYS 1 -23.891 -1.618 -5.699
2 H2 LYS 1 H2 LYS 1 -23.919 -1.390 -7.381
3 H3 LYS 1 H3 LYS 1 -24.445 -0.151 -6.349
4 HA LYS 1 HA LYS 1 -21.690 -1.211 -6.419
5 HB2 LYS 1 HB2 LYS 1 -21.155 1.022 -7.474
6 HB3 LYS 1 HB3 LYS 1 -22.012 -0.112 -8.506
7 HG2 LYS 1 HG2 LYS 1 -24.081 1.077 -8.171
8 HG3 LYS 1 HG3 LYS 1 -23.315 2.144 -6.992
9 HD2 LYS 1 HD2 LYS 1 -22.486 1.920 -9.883
10 HD3 LYS 1 HD3 LYS 1 -23.574 3.159 -9.252
11 HE2 LYS 1 HE2 LYS 1 -20.755 2.703 -8.286
12 HE3 LYS 1 HE3 LYS 1 -21.213 3.910 -9.484
13 HZ1 LYS 1 HZ1 LYS 1 -22.297 3.816 -6.720
14 HZ2 LYS 1 HZ2 LYS 1 -22.545 5.037 -7.869
15 HZ3 LYS 1 HZ3 LYS 1 -21.005 4.798 -7.204
16 H LYS 2 H LYS 2 -22.221 -1.282 -4.048
17 HA LYS 2 HA LYS 2 -21.584 1.344 -2.884
18 HB2 LYS 2 HB2 LYS 2 -24.009 0.633 -2.564
19 HB3 LYS 2 HB3 LYS 2 -23.400 -0.672 -1.558
20 HG2 LYS 2 HG2 LYS 2 -22.426 0.952 -0.024
21 HG3 LYS 2 HG3 LYS 2 -23.010 2.272 -1.044
22 HD2 LYS 2 HD2 LYS 2 -25.316 1.509 -0.687
23 HD3 LYS 2 HD3 LYS 2 -24.717 0.220 0.360
24 HE2 LYS 2 HE2 LYS 2 -23.808 1.874 1.896
25 HE3 LYS 2 HE3 LYS 2 -24.351 3.175 0.837
26 HZ1 LYS 2 HZ1 LYS 2 -25.875 2.829 2.681
27 HZ2 LYS 2 HZ2 LYS 2 -26.117 1.219 2.205
28 HZ3 LYS 2 HZ3 LYS 2 -26.631 2.485 1.201
29 H LEU 3 H LEU 3 -19.573 -0.253 -3.531
30 HA LEU 3 HA LEU 3 -18.875 -1.824 -1.154
31 HB2 LEU 3 HB2 LEU 3 -17.677 -1.692 -3.920
32 HB3 LEU 3 HB3 LEU 3 -16.904 -2.533 -2.592
33 HG LEU 3 HG LEU 3 -19.023 -3.941 -2.431
34 HD11 LEU 3 HD11 LEU 3 -19.506 -2.721 -5.142
35 HD12 LEU 3 HD12 LEU 3 -20.508 -2.497 -3.708
36 HD13 LEU 3 HD13 LEU 3 -20.382 -4.089 -4.457
37 HD21 LEU 3 HD21 LEU 3 -17.350 -4.083 -4.934
38 HD22 LEU 3 HD22 LEU 3 -18.321 -5.398 -4.269
39 HD23 LEU 3 HD23 LEU 3 -16.939 -4.777 -3.366
40 H LYS 4 H LYS 4 -17.772 -0.821 0.360
41 HA LYS 4 HA LYS 4 -16.135 1.503 -0.282
42 HB2 LYS 4 HB2 LYS 4 -16.919 0.211 2.327
43 HB3 LYS 4 HB3 LYS 4 -15.733 1.501 2.240
44 HG2 LYS 4 HG2 LYS 4 -17.778 2.501 2.848
45 HG3 LYS 4 HG3 LYS 4 -17.502 2.919 1.158
46 HD2 LYS 4 HD2 LYS 4 -19.092 1.277 0.428
47 HD3 LYS 4 HD3 LYS 4 -19.253 0.636 2.065
48 HE2 LYS 4 HE2 LYS 4 -20.013 3.431 1.214
49 HE3 LYS 4 HE3 LYS 4 -21.142 2.089 1.400
50 HZ1 LYS 4 HZ1 LYS 4 -21.112 3.503 3.362
51 HZ2 LYS 4 HZ2 LYS 4 -19.449 3.235 3.560
52 HZ3 LYS 4 HZ3 LYS 4 -20.543 1.948 3.737
53 H LEU 5 H LEU 5 -15.876 -1.814 0.688
54 HA LEU 5 HA LEU 5 -12.989 -1.646 1.037
55 HB2 LEU 5 HB2 LEU 5 -14.851 -4.014 1.265
56 HB3 LEU 5 HB3 LEU 5 -13.149 -4.010 1.685
57 HG LEU 5 HG LEU 5 -15.291 -2.385 3.064
58 HD11 LEU 5 HD11 LEU 5 -14.926 -3.912 4.932
59 HD12 LEU 5 HD12 LEU 5 -13.777 -4.833 3.961
60 HD13 LEU 5 HD13 LEU 5 -15.478 -4.781 3.499
61 HD21 LEU 5 HD21 LEU 5 -13.544 -1.850 4.676
62 HD22 LEU 5 HD22 LEU 5 -13.103 -1.283 3.065
63 HD23 LEU 5 HD23 LEU 5 -12.368 -2.747 3.716
64 H ALA 6 H ALA 6 -12.852 -0.973 -1.278
65 HA ALA 6 HA ALA 6 -12.418 -3.377 -2.907
66 HB1 ALA 6 HB1 ALA 6 -13.562 -0.782 -3.938
67 HB2 ALA 6 HB2 ALA 6 -14.465 -2.277 -3.692
68 HB3 ALA 6 HB3 ALA 6 -13.183 -2.210 -4.902
69 HA PRO 7 HA PRO 7 -8.622 -0.747 -2.662
70 HB2 PRO 7 HB2 PRO 7 -7.178 -3.141 -1.945
71 HB3 PRO 7 HB3 PRO 7 -7.463 -1.699 -0.972
72 HG2 PRO 7 HG2 PRO 7 -8.549 -4.146 -0.418
73 HG3 PRO 7 HG3 PRO 7 -9.283 -2.606 0.070
74 HD2 PRO 7 HD2 PRO 7 -9.950 -4.374 -2.258
75 HD3 PRO 7 HD3 PRO 7 -11.040 -3.501 -1.159
76 H ALA 8 H ALA 8 -9.490 -1.237 -5.042
77 HA ALA 8 HA ALA 8 -8.243 -3.285 -6.541
78 HB1 ALA 8 HB1 ALA 8 -10.283 -2.189 -7.287
79 HB2 ALA 8 HB2 ALA 8 -9.017 -2.043 -8.508
80 HB3 ALA 8 HB3 ALA 8 -9.412 -0.667 -7.477
81 H LYS 9 H LYS 9 -7.094 -0.258 -5.403
82 HA LYS 9 HA LYS 9 -4.586 -0.700 -6.840
83 HB2 LYS 9 HB2 LYS 9 -5.807 0.986 -8.147
84 HB3 LYS 9 HB3 LYS 9 -5.992 1.975 -6.705
85 HG2 LYS 9 HG2 LYS 9 -3.548 2.197 -6.566
86 HG3 LYS 9 HG3 LYS 9 -3.397 1.260 -8.052
87 HD2 LYS 9 HD2 LYS 9 -4.676 2.959 -9.255
88 HD3 LYS 9 HD3 LYS 9 -4.839 3.894 -7.767
89 HE2 LYS 9 HE2 LYS 9 -3.061 4.832 -9.088
90 HE3 LYS 9 HE3 LYS 9 -2.374 4.068 -7.655
91 HZ1 LYS 9 HZ1 LYS 9 -1.901 2.095 -9.082
92 HZ2 LYS 9 HZ2 LYS 9 -1.039 3.486 -9.513
93 HZ3 LYS 9 HZ3 LYS 9 -2.383 3.008 -10.430
94 H LEU 10 H LEU 10 -6.323 0.844 -4.204
95 HA LEU 10 HA LEU 10 -3.850 1.722 -2.960
96 HB2 LEU 10 HB2 LEU 10 -6.737 2.072 -2.167
97 HB3 LEU 10 HB3 LEU 10 -5.394 2.647 -1.203
98 HG LEU 10 HG LEU 10 -4.717 4.048 -3.222
99 HD11 LEU 10 HD11 LEU 10 -7.506 3.326 -4.100
100 HD12 LEU 10 HD12 LEU 10 -6.006 2.903 -4.925
101 HD13 LEU 10 HD13 LEU 10 -6.500 4.591 -4.806
102 HD21 LEU 10 HD21 LEU 10 -5.763 4.978 -1.226
103 HD22 LEU 10 HD22 LEU 10 -7.358 4.619 -1.886
104 HD23 LEU 10 HD23 LEU 10 -6.321 5.803 -2.682
105 H ALA 11 H ALA 11 -4.521 -1.158 -3.209
106 HA ALA 11 HA ALA 11 -5.104 -2.140 -0.590
107 HB1 ALA 11 HB1 ALA 11 -4.414 -4.315 -1.465
108 HB2 ALA 11 HB2 ALA 11 -3.772 -3.537 -2.913
109 HB3 ALA 11 HB3 ALA 11 -5.505 -3.499 -2.587
110 H LEU 12 H LEU 12 -2.096 -2.128 -2.511
111 HA LEU 12 HA LEU 12 -0.610 -1.818 0.007
112 HB2 LEU 12 HB2 LEU 12 -0.437 -4.153 -0.739
113 HB3 LEU 12 HB3 LEU 12 0.165 -3.610 -2.294
114 HG LEU 12 HG LEU 12 2.160 -2.670 -1.185
115 HD11 LEU 12 HD11 LEU 12 2.623 -3.203 1.147
116 HD12 LEU 12 HD12 LEU 12 1.041 -3.965 1.299
117 HD13 LEU 12 HD13 LEU 12 1.158 -2.230 1.008
118 HD21 LEU 12 HD21 LEU 12 2.211 -4.931 -2.108
119 HD22 LEU 12 HD22 LEU 12 1.643 -5.575 -0.568
120 HD23 LEU 12 HD23 LEU 12 3.225 -4.803 -0.670
121 H LEU 13 H LEU 13 -0.388 0.370 -0.363
122 HA LEU 13 HA LEU 13 0.971 1.262 -2.783
123 HB2 LEU 13 HB2 LEU 13 0.024 2.830 -0.381
124 HB3 LEU 13 HB3 LEU 13 0.639 3.515 -1.872
125 HG LEU 13 HG LEU 13 -1.897 1.890 -1.633
126 HD11 LEU 13 HD11 LEU 13 -2.081 4.062 -0.540
127 HD12 LEU 13 HD12 LEU 13 -3.033 4.012 -2.024
128 HD13 LEU 13 HD13 LEU 13 -1.482 4.851 -1.997
129 HD21 LEU 13 HD21 LEU 13 -0.844 1.658 -3.816
130 HD22 LEU 13 HD22 LEU 13 -0.711 3.410 -3.952
131 HD23 LEU 13 HD23 LEU 13 -2.301 2.647 -3.930
132 H TRP 14 H TRP 14 1.765 0.102 0.236
133 HA TRP 14 HA TRP 14 4.059 1.819 0.687
134 HB2 TRP 14 HB2 TRP 14 3.049 -0.541 2.291
135 HB3 TRP 14 HB3 TRP 14 4.288 0.607 2.797
136 HD1 TRP 14 HD1 TRP 14 3.462 3.077 3.493
137 HE1 TRP 14 HE1 TRP 14 1.162 3.961 4.248
138 HE3 TRP 14 HE3 TRP 14 0.546 -0.835 1.952
139 HZ2 TRP 14 HZ2 TRP 14 -1.527 3.110 4.187
140 HZ3 TRP 14 HZ3 TRP 14 -1.882 -0.713 2.335
141 HH2 TRP 14 HH2 TRP 14 -2.895 1.217 3.430
142 H LYS 15 H LYS 15 4.196 0.307 -1.654
143 HA LYS 15 HA LYS 15 6.371 -1.576 -1.023
144 HB2 LYS 15 HB2 LYS 15 4.542 -2.617 -2.257
145 HB3 LYS 15 HB3 LYS 15 4.622 -1.365 -3.487
146 HG2 LYS 15 HG2 LYS 15 5.650 -3.374 -4.306
147 HG3 LYS 15 HG3 LYS 15 6.884 -2.135 -4.085
148 HD2 LYS 15 HD2 LYS 15 7.490 -3.152 -1.926
149 HD3 LYS 15 HD3 LYS 15 6.291 -4.416 -2.206
150 HE2 LYS 15 HE2 LYS 15 8.692 -3.836 -3.937
151 HE3 LYS 15 HE3 LYS 15 8.541 -5.170 -2.794
152 HZ1 LYS 15 HZ1 LYS 15 6.803 -4.758 -5.173
153 HZ2 LYS 15 HZ2 LYS 15 6.743 -6.073 -4.101
154 HZ3 LYS 15 HZ3 LYS 15 8.101 -5.846 -5.091
155 H ALA 16 H ALA 16 5.414 1.254 -2.810
156 HA ALA 16 HA ALA 16 7.621 1.461 -4.534
157 HB1 ALA 16 HB1 ALA 16 5.838 3.640 -3.466
158 HB2 ALA 16 HB2 ALA 16 5.538 2.663 -4.902
159 HB3 ALA 16 HB3 ALA 16 6.910 3.771 -4.860
160 H LEU 17 H LEU 17 7.023 2.871 -1.332
161 HA LEU 17 HA LEU 17 9.616 4.166 -1.317
162 HB2 LEU 17 HB2 LEU 17 8.967 5.227 0.658
163 HB3 LEU 17 HB3 LEU 17 7.478 5.099 -0.256
164 HG LEU 17 HG LEU 17 8.265 3.230 1.988
165 HD11 LEU 17 HD11 LEU 17 6.342 5.545 1.987
166 HD12 LEU 17 HD12 LEU 17 7.895 5.481 2.823
167 HD13 LEU 17 HD13 LEU 17 6.586 4.402 3.308
168 HD21 LEU 17 HD21 LEU 17 6.737 2.215 0.374
169 HD22 LEU 17 HD22 LEU 17 5.644 3.590 0.541
170 HD23 LEU 17 HD23 LEU 17 5.932 2.521 1.913
171 H ALA 18 H ALA 18 8.575 1.073 -0.702
172 HA ALA 18 HA ALA 18 10.080 0.617 1.718
173 HB1 ALA 18 HB1 ALA 18 9.281 -1.669 1.567
174 HB2 ALA 18 HB2 ALA 18 8.662 -1.363 -0.055
175 HB3 ALA 18 HB3 ALA 18 7.951 -0.535 1.330
176 H LEU 19 H LEU 19 10.513 0.182 -1.704
177 HA LEU 19 HA LEU 19 12.421 -1.838 -1.734
178 HB2 LEU 19 HB2 LEU 19 11.279 -0.987 -3.737
179 HB3 LEU 19 HB3 LEU 19 12.190 0.507 -3.619
180 HG LEU 19 HG LEU 19 14.281 -0.749 -4.002
181 HD11 LEU 19 HD11 LEU 19 13.581 -2.899 -3.079
182 HD12 LEU 19 HD12 LEU 19 14.181 -3.076 -4.727
183 HD13 LEU 19 HD13 LEU 19 12.446 -3.108 -4.413
184 HD21 LEU 19 HD21 LEU 19 13.898 -1.230 -6.359
185 HD22 LEU 19 HD22 LEU 19 13.088 0.261 -5.877
186 HD23 LEU 19 HD23 LEU 19 12.155 -1.221 -6.085
187 H LYS 20 H LYS 20 13.133 1.660 -2.080
188 HA LYS 20 HA LYS 20 15.890 1.097 -1.346
189 HB2 LYS 20 HB2 LYS 20 15.110 2.697 -3.231
190 HB3 LYS 20 HB3 LYS 20 14.795 3.836 -1.927
191 HG2 LYS 20 HG2 LYS 20 17.130 3.681 -1.225
192 HG3 LYS 20 HG3 LYS 20 17.446 2.538 -2.528
193 HD2 LYS 20 HD2 LYS 20 16.730 4.304 -4.144
194 HD3 LYS 20 HD3 LYS 20 16.640 5.430 -2.788
195 HE2 LYS 20 HE2 LYS 20 18.763 5.693 -3.897
196 HE3 LYS 20 HE3 LYS 20 19.022 4.980 -2.306
197 HZ1 LYS 20 HZ1 LYS 20 20.365 3.838 -3.902
198 HZ2 LYS 20 HZ2 LYS 20 19.033 3.558 -4.913
199 HZ3 LYS 20 HZ3 LYS 20 19.130 2.784 -3.413
200 H LEU 21 H LEU 21 13.748 0.810 0.591
201 HA LEU 21 HA LEU 21 14.739 2.711 2.607
202 HB2 LEU 21 HB2 LEU 21 12.293 2.727 2.308
203 HB3 LEU 21 HB3 LEU 21 12.239 1.008 2.646
204 HG LEU 21 HG LEU 21 13.003 1.420 4.937
205 HD11 LEU 21 HD11 LEU 21 14.338 3.424 4.518
206 HD12 LEU 21 HD12 LEU 21 13.158 3.694 5.801
207 HD13 LEU 21 HD13 LEU 21 12.868 4.338 4.184
208 HD21 LEU 21 HD21 LEU 21 10.609 1.381 4.468
209 HD22 LEU 21 HD22 LEU 21 10.639 3.113 4.136
210 HD23 LEU 21 HD23 LEU 21 10.983 2.522 5.761
211 H LYS 22 H LYS 22 13.776 -0.672 2.121
212 HA LYS 22 HA LYS 22 15.422 -1.561 4.331
213 HB2 LYS 22 HB2 LYS 22 14.700 -3.823 3.656
214 HB3 LYS 22 HB3 LYS 22 13.335 -2.736 3.873
215 HG2 LYS 22 HG2 LYS 22 13.266 -2.416 1.414
216 HG3 LYS 22 HG3 LYS 22 14.542 -3.625 1.261
217 HD2 LYS 22 HD2 LYS 22 12.339 -4.607 0.872
218 HD3 LYS 22 HD3 LYS 22 13.098 -5.291 2.311
219 HE2 LYS 22 HE2 LYS 22 11.762 -3.849 3.734
220 HE3 LYS 22 HE3 LYS 22 11.044 -3.083 2.317
221 HZ1 LYS 22 HZ1 LYS 22 10.802 -5.988 2.848
222 HZ2 LYS 22 HZ2 LYS 22 9.894 -5.042 1.770
223 HZ3 LYS 22 HZ3 LYS 22 9.689 -4.856 3.442
224 H LYS 23 H LYS 23 15.576 -1.367 0.846
225 HA LYS 23 HA LYS 23 18.237 -2.598 0.882
226 HB2 LYS 23 HB2 LYS 23 16.544 -3.586 -0.651
227 HB3 LYS 23 HB3 LYS 23 16.412 -2.034 -1.463
228 HG2 LYS 23 HG2 LYS 23 18.772 -2.184 -2.114
229 HG3 LYS 23 HG3 LYS 23 18.870 -3.769 -1.340
230 HD2 LYS 23 HD2 LYS 23 17.183 -4.635 -2.860
231 HD3 LYS 23 HD3 LYS 23 17.006 -3.042 -3.596
232 HE2 LYS 23 HE2 LYS 23 19.334 -3.125 -4.339
233 HE3 LYS 23 HE3 LYS 23 19.513 -4.719 -3.608
234 HZ1 LYS 23 HZ1 LYS 23 17.829 -5.564 -5.119
235 HZ2 LYS 23 HZ2 LYS 23 19.113 -4.868 -5.979
236 HZ3 LYS 23 HZ3 LYS 23 17.651 -4.027 -5.818
237 H ALA 24 H ALA 24 18.796 -0.479 1.929
238 HA ALA 24 HA ALA 24 19.813 1.321 -0.119
239 HB1 ALA 24 HB1 ALA 24 17.694 2.341 0.548
240 HB2 ALA 24 HB2 ALA 24 19.063 3.314 1.081
241 HB3 ALA 24 HB3 ALA 24 18.202 2.302 2.239
Start of MODEL 5
1 H1 LYS 1 H1 LYS 1 -4.201 13.285 13.016
2 H2 LYS 1 H2 LYS 1 -5.409 13.607 14.166
3 H3 LYS 1 H3 LYS 1 -3.774 13.606 14.625
4 HA LYS 1 HA LYS 1 -4.790 15.838 14.371
5 HB2 LYS 1 HB2 LYS 1 -2.422 15.060 12.654
6 HB3 LYS 1 HB3 LYS 1 -2.864 16.727 13.006
7 HG2 LYS 1 HG2 LYS 1 -2.591 16.278 15.403
8 HG3 LYS 1 HG3 LYS 1 -2.100 14.629 15.024
9 HD2 LYS 1 HD2 LYS 1 -0.676 17.096 14.038
10 HD3 LYS 1 HD3 LYS 1 -0.205 16.185 15.472
11 HE2 LYS 1 HE2 LYS 1 0.057 14.176 14.030
12 HE3 LYS 1 HE3 LYS 1 -0.263 15.196 12.629
13 HZ1 LYS 1 HZ1 LYS 1 1.992 15.506 14.537
14 HZ2 LYS 1 HZ2 LYS 1 1.671 16.540 13.232
15 HZ3 LYS 1 HZ3 LYS 1 2.100 14.922 12.945
16 H LYS 2 H LYS 2 -4.136 17.243 11.893
17 HA LYS 2 HA LYS 2 -6.649 16.978 10.655
18 HB2 LYS 2 HB2 LYS 2 -5.781 18.664 9.054
19 HB3 LYS 2 HB3 LYS 2 -5.638 19.137 10.735
20 HG2 LYS 2 HG2 LYS 2 -3.280 18.676 10.725
21 HG3 LYS 2 HG3 LYS 2 -3.383 18.010 9.093
22 HD2 LYS 2 HD2 LYS 2 -2.521 20.346 9.169
23 HD3 LYS 2 HD3 LYS 2 -3.974 20.152 8.185
24 HE2 LYS 2 HE2 LYS 2 -5.311 20.915 10.159
25 HE3 LYS 2 HE3 LYS 2 -3.793 21.271 10.981
26 HZ1 LYS 2 HZ1 LYS 2 -3.265 22.903 9.347
27 HZ2 LYS 2 HZ2 LYS 2 -4.843 23.212 9.876
28 HZ3 LYS 2 HZ3 LYS 2 -4.584 22.462 8.377
29 H LEU 3 H LEU 3 -6.408 17.204 8.093
30 HA LEU 3 HA LEU 3 -5.885 14.428 7.395
31 HB2 LEU 3 HB2 LEU 3 -7.386 16.577 5.905
32 HB3 LEU 3 HB3 LEU 3 -7.305 14.887 5.444
33 HG LEU 3 HG LEU 3 -8.539 15.924 7.996
34 HD11 LEU 3 HD11 LEU 3 -9.824 14.951 5.450
35 HD12 LEU 3 HD12 LEU 3 -9.840 16.602 6.071
36 HD13 LEU 3 HD13 LEU 3 -10.673 15.321 6.951
37 HD21 LEU 3 HD21 LEU 3 -9.429 13.641 8.189
38 HD22 LEU 3 HD22 LEU 3 -7.668 13.680 8.252
39 HD23 LEU 3 HD23 LEU 3 -8.484 13.166 6.776
40 H LYS 4 H LYS 4 -3.774 14.206 6.857
41 HA LYS 4 HA LYS 4 -3.018 15.256 4.272
42 HB2 LYS 4 HB2 LYS 4 -2.242 16.974 5.969
43 HB3 LYS 4 HB3 LYS 4 -1.169 15.742 6.618
44 HG2 LYS 4 HG2 LYS 4 -0.061 15.579 4.431
45 HG3 LYS 4 HG3 LYS 4 -1.111 16.856 3.821
46 HD2 LYS 4 HD2 LYS 4 -0.190 18.411 5.453
47 HD3 LYS 4 HD3 LYS 4 0.824 17.130 6.121
48 HE2 LYS 4 HE2 LYS 4 2.142 18.505 4.636
49 HE3 LYS 4 HE3 LYS 4 1.934 16.905 3.929
50 HZ1 LYS 4 HZ1 LYS 4 0.583 19.426 3.151
51 HZ2 LYS 4 HZ2 LYS 4 0.032 17.908 2.639
52 HZ3 LYS 4 HZ3 LYS 4 1.583 18.438 2.200
53 H LEU 5 H LEU 5 -3.598 12.680 5.683
54 HA LEU 5 HA LEU 5 -1.327 11.225 4.636
55 HB2 LEU 5 HB2 LEU 5 -0.635 11.699 6.944
56 HB3 LEU 5 HB3 LEU 5 -2.109 10.963 7.541
57 HG LEU 5 HG LEU 5 -1.382 8.792 6.617
58 HD11 LEU 5 HD11 LEU 5 0.004 9.605 4.788
59 HD12 LEU 5 HD12 LEU 5 0.927 8.536 5.846
60 HD13 LEU 5 HD13 LEU 5 1.151 10.282 5.944
61 HD21 LEU 5 HD21 LEU 5 0.611 10.133 8.435
62 HD22 LEU 5 HD22 LEU 5 0.415 8.393 8.233
63 HD23 LEU 5 HD23 LEU 5 -0.890 9.352 8.933
64 H ALA 6 H ALA 6 -2.352 9.907 3.310
65 HA ALA 6 HA ALA 6 -4.425 8.156 4.438
66 HB1 ALA 6 HB1 ALA 6 -5.476 9.812 2.939
67 HB2 ALA 6 HB2 ALA 6 -5.625 8.165 2.330
68 HB3 ALA 6 HB3 ALA 6 -4.433 9.259 1.628
69 HA PRO 7 HA PRO 7 -0.783 5.728 3.060
70 HB2 PRO 7 HB2 PRO 7 -1.415 3.551 4.618
71 HB3 PRO 7 HB3 PRO 7 -0.456 4.930 5.171
72 HG2 PRO 7 HG2 PRO 7 -3.362 4.350 5.580
73 HG3 PRO 7 HG3 PRO 7 -2.179 5.005 6.727
74 HD2 PRO 7 HD2 PRO 7 -3.961 6.578 5.480
75 HD3 PRO 7 HD3 PRO 7 -2.316 7.137 5.838
76 H ALA 8 H ALA 8 -4.152 4.702 3.247
77 HA ALA 8 HA ALA 8 -3.725 2.392 1.580
78 HB1 ALA 8 HB1 ALA 8 -5.388 2.364 3.368
79 HB2 ALA 8 HB2 ALA 8 -6.127 2.047 1.798
80 HB3 ALA 8 HB3 ALA 8 -6.296 3.634 2.549
81 H LYS 9 H LYS 9 -3.225 5.199 0.548
82 HA LYS 9 HA LYS 9 -4.395 4.699 -2.044
83 HB2 LYS 9 HB2 LYS 9 -6.106 6.107 -0.920
84 HB3 LYS 9 HB3 LYS 9 -4.889 7.354 -0.681
85 HG2 LYS 9 HG2 LYS 9 -4.642 7.601 -3.083
86 HG3 LYS 9 HG3 LYS 9 -5.820 6.316 -3.351
87 HD2 LYS 9 HD2 LYS 9 -7.527 7.669 -2.221
88 HD3 LYS 9 HD3 LYS 9 -6.341 8.955 -1.985
89 HE2 LYS 9 HE2 LYS 9 -6.094 9.175 -4.404
90 HE3 LYS 9 HE3 LYS 9 -7.263 7.878 -4.650
91 HZ1 LYS 9 HZ1 LYS 9 -7.833 10.463 -3.307
92 HZ2 LYS 9 HZ2 LYS 9 -8.956 9.231 -3.620
93 HZ3 LYS 9 HZ3 LYS 9 -8.250 10.085 -4.907
94 H LEU 10 H LEU 10 -2.480 6.924 -0.046
95 HA LEU 10 HA LEU 10 -0.983 7.992 -2.206
96 HB2 LEU 10 HB2 LEU 10 -0.330 7.836 0.739
97 HB3 LEU 10 HB3 LEU 10 0.572 8.779 -0.433
98 HG LEU 10 HG LEU 10 -2.330 9.214 0.293
99 HD11 LEU 10 HD11 LEU 10 -0.830 9.808 2.116
100 HD12 LEU 10 HD12 LEU 10 -1.531 11.249 1.382
101 HD13 LEU 10 HD13 LEU 10 0.134 10.796 1.018
102 HD21 LEU 10 HD21 LEU 10 -2.114 11.273 -1.014
103 HD22 LEU 10 HD22 LEU 10 -1.844 9.845 -2.013
104 HD23 LEU 10 HD23 LEU 10 -0.473 10.813 -1.470
105 H ALA 11 H ALA 11 -0.191 5.506 0.221
106 HA ALA 11 HA ALA 11 1.814 4.472 -1.665
107 HB1 ALA 11 HB1 ALA 11 2.966 5.686 0.108
108 HB2 ALA 11 HB2 ALA 11 3.294 3.955 0.210
109 HB3 ALA 11 HB3 ALA 11 2.149 4.705 1.323
110 H LEU 12 H LEU 12 0.087 3.070 -2.281
111 HA LEU 12 HA LEU 12 -1.703 1.705 -0.778
112 HB2 LEU 12 HB2 LEU 12 -0.330 0.692 -3.265
113 HB3 LEU 12 HB3 LEU 12 -1.837 0.072 -2.621
114 HG LEU 12 HG LEU 12 -1.445 2.912 -3.568
115 HD11 LEU 12 HD11 LEU 12 -1.216 1.344 -5.422
116 HD12 LEU 12 HD12 LEU 12 -2.728 2.244 -5.536
117 HD13 LEU 12 HD13 LEU 12 -2.736 0.574 -4.970
118 HD21 LEU 12 HD21 LEU 12 -3.940 1.359 -2.884
119 HD22 LEU 12 HD22 LEU 12 -3.874 3.018 -3.476
120 HD23 LEU 12 HD23 LEU 12 -3.209 2.622 -1.892
121 H LEU 13 H LEU 13 1.403 0.303 -1.828
122 HA LEU 13 HA LEU 13 1.290 -1.452 0.534
123 HB2 LEU 13 HB2 LEU 13 2.249 -2.169 -2.244
124 HB3 LEU 13 HB3 LEU 13 2.475 -3.177 -0.828
125 HG LEU 13 HG LEU 13 -0.194 -2.404 -2.018
126 HD11 LEU 13 HD11 LEU 13 1.036 -3.943 -3.438
127 HD12 LEU 13 HD12 LEU 13 -0.326 -4.757 -2.669
128 HD13 LEU 13 HD13 LEU 13 1.311 -5.015 -2.064
129 HD21 LEU 13 HD21 LEU 13 -1.121 -4.024 -0.444
130 HD22 LEU 13 HD22 LEU 13 -0.306 -2.709 0.402
131 HD23 LEU 13 HD23 LEU 13 0.480 -4.282 0.248
132 H TRP 14 H TRP 14 2.561 1.169 -0.250
133 HA TRP 14 HA TRP 14 4.528 2.305 -0.080
134 HB2 TRP 14 HB2 TRP 14 5.204 0.032 1.801
135 HB3 TRP 14 HB3 TRP 14 6.022 1.588 1.739
136 HD1 TRP 14 HD1 TRP 14 4.587 3.745 2.622
137 HE1 TRP 14 HE1 TRP 14 2.666 3.881 4.341
138 HE3 TRP 14 HE3 TRP 14 3.245 -1.190 2.731
139 HZ2 TRP 14 HZ2 TRP 14 0.836 2.118 5.576
140 HZ3 TRP 14 HZ3 TRP 14 1.404 -1.881 4.206
141 HH2 TRP 14 HH2 TRP 14 0.225 -0.259 5.599
142 H LYS 15 H LYS 15 4.413 0.469 -2.290
143 HA LYS 15 HA LYS 15 6.705 -1.188 -2.392
144 HB2 LYS 15 HB2 LYS 15 4.875 -0.106 -4.518
145 HB3 LYS 15 HB3 LYS 15 6.245 -1.136 -4.910
146 HG2 LYS 15 HG2 LYS 15 3.988 -1.880 -3.061
147 HG3 LYS 15 HG3 LYS 15 4.138 -2.381 -4.749
148 HD2 LYS 15 HD2 LYS 15 6.281 -3.477 -4.193
149 HD3 LYS 15 HD3 LYS 15 6.045 -3.038 -2.499
150 HE2 LYS 15 HE2 LYS 15 4.032 -4.377 -2.400
151 HE3 LYS 15 HE3 LYS 15 4.157 -4.737 -4.121
152 HZ1 LYS 15 HZ1 LYS 15 4.993 -6.587 -2.916
153 HZ2 LYS 15 HZ2 LYS 15 6.012 -5.611 -1.976
154 HZ3 LYS 15 HZ3 LYS 15 6.317 -5.813 -3.635
155 H ALA 16 H ALA 16 6.228 2.177 -3.167
156 HA ALA 16 HA ALA 16 8.867 2.335 -4.397
157 HB1 ALA 16 HB1 ALA 16 6.802 4.497 -3.992
158 HB2 ALA 16 HB2 ALA 16 7.024 3.550 -5.463
159 HB3 ALA 16 HB3 ALA 16 8.293 4.648 -4.922
160 H LEU 17 H LEU 17 7.674 2.345 -1.347
161 HA LEU 17 HA LEU 17 9.630 4.323 -0.378
162 HB2 LEU 17 HB2 LEU 17 7.060 3.351 0.879
163 HB3 LEU 17 HB3 LEU 17 8.247 4.312 1.735
164 HG LEU 17 HG LEU 17 6.557 5.810 1.075
165 HD11 LEU 17 HD11 LEU 17 7.671 7.317 -0.491
166 HD12 LEU 17 HD12 LEU 17 8.805 6.033 -0.911
167 HD13 LEU 17 HD13 LEU 17 8.778 6.685 0.728
168 HD21 LEU 17 HD21 LEU 17 5.430 4.407 -0.561
169 HD22 LEU 17 HD22 LEU 17 6.742 4.673 -1.710
170 HD23 LEU 17 HD23 LEU 17 5.722 6.022 -1.209
171 H ALA 18 H ALA 18 8.059 1.281 0.606
172 HA ALA 18 HA ALA 18 10.144 0.782 2.545
173 HB1 ALA 18 HB1 ALA 18 8.805 -1.170 3.158
174 HB2 ALA 18 HB2 ALA 18 7.745 -0.874 1.779
175 HB3 ALA 18 HB3 ALA 18 7.826 0.296 3.096
176 H LEU 19 H LEU 19 10.369 0.550 -0.583
177 HA LEU 19 HA LEU 19 11.778 -2.032 -0.513
178 HB2 LEU 19 HB2 LEU 19 10.034 -1.789 -2.258
179 HB3 LEU 19 HB3 LEU 19 10.907 -0.415 -2.912
180 HG LEU 19 HG LEU 19 12.816 -1.881 -3.437
181 HD11 LEU 19 HD11 LEU 19 11.015 -4.102 -2.479
182 HD12 LEU 19 HD12 LEU 19 12.489 -3.550 -1.686
183 HD13 LEU 19 HD13 LEU 19 12.574 -4.304 -3.278
184 HD21 LEU 19 HD21 LEU 19 10.180 -2.841 -4.537
185 HD22 LEU 19 HD22 LEU 19 11.763 -3.095 -5.271
186 HD23 LEU 19 HD23 LEU 19 11.113 -1.463 -5.121
187 H LYS 20 H LYS 20 12.054 1.222 -1.935
188 HA LYS 20 HA LYS 20 14.851 1.026 -2.363
189 HB2 LYS 20 HB2 LYS 20 13.101 3.489 -2.200
190 HB3 LYS 20 HB3 LYS 20 14.733 3.433 -2.850
191 HG2 LYS 20 HG2 LYS 20 13.982 1.924 -4.616
192 HG3 LYS 20 HG3 LYS 20 12.342 1.982 -3.966
193 HD2 LYS 20 HD2 LYS 20 12.541 3.498 -5.843
194 HD3 LYS 20 HD3 LYS 20 12.300 4.414 -4.355
195 HE2 LYS 20 HE2 LYS 20 13.997 5.474 -5.714
196 HE3 LYS 20 HE3 LYS 20 14.729 4.828 -4.247
197 HZ1 LYS 20 HZ1 LYS 20 16.103 4.334 -6.150
198 HZ2 LYS 20 HZ2 LYS 20 14.810 3.587 -6.950
199 HZ3 LYS 20 HZ3 LYS 20 15.456 2.887 -5.546
200 H LEU 21 H LEU 21 12.871 2.179 0.292
201 HA LEU 21 HA LEU 21 15.222 3.205 1.687
202 HB2 LEU 21 HB2 LEU 21 12.346 3.199 2.595
203 HB3 LEU 21 HB3 LEU 21 13.669 4.094 3.313
204 HG LEU 21 HG LEU 21 12.510 4.581 0.567
205 HD11 LEU 21 HD11 LEU 21 11.681 6.664 1.531
206 HD12 LEU 21 HD12 LEU 21 12.312 6.191 3.108
207 HD13 LEU 21 HD13 LEU 21 11.010 5.263 2.365
208 HD21 LEU 21 HD21 LEU 21 14.891 5.090 0.641
209 HD22 LEU 21 HD22 LEU 21 14.648 6.068 2.088
210 HD23 LEU 21 HD23 LEU 21 13.939 6.572 0.555
211 H LYS 22 H LYS 22 14.470 0.281 1.162
212 HA LYS 22 HA LYS 22 14.965 -0.602 3.925
213 HB2 LYS 22 HB2 LYS 22 12.624 -1.118 3.308
214 HB3 LYS 22 HB3 LYS 22 13.204 -2.042 1.928
215 HG2 LYS 22 HG2 LYS 22 14.409 -3.534 3.523
216 HG3 LYS 22 HG3 LYS 22 13.630 -2.667 4.846
217 HD2 LYS 22 HD2 LYS 22 12.187 -4.134 2.638
218 HD3 LYS 22 HD3 LYS 22 12.465 -4.763 4.262
219 HE2 LYS 22 HE2 LYS 22 11.140 -2.964 5.212
220 HE3 LYS 22 HE3 LYS 22 10.918 -2.254 3.613
221 HZ1 LYS 22 HZ1 LYS 22 9.893 -4.886 4.535
222 HZ2 LYS 22 HZ2 LYS 22 9.769 -4.311 2.945
223 HZ3 LYS 22 HZ3 LYS 22 8.970 -3.501 4.204
224 H LYS 23 H LYS 23 15.394 -1.067 0.504
225 HA LYS 23 HA LYS 23 17.106 -1.885 -0.714
226 HB2 LYS 23 HB2 LYS 23 18.432 -2.444 1.945
227 HB3 LYS 23 HB3 LYS 23 19.200 -2.663 0.378
228 HG2 LYS 23 HG2 LYS 23 18.946 -0.273 -0.079
229 HG3 LYS 23 HG3 LYS 23 18.180 -0.057 1.495
230 HD2 LYS 23 HD2 LYS 23 20.234 -0.832 2.596
231 HD3 LYS 23 HD3 LYS 23 20.995 -1.038 1.019
232 HE2 LYS 23 HE2 LYS 23 19.968 1.566 2.137
233 HE3 LYS 23 HE3 LYS 23 21.658 1.064 2.110
234 HZ1 LYS 23 HZ1 LYS 23 21.540 0.994 -0.315
235 HZ2 LYS 23 HZ2 LYS 23 21.184 2.538 0.283
236 HZ3 LYS 23 HZ3 LYS 23 19.931 1.535 -0.264
237 H ALA 24 H ALA 24 16.703 -3.988 2.127
238 HA ALA 24 HA ALA 24 16.114 -6.153 2.367
239 HB1 ALA 24 HB1 ALA 24 14.134 -5.499 1.085
240 HB2 ALA 24 HB2 ALA 24 14.607 -7.165 0.752
241 HB3 ALA 24 HB3 ALA 24 14.973 -5.894 -0.415
Start of MODEL 6
1 H1 LYS 1 H1 LYS 1 -20.628 9.213 8.664
2 H2 LYS 1 H2 LYS 1 -19.141 8.455 8.976
3 H3 LYS 1 H3 LYS 1 -19.280 9.555 7.690
4 HA LYS 1 HA LYS 1 -19.743 11.339 9.258
5 HB2 LYS 1 HB2 LYS 1 -19.142 9.168 11.283
6 HB3 LYS 1 HB3 LYS 1 -19.232 10.881 11.666
7 HG2 LYS 1 HG2 LYS 1 -21.503 9.265 10.527
8 HG3 LYS 1 HG3 LYS 1 -21.279 9.620 12.240
9 HD2 LYS 1 HD2 LYS 1 -21.404 11.816 10.200
10 HD3 LYS 1 HD3 LYS 1 -22.874 11.106 10.862
11 HE2 LYS 1 HE2 LYS 1 -22.360 13.061 12.133
12 HE3 LYS 1 HE3 LYS 1 -22.045 11.657 13.143
13 HZ1 LYS 1 HZ1 LYS 1 -19.711 11.905 12.807
14 HZ2 LYS 1 HZ2 LYS 1 -20.327 13.415 13.274
15 HZ3 LYS 1 HZ3 LYS 1 -19.938 13.126 11.649
16 H LYS 2 H LYS 2 -17.985 11.734 7.774
17 HA LYS 2 HA LYS 2 -15.838 12.175 7.186
18 HB2 LYS 2 HB2 LYS 2 -15.429 12.166 10.184
19 HB3 LYS 2 HB3 LYS 2 -14.285 12.805 9.011
20 HG2 LYS 2 HG2 LYS 2 -15.911 14.473 8.306
21 HG3 LYS 2 HG3 LYS 2 -17.086 13.822 9.449
22 HD2 LYS 2 HD2 LYS 2 -15.604 14.388 11.302
23 HD3 LYS 2 HD3 LYS 2 -14.417 15.024 10.161
24 HE2 LYS 2 HE2 LYS 2 -17.213 16.075 10.584
25 HE3 LYS 2 HE3 LYS 2 -15.726 16.833 11.148
26 HZ1 LYS 2 HZ1 LYS 2 -16.580 16.450 8.326
27 HZ2 LYS 2 HZ2 LYS 2 -15.037 16.993 8.780
28 HZ3 LYS 2 HZ3 LYS 2 -16.405 17.922 9.155
29 H LEU 3 H LEU 3 -16.537 9.563 6.993
30 HA LEU 3 HA LEU 3 -14.477 7.915 8.198
31 HB2 LEU 3 HB2 LEU 3 -16.828 7.141 8.043
32 HB3 LEU 3 HB3 LEU 3 -16.706 7.188 6.295
33 HG LEU 3 HG LEU 3 -14.923 5.457 6.411
34 HD11 LEU 3 HD11 LEU 3 -14.643 4.202 8.502
35 HD12 LEU 3 HD12 LEU 3 -15.663 5.379 9.333
36 HD13 LEU 3 HD13 LEU 3 -14.110 5.877 8.655
37 HD21 LEU 3 HD21 LEU 3 -17.537 4.700 7.708
38 HD22 LEU 3 HD22 LEU 3 -16.418 3.598 6.903
39 HD23 LEU 3 HD23 LEU 3 -17.246 4.848 5.976
40 H LYS 4 H LYS 4 -12.562 7.873 7.273
41 HA LYS 4 HA LYS 4 -12.352 8.183 4.355
42 HB2 LYS 4 HB2 LYS 4 -10.165 8.356 6.440
43 HB3 LYS 4 HB3 LYS 4 -10.036 8.798 4.742
44 HG2 LYS 4 HG2 LYS 4 -11.575 10.627 5.053
45 HG3 LYS 4 HG3 LYS 4 -11.850 10.148 6.730
46 HD2 LYS 4 HD2 LYS 4 -9.413 10.523 7.144
47 HD3 LYS 4 HD3 LYS 4 -9.294 11.188 5.513
48 HE2 LYS 4 HE2 LYS 4 -11.054 12.234 7.730
49 HE3 LYS 4 HE3 LYS 4 -9.534 12.949 7.202
50 HZ1 LYS 4 HZ1 LYS 4 -11.994 12.671 5.555
51 HZ2 LYS 4 HZ2 LYS 4 -10.522 13.315 5.017
52 HZ3 LYS 4 HZ3 LYS 4 -11.401 14.109 6.235
53 H LEU 5 H LEU 5 -13.289 5.760 5.311
54 HA LEU 5 HA LEU 5 -11.043 3.927 5.488
55 HB2 LEU 5 HB2 LEU 5 -13.318 3.901 6.828
56 HB3 LEU 5 HB3 LEU 5 -13.893 3.033 5.421
57 HG LEU 5 HG LEU 5 -11.531 2.144 7.084
58 HD11 LEU 5 HD11 LEU 5 -13.560 2.143 8.435
59 HD12 LEU 5 HD12 LEU 5 -13.048 0.499 8.058
60 HD13 LEU 5 HD13 LEU 5 -14.399 1.223 7.185
61 HD21 LEU 5 HD21 LEU 5 -13.192 0.695 5.023
62 HD22 LEU 5 HD22 LEU 5 -11.870 0.000 5.964
63 HD23 LEU 5 HD23 LEU 5 -11.543 1.281 4.794
64 H ALA 6 H ALA 6 -10.371 4.461 3.299
65 HA ALA 6 HA ALA 6 -11.391 2.419 1.503
66 HB1 ALA 6 HB1 ALA 6 -11.572 3.937 -0.409
67 HB2 ALA 6 HB2 ALA 6 -11.206 5.309 0.640
68 HB3 ALA 6 HB3 ALA 6 -12.696 4.394 0.872
69 HA PRO 7 HA PRO 7 -6.771 3.254 1.962
70 HB2 PRO 7 HB2 PRO 7 -6.058 0.664 2.451
71 HB3 PRO 7 HB3 PRO 7 -6.515 1.810 3.715
72 HG2 PRO 7 HG2 PRO 7 -8.164 -0.310 2.396
73 HG3 PRO 7 HG3 PRO 7 -8.077 0.130 4.113
74 HD2 PRO 7 HD2 PRO 7 -10.101 0.943 2.541
75 HD3 PRO 7 HD3 PRO 7 -9.456 1.964 3.842
76 H ALA 8 H ALA 8 -8.594 0.886 0.171
77 HA ALA 8 HA ALA 8 -6.581 -0.169 -1.462
78 HB1 ALA 8 HB1 ALA 8 -9.501 0.167 -2.128
79 HB2 ALA 8 HB2 ALA 8 -8.805 -1.166 -1.207
80 HB3 ALA 8 HB3 ALA 8 -8.369 -0.944 -2.900
81 H LYS 9 H LYS 9 -8.190 2.885 -1.582
82 HA LYS 9 HA LYS 9 -6.653 3.505 -4.004
83 HB2 LYS 9 HB2 LYS 9 -8.477 4.892 -4.850
84 HB3 LYS 9 HB3 LYS 9 -8.992 3.221 -4.670
85 HG2 LYS 9 HG2 LYS 9 -10.209 3.754 -2.667
86 HG3 LYS 9 HG3 LYS 9 -9.575 5.400 -2.676
87 HD2 LYS 9 HD2 LYS 9 -11.420 4.165 -4.720
88 HD3 LYS 9 HD3 LYS 9 -11.832 5.408 -3.537
89 HE2 LYS 9 HE2 LYS 9 -9.883 5.681 -5.826
90 HE3 LYS 9 HE3 LYS 9 -11.487 6.407 -5.726
91 HZ1 LYS 9 HZ1 LYS 9 -9.249 6.993 -3.862
92 HZ2 LYS 9 HZ2 LYS 9 -10.764 7.752 -3.888
93 HZ3 LYS 9 HZ3 LYS 9 -9.682 7.965 -5.179
94 H LEU 10 H LEU 10 -6.043 3.914 -1.233
95 HA LEU 10 HA LEU 10 -5.837 6.843 -1.225
96 HB2 LEU 10 HB2 LEU 10 -7.637 6.169 0.326
97 HB3 LEU 10 HB3 LEU 10 -6.504 5.141 1.181
98 HG LEU 10 HG LEU 10 -5.187 7.159 1.787
99 HD11 LEU 10 HD11 LEU 10 -7.512 8.611 0.532
100 HD12 LEU 10 HD12 LEU 10 -5.841 8.621 -0.033
101 HD13 LEU 10 HD13 LEU 10 -6.255 9.358 1.515
102 HD21 LEU 10 HD21 LEU 10 -8.092 7.178 2.590
103 HD22 LEU 10 HD22 LEU 10 -6.781 7.981 3.455
104 HD23 LEU 10 HD23 LEU 10 -6.810 6.222 3.334
105 H ALA 11 H ALA 11 -4.708 3.810 0.230
106 HA ALA 11 HA ALA 11 -1.962 4.728 -0.032
107 HB1 ALA 11 HB1 ALA 11 -1.404 4.143 2.276
108 HB2 ALA 11 HB2 ALA 11 -3.103 3.792 2.599
109 HB3 ALA 11 HB3 ALA 11 -2.599 5.439 2.215
110 H LEU 12 H LEU 12 -2.429 3.045 -1.741
111 HA LEU 12 HA LEU 12 -2.185 0.319 -0.650
112 HB2 LEU 12 HB2 LEU 12 -4.149 0.802 -2.123
113 HB3 LEU 12 HB3 LEU 12 -3.036 1.166 -3.426
114 HG LEU 12 HG LEU 12 -2.177 -1.184 -3.258
115 HD11 LEU 12 HD11 LEU 12 -4.561 -1.532 -1.449
116 HD12 LEU 12 HD12 LEU 12 -2.867 -1.639 -0.968
117 HD13 LEU 12 HD13 LEU 12 -3.544 -2.825 -2.085
118 HD21 LEU 12 HD21 LEU 12 -5.111 -0.830 -3.862
119 HD22 LEU 12 HD22 LEU 12 -4.111 -2.184 -4.390
120 HD23 LEU 12 HD23 LEU 12 -3.772 -0.556 -4.977
121 H LEU 13 H LEU 13 -0.242 2.681 -1.590
122 HA LEU 13 HA LEU 13 1.509 0.929 -3.172
123 HB2 LEU 13 HB2 LEU 13 0.675 2.901 -4.410
124 HB3 LEU 13 HB3 LEU 13 1.408 3.947 -3.208
125 HG LEU 13 HG LEU 13 3.636 3.153 -3.843
126 HD11 LEU 13 HD11 LEU 13 3.924 1.730 -5.813
127 HD12 LEU 13 HD12 LEU 13 2.177 1.506 -5.900
128 HD13 LEU 13 HD13 LEU 13 3.076 0.890 -4.513
129 HD21 LEU 13 HD21 LEU 13 2.752 5.096 -4.987
130 HD22 LEU 13 HD22 LEU 13 1.958 4.064 -6.176
131 HD23 LEU 13 HD23 LEU 13 3.718 4.127 -6.099
132 H TRP 14 H TRP 14 2.063 0.199 -0.906
133 HA TRP 14 HA TRP 14 4.128 1.938 0.253
134 HB2 TRP 14 HB2 TRP 14 2.822 -0.580 1.300
135 HB3 TRP 14 HB3 TRP 14 4.154 0.244 2.104
136 HD1 TRP 14 HD1 TRP 14 0.445 0.235 1.896
137 HE1 TRP 14 HE1 TRP 14 -0.532 2.223 3.214
138 HE3 TRP 14 HE3 TRP 14 4.742 2.897 2.631
139 HZ2 TRP 14 HZ2 TRP 14 0.403 4.617 4.391
140 HZ3 TRP 14 HZ3 TRP 14 4.615 5.027 3.860
141 HH2 TRP 14 HH2 TRP 14 2.492 5.865 4.719
142 H LYS 15 H LYS 15 3.632 -0.687 -1.788
143 HA LYS 15 HA LYS 15 6.136 -2.017 -1.429
144 HB2 LYS 15 HB2 LYS 15 5.507 -3.122 -3.616
145 HB3 LYS 15 HB3 LYS 15 4.365 -3.322 -2.297
146 HG2 LYS 15 HG2 LYS 15 3.200 -1.245 -3.371
147 HG3 LYS 15 HG3 LYS 15 4.102 -1.737 -4.807
148 HD2 LYS 15 HD2 LYS 15 3.119 -3.966 -4.675
149 HD3 LYS 15 HD3 LYS 15 2.246 -3.502 -3.213
150 HE2 LYS 15 HE2 LYS 15 0.670 -3.323 -4.943
151 HE3 LYS 15 HE3 LYS 15 1.183 -1.668 -4.623
152 HZ1 LYS 15 HZ1 LYS 15 2.169 -3.399 -6.826
153 HZ2 LYS 15 HZ2 LYS 15 2.688 -1.811 -6.523
154 HZ3 LYS 15 HZ3 LYS 15 1.083 -2.107 -6.986
155 H ALA 16 H ALA 16 6.729 0.564 -1.562
156 HA ALA 16 HA ALA 16 8.553 0.670 -3.799
157 HB1 ALA 16 HB1 ALA 16 6.579 1.738 -4.776
158 HB2 ALA 16 HB2 ALA 16 7.866 2.914 -4.531
159 HB3 ALA 16 HB3 ALA 16 6.500 2.860 -3.419
160 H LEU 17 H LEU 17 7.099 2.527 -1.144
161 HA LEU 17 HA LEU 17 9.416 3.975 -0.454
162 HB2 LEU 17 HB2 LEU 17 6.967 3.236 1.149
163 HB3 LEU 17 HB3 LEU 17 8.243 4.259 1.775
164 HG LEU 17 HG LEU 17 6.494 5.695 1.068
165 HD11 LEU 17 HD11 LEU 17 7.554 6.998 -0.737
166 HD12 LEU 17 HD12 LEU 17 8.675 5.663 -1.008
167 HD13 LEU 17 HD13 LEU 17 8.684 6.523 0.532
168 HD21 LEU 17 HD21 LEU 17 5.280 4.143 -0.362
169 HD22 LEU 17 HD22 LEU 17 6.538 4.278 -1.592
170 HD23 LEU 17 HD23 LEU 17 5.550 5.680 -1.181
171 H ALA 18 H ALA 18 8.095 0.891 0.643
172 HA ALA 18 HA ALA 18 10.004 0.505 2.718
173 HB1 ALA 18 HB1 ALA 18 7.819 -0.584 2.735
174 HB2 ALA 18 HB2 ALA 18 9.125 -1.764 2.845
175 HB3 ALA 18 HB3 ALA 18 8.273 -1.529 1.318
176 H LEU 19 H LEU 19 10.154 0.127 -0.671
177 HA LEU 19 HA LEU 19 12.193 -1.895 -0.715
178 HB2 LEU 19 HB2 LEU 19 10.698 -1.568 -2.620
179 HB3 LEU 19 HB3 LEU 19 11.293 0.068 -2.823
180 HG LEU 19 HG LEU 19 13.560 -0.883 -3.299
181 HD11 LEU 19 HD11 LEU 19 12.039 -3.485 -3.376
182 HD12 LEU 19 HD12 LEU 19 13.291 -3.041 -2.216
183 HD13 LEU 19 HD13 LEU 19 13.700 -3.244 -3.919
184 HD21 LEU 19 HD21 LEU 19 12.076 -0.156 -5.091
185 HD22 LEU 19 HD22 LEU 19 11.326 -1.752 -5.127
186 HD23 LEU 19 HD23 LEU 19 13.021 -1.563 -5.577
187 H LYS 20 H LYS 20 12.109 1.619 -1.178
188 HA LYS 20 HA LYS 20 14.901 1.927 -1.537
189 HB2 LYS 20 HB2 LYS 20 12.866 3.964 -0.606
190 HB3 LYS 20 HB3 LYS 20 14.477 4.324 -1.207
191 HG2 LYS 20 HG2 LYS 20 13.866 3.420 -3.395
192 HG3 LYS 20 HG3 LYS 20 12.249 3.061 -2.788
193 HD2 LYS 20 HD2 LYS 20 11.863 5.427 -2.362
194 HD3 LYS 20 HD3 LYS 20 13.495 5.803 -2.915
195 HE2 LYS 20 HE2 LYS 20 11.284 4.603 -4.579
196 HE3 LYS 20 HE3 LYS 20 11.843 6.273 -4.648
197 HZ1 LYS 20 HZ1 LYS 20 14.100 5.250 -5.197
198 HZ2 LYS 20 HZ2 LYS 20 12.915 5.230 -6.409
199 HZ3 LYS 20 HZ3 LYS 20 13.247 3.822 -5.523
200 H LEU 21 H LEU 21 12.951 1.468 1.228
201 HA LEU 21 HA LEU 21 14.778 2.701 3.086
202 HB2 LEU 21 HB2 LEU 21 12.319 2.636 3.442
203 HB3 LEU 21 HB3 LEU 21 12.416 0.894 3.607
204 HG LEU 21 HG LEU 21 13.872 1.204 5.601
205 HD11 LEU 21 HD11 LEU 21 13.169 4.113 5.239
206 HD12 LEU 21 HD12 LEU 21 14.772 3.400 5.066
207 HD13 LEU 21 HD13 LEU 21 13.979 3.415 6.642
208 HD21 LEU 21 HD21 LEU 21 11.183 2.567 5.719
209 HD22 LEU 21 HD22 LEU 21 12.078 1.928 7.097
210 HD23 LEU 21 HD23 LEU 21 11.477 0.833 5.852
211 H LYS 22 H LYS 22 14.773 -0.173 1.399
212 HA LYS 22 HA LYS 22 16.371 -1.492 3.488
213 HB2 LYS 22 HB2 LYS 22 14.222 -2.634 3.198
214 HB3 LYS 22 HB3 LYS 22 14.551 -2.834 1.481
215 HG2 LYS 22 HG2 LYS 22 16.318 -4.349 1.904
216 HG3 LYS 22 HG3 LYS 22 16.328 -3.964 3.625
217 HD2 LYS 22 HD2 LYS 22 14.037 -5.274 2.167
218 HD3 LYS 22 HD3 LYS 22 15.252 -6.138 3.111
219 HE2 LYS 22 HE2 LYS 22 14.589 -4.862 5.104
220 HE3 LYS 22 HE3 LYS 22 13.357 -4.034 4.156
221 HZ1 LYS 22 HZ1 LYS 22 12.302 -6.188 3.747
222 HZ2 LYS 22 HZ2 LYS 22 12.379 -5.827 5.398
223 HZ3 LYS 22 HZ3 LYS 22 13.462 -6.950 4.726
224 H LYS 23 H LYS 23 15.864 -1.237 -0.044
225 HA LYS 23 HA LYS 23 18.585 -2.276 -0.386
226 HB2 LYS 23 HB2 LYS 23 16.744 -3.409 -1.637
227 HB3 LYS 23 HB3 LYS 23 16.474 -1.908 -2.517
228 HG2 LYS 23 HG2 LYS 23 18.816 -2.019 -3.323
229 HG3 LYS 23 HG3 LYS 23 18.973 -3.587 -2.532
230 HD2 LYS 23 HD2 LYS 23 18.514 -3.965 -4.845
231 HD3 LYS 23 HD3 LYS 23 17.073 -4.400 -3.926
232 HE2 LYS 23 HE2 LYS 23 15.958 -2.404 -4.566
233 HE3 LYS 23 HE3 LYS 23 17.442 -1.705 -5.217
234 HZ1 LYS 23 HZ1 LYS 23 15.926 -2.556 -6.944
235 HZ2 LYS 23 HZ2 LYS 23 16.104 -4.121 -6.315
236 HZ3 LYS 23 HZ3 LYS 23 17.442 -3.313 -6.972
237 H ALA 24 H ALA 24 20.187 -1.027 -1.063
238 HA ALA 24 HA ALA 24 19.531 1.591 -2.234
239 HB1 ALA 24 HB1 ALA 24 21.517 2.513 -1.166
240 HB2 ALA 24 HB2 ALA 24 21.873 0.946 -0.440
241 HB3 ALA 24 HB3 ALA 24 20.425 1.831 0.040
Start of MODEL 7
1 H1 LYS 1 H1 LYS 1 -21.499 15.672 -4.452
2 H2 LYS 1 H2 LYS 1 -21.482 14.668 -3.091
3 H3 LYS 1 H3 LYS 1 -22.947 15.334 -3.633
4 HA LYS 1 HA LYS 1 -22.791 13.014 -4.251
5 HB2 LYS 1 HB2 LYS 1 -22.491 14.925 -6.581
6 HB3 LYS 1 HB3 LYS 1 -23.080 13.274 -6.710
7 HG2 LYS 1 HG2 LYS 1 -24.396 15.449 -5.102
8 HG3 LYS 1 HG3 LYS 1 -24.874 14.948 -6.725
9 HD2 LYS 1 HD2 LYS 1 -25.314 12.683 -5.873
10 HD3 LYS 1 HD3 LYS 1 -24.885 13.222 -4.247
11 HE2 LYS 1 HE2 LYS 1 -27.128 14.327 -5.935
12 HE3 LYS 1 HE3 LYS 1 -27.316 13.178 -4.613
13 HZ1 LYS 1 HZ1 LYS 1 -27.805 15.401 -3.873
14 HZ2 LYS 1 HZ2 LYS 1 -26.291 15.957 -4.389
15 HZ3 LYS 1 HZ3 LYS 1 -26.396 14.852 -3.101
16 H LYS 2 H LYS 2 -21.823 11.540 -5.947
17 HA LYS 2 HA LYS 2 -20.103 10.448 -6.931
18 HB2 LYS 2 HB2 LYS 2 -19.898 12.705 -8.088
19 HB3 LYS 2 HB3 LYS 2 -18.597 13.062 -6.964
20 HG2 LYS 2 HG2 LYS 2 -17.291 11.230 -7.820
21 HG3 LYS 2 HG3 LYS 2 -18.617 10.732 -8.871
22 HD2 LYS 2 HD2 LYS 2 -18.477 12.924 -10.018
23 HD3 LYS 2 HD3 LYS 2 -17.080 13.323 -9.020
24 HE2 LYS 2 HE2 LYS 2 -16.418 12.526 -11.241
25 HE3 LYS 2 HE3 LYS 2 -15.844 11.458 -9.962
26 HZ1 LYS 2 HZ1 LYS 2 -18.387 10.906 -11.361
27 HZ2 LYS 2 HZ2 LYS 2 -17.373 9.834 -10.518
28 HZ3 LYS 2 HZ3 LYS 2 -16.904 10.430 -12.036
29 H LEU 3 H LEU 3 -20.256 10.392 -4.134
30 HA LEU 3 HA LEU 3 -17.592 10.637 -3.058
31 HB2 LEU 3 HB2 LEU 3 -20.099 9.351 -1.976
32 HB3 LEU 3 HB3 LEU 3 -18.582 9.410 -1.096
33 HG LEU 3 HG LEU 3 -20.181 11.814 -1.985
34 HD11 LEU 3 HD11 LEU 3 -21.286 10.579 -0.202
35 HD12 LEU 3 HD12 LEU 3 -20.649 12.114 0.390
36 HD13 LEU 3 HD13 LEU 3 -19.803 10.609 0.749
37 HD21 LEU 3 HD21 LEU 3 -17.712 11.623 -0.264
38 HD22 LEU 3 HD22 LEU 3 -18.618 13.092 -0.625
39 HD23 LEU 3 HD23 LEU 3 -17.771 12.240 -1.917
40 H LYS 4 H LYS 4 -16.660 9.393 -4.828
41 HA LYS 4 HA LYS 4 -16.683 6.503 -4.262
42 HB2 LYS 4 HB2 LYS 4 -17.846 7.004 -6.374
43 HB3 LYS 4 HB3 LYS 4 -16.439 7.876 -6.948
44 HG2 LYS 4 HG2 LYS 4 -16.609 5.677 -7.967
45 HG3 LYS 4 HG3 LYS 4 -15.148 5.826 -6.989
46 HD2 LYS 4 HD2 LYS 4 -16.150 4.555 -5.208
47 HD3 LYS 4 HD3 LYS 4 -17.703 4.523 -6.048
48 HE2 LYS 4 HE2 LYS 4 -16.482 2.409 -6.286
49 HE3 LYS 4 HE3 LYS 4 -16.734 3.204 -7.840
50 HZ1 LYS 4 HZ1 LYS 4 -14.517 2.433 -7.805
51 HZ2 LYS 4 HZ2 LYS 4 -14.225 3.061 -6.258
52 HZ3 LYS 4 HZ3 LYS 4 -14.420 4.109 -7.575
53 H LEU 5 H LEU 5 -14.986 9.211 -3.925
54 HA LEU 5 HA LEU 5 -12.421 8.217 -4.929
55 HB2 LEU 5 HB2 LEU 5 -13.071 10.901 -3.722
56 HB3 LEU 5 HB3 LEU 5 -11.605 10.464 -4.574
57 HG LEU 5 HG LEU 5 -14.358 10.673 -5.798
58 HD11 LEU 5 HD11 LEU 5 -13.421 12.847 -5.254
59 HD12 LEU 5 HD12 LEU 5 -13.411 12.590 -6.998
60 HD13 LEU 5 HD13 LEU 5 -11.917 12.424 -6.075
61 HD21 LEU 5 HD21 LEU 5 -13.039 8.943 -6.876
62 HD22 LEU 5 HD22 LEU 5 -11.687 10.060 -7.058
63 HD23 LEU 5 HD23 LEU 5 -13.192 10.350 -7.932
64 H ALA 6 H ALA 6 -12.719 6.564 -3.116
65 HA ALA 6 HA ALA 6 -12.101 7.530 -0.453
66 HB1 ALA 6 HB1 ALA 6 -13.660 5.684 -0.691
67 HB2 ALA 6 HB2 ALA 6 -12.225 5.169 0.196
68 HB3 ALA 6 HB3 ALA 6 -12.423 4.721 -1.497
69 HA PRO 7 HA PRO 7 -7.750 7.367 -1.635
70 HB2 PRO 7 HB2 PRO 7 -7.361 8.454 1.075
71 HB3 PRO 7 HB3 PRO 7 -6.900 9.136 -0.486
72 HG2 PRO 7 HG2 PRO 7 -8.902 10.182 0.956
73 HG3 PRO 7 HG3 PRO 7 -8.959 10.131 -0.818
74 HD2 PRO 7 HD2 PRO 7 -10.292 8.327 1.176
75 HD3 PRO 7 HD3 PRO 7 -10.951 9.032 -0.319
76 H ALA 8 H ALA 8 -9.264 6.047 1.199
77 HA ALA 8 HA ALA 8 -7.031 4.806 2.373
78 HB1 ALA 8 HB1 ALA 8 -8.637 3.483 3.628
79 HB2 ALA 8 HB2 ALA 8 -9.922 3.959 2.518
80 HB3 ALA 8 HB3 ALA 8 -9.153 5.168 3.548
81 H LYS 9 H LYS 9 -9.096 3.834 -0.283
82 HA LYS 9 HA LYS 9 -8.063 1.126 -0.273
83 HB2 LYS 9 HB2 LYS 9 -10.019 2.597 -2.024
84 HB3 LYS 9 HB3 LYS 9 -9.434 0.991 -2.438
85 HG2 LYS 9 HG2 LYS 9 -10.802 1.678 0.153
86 HG3 LYS 9 HG3 LYS 9 -11.620 1.004 -1.261
87 HD2 LYS 9 HD2 LYS 9 -10.164 -0.967 -1.155
88 HD3 LYS 9 HD3 LYS 9 -9.348 -0.290 0.254
89 HE2 LYS 9 HE2 LYS 9 -12.300 -0.885 0.156
90 HE3 LYS 9 HE3 LYS 9 -11.093 -2.022 0.756
91 HZ1 LYS 9 HZ1 LYS 9 -12.176 -0.711 2.521
92 HZ2 LYS 9 HZ2 LYS 9 -11.512 0.706 1.862
93 HZ3 LYS 9 HZ3 LYS 9 -10.495 -0.502 2.480
94 H LEU 10 H LEU 10 -7.140 4.124 -1.557
95 HA LEU 10 HA LEU 10 -5.621 2.873 -3.728
96 HB2 LEU 10 HB2 LEU 10 -6.142 5.787 -3.128
97 HB3 LEU 10 HB3 LEU 10 -5.230 5.187 -4.501
98 HG LEU 10 HG LEU 10 -8.166 4.659 -3.991
99 HD11 LEU 10 HD11 LEU 10 -8.515 6.113 -5.937
100 HD12 LEU 10 HD12 LEU 10 -6.784 6.454 -5.983
101 HD13 LEU 10 HD13 LEU 10 -7.748 6.974 -4.602
102 HD21 LEU 10 HD21 LEU 10 -7.053 2.819 -5.167
103 HD22 LEU 10 HD22 LEU 10 -6.427 3.961 -6.358
104 HD23 LEU 10 HD23 LEU 10 -8.164 3.690 -6.224
105 H ALA 11 H ALA 11 -5.275 4.157 -0.590
106 HA ALA 11 HA ALA 11 -2.490 4.812 -0.773
107 HB1 ALA 11 HB1 ALA 11 -3.978 5.863 0.871
108 HB2 ALA 11 HB2 ALA 11 -2.592 5.080 1.628
109 HB3 ALA 11 HB3 ALA 11 -4.175 4.303 1.670
110 H LEU 12 H LEU 12 -2.207 2.601 -1.887
111 HA LEU 12 HA LEU 12 -1.287 0.694 0.160
112 HB2 LEU 12 HB2 LEU 12 -2.480 0.086 -2.547
113 HB3 LEU 12 HB3 LEU 12 -1.673 -1.103 -1.542
114 HG LEU 12 HG LEU 12 -4.190 0.393 -0.792
115 HD11 LEU 12 HD11 LEU 12 -3.789 -2.482 -1.616
116 HD12 LEU 12 HD12 LEU 12 -4.548 -1.225 -2.593
117 HD13 LEU 12 HD13 LEU 12 -5.306 -1.752 -1.090
118 HD21 LEU 12 HD21 LEU 12 -2.720 -1.843 0.610
119 HD22 LEU 12 HD22 LEU 12 -4.277 -1.172 1.095
120 HD23 LEU 12 HD23 LEU 12 -2.830 -0.168 1.153
121 H LEU 13 H LEU 13 0.133 2.884 -1.044
122 HA LEU 13 HA LEU 13 1.884 1.748 -3.048
123 HB2 LEU 13 HB2 LEU 13 1.110 4.126 -3.096
124 HB3 LEU 13 HB3 LEU 13 2.056 4.420 -1.651
125 HG LEU 13 HG LEU 13 4.112 3.836 -2.918
126 HD11 LEU 13 HD11 LEU 13 3.979 3.707 -5.366
127 HD12 LEU 13 HD12 LEU 13 2.217 3.722 -5.263
128 HD13 LEU 13 HD13 LEU 13 3.131 2.372 -4.587
129 HD21 LEU 13 HD21 LEU 13 2.435 6.019 -4.151
130 HD22 LEU 13 HD22 LEU 13 4.193 5.895 -4.218
131 HD23 LEU 13 HD23 LEU 13 3.386 6.162 -2.674
132 H TRP 14 H TRP 14 2.229 0.081 -1.164
133 HA TRP 14 HA TRP 14 4.265 0.961 0.721
134 HB2 TRP 14 HB2 TRP 14 2.946 -1.744 0.431
135 HB3 TRP 14 HB3 TRP 14 3.991 -1.238 1.756
136 HD1 TRP 14 HD1 TRP 14 0.450 -1.543 0.931
137 HE1 TRP 14 HE1 TRP 14 -1.014 -0.171 2.544
138 HE3 TRP 14 HE3 TRP 14 4.090 1.347 3.066
139 HZ2 TRP 14 HZ2 TRP 14 -0.670 1.874 4.454
140 HZ3 TRP 14 HZ3 TRP 14 3.436 2.992 4.776
141 HH2 TRP 14 HH2 TRP 14 1.108 3.248 5.454
142 H LYS 15 H LYS 15 3.924 -0.997 -2.165
143 HA LYS 15 HA LYS 15 6.564 -2.144 -1.943
144 HB2 LYS 15 HB2 LYS 15 4.523 -2.170 -4.161
145 HB3 LYS 15 HB3 LYS 15 6.099 -2.938 -4.297
146 HG2 LYS 15 HG2 LYS 15 5.522 -4.307 -2.297
147 HG3 LYS 15 HG3 LYS 15 3.896 -3.623 -2.367
148 HD2 LYS 15 HD2 LYS 15 3.549 -4.552 -4.566
149 HD3 LYS 15 HD3 LYS 15 5.219 -5.118 -4.629
150 HE2 LYS 15 HE2 LYS 15 3.081 -6.054 -2.720
151 HE3 LYS 15 HE3 LYS 15 3.709 -6.947 -4.104
152 HZ1 LYS 15 HZ1 LYS 15 5.937 -6.812 -2.993
153 HZ2 LYS 15 HZ2 LYS 15 4.794 -7.774 -2.194
154 HZ3 LYS 15 HZ3 LYS 15 5.147 -6.222 -1.610
155 H ALA 16 H ALA 16 6.946 0.409 -1.660
156 HA ALA 16 HA ALA 16 8.650 1.048 -3.899
157 HB1 ALA 16 HB1 ALA 16 6.560 2.136 -4.560
158 HB2 ALA 16 HB2 ALA 16 7.795 3.331 -4.166
159 HB3 ALA 16 HB3 ALA 16 6.503 2.984 -3.016
160 H LEU 17 H LEU 17 7.210 2.620 -1.058
161 HA LEU 17 HA LEU 17 9.483 3.951 -0.163
162 HB2 LEU 17 HB2 LEU 17 7.168 4.362 0.604
163 HB3 LEU 17 HB3 LEU 17 7.206 2.847 1.485
164 HG LEU 17 HG LEU 17 9.051 3.749 2.883
165 HD11 LEU 17 HD11 LEU 17 8.470 6.297 1.379
166 HD12 LEU 17 HD12 LEU 17 9.969 5.370 1.340
167 HD13 LEU 17 HD13 LEU 17 9.467 6.174 2.827
168 HD21 LEU 17 HD21 LEU 17 6.528 5.401 2.830
169 HD22 LEU 17 HD22 LEU 17 7.644 5.267 4.189
170 HD23 LEU 17 HD23 LEU 17 6.738 3.853 3.648
171 H ALA 18 H ALA 18 8.268 0.727 0.693
172 HA ALA 18 HA ALA 18 10.193 0.110 2.638
173 HB1 ALA 18 HB1 ALA 18 9.535 -2.211 2.310
174 HB2 ALA 18 HB2 ALA 18 8.720 -1.783 0.806
175 HB3 ALA 18 HB3 ALA 18 8.117 -1.161 2.343
176 H LEU 19 H LEU 19 10.164 -0.335 -0.855
177 HA LEU 19 HA LEU 19 12.584 -1.850 -0.929
178 HB2 LEU 19 HB2 LEU 19 11.136 -0.399 -3.144
179 HB3 LEU 19 HB3 LEU 19 12.422 -1.569 -3.363
180 HG LEU 19 HG LEU 19 9.698 -2.146 -2.193
181 HD11 LEU 19 HD11 LEU 19 9.342 -3.436 -4.233
182 HD12 LEU 19 HD12 LEU 19 10.914 -2.919 -4.843
183 HD13 LEU 19 HD13 LEU 19 9.631 -1.735 -4.595
184 HD21 LEU 19 HD21 LEU 19 12.032 -3.969 -2.759
185 HD22 LEU 19 HD22 LEU 19 10.411 -4.503 -2.314
186 HD23 LEU 19 HD23 LEU 19 11.371 -3.559 -1.175
187 H LYS 20 H LYS 20 11.891 1.460 -0.628
188 HA LYS 20 HA LYS 20 14.424 2.336 -1.745
189 HB2 LYS 20 HB2 LYS 20 12.263 3.850 -0.265
190 HB3 LYS 20 HB3 LYS 20 13.708 4.585 -0.946
191 HG2 LYS 20 HG2 LYS 20 11.600 3.130 -2.527
192 HG3 LYS 20 HG3 LYS 20 11.719 4.882 -2.357
193 HD2 LYS 20 HD2 LYS 20 13.819 3.082 -3.561
194 HD3 LYS 20 HD3 LYS 20 12.692 4.096 -4.467
195 HE2 LYS 20 HE2 LYS 20 13.642 6.084 -3.363
196 HE3 LYS 20 HE3 LYS 20 14.794 5.047 -2.522
197 HZ1 LYS 20 HZ1 LYS 20 15.706 4.384 -4.655
198 HZ2 LYS 20 HZ2 LYS 20 15.777 6.067 -4.470
199 HZ3 LYS 20 HZ3 LYS 20 14.591 5.373 -5.469
200 H LEU 21 H LEU 21 12.834 2.183 1.414
201 HA LEU 21 HA LEU 21 15.041 3.234 2.847
202 HB2 LEU 21 HB2 LEU 21 12.466 1.946 3.571
203 HB3 LEU 21 HB3 LEU 21 13.720 1.981 4.793
204 HG LEU 21 HG LEU 21 12.201 3.866 5.063
205 HD11 LEU 21 HD11 LEU 21 14.906 4.732 4.056
206 HD12 LEU 21 HD12 LEU 21 14.553 4.127 5.675
207 HD13 LEU 21 HD13 LEU 21 13.847 5.649 5.129
208 HD21 LEU 21 HD21 LEU 21 11.469 4.117 2.755
209 HD22 LEU 21 HD22 LEU 21 13.078 4.676 2.292
210 HD23 LEU 21 HD23 LEU 21 12.088 5.642 3.388
211 H LYS 22 H LYS 22 13.962 -0.081 2.202
212 HA LYS 22 HA LYS 22 16.223 -1.115 3.726
213 HB2 LYS 22 HB2 LYS 22 13.950 -2.190 3.809
214 HB3 LYS 22 HB3 LYS 22 14.180 -2.672 2.133
215 HG2 LYS 22 HG2 LYS 22 16.231 -3.896 2.849
216 HG3 LYS 22 HG3 LYS 22 15.801 -3.524 4.520
217 HD2 LYS 22 HD2 LYS 22 14.151 -5.104 2.553
218 HD3 LYS 22 HD3 LYS 22 15.058 -5.756 3.917
219 HE2 LYS 22 HE2 LYS 22 13.643 -4.559 5.471
220 HE3 LYS 22 HE3 LYS 22 12.780 -3.794 4.133
221 HZ1 LYS 22 HZ1 LYS 22 11.550 -5.664 5.038
222 HZ2 LYS 22 HZ2 LYS 22 12.849 -6.704 4.723
223 HZ3 LYS 22 HZ3 LYS 22 12.015 -5.978 3.437
224 H LYS 23 H LYS 23 15.312 -0.401 0.502
225 HA LYS 23 HA LYS 23 16.394 -0.443 -1.481
226 HB2 LYS 23 HB2 LYS 23 18.436 0.160 -0.208
227 HB3 LYS 23 HB3 LYS 23 18.769 -1.548 0.029
228 HG2 LYS 23 HG2 LYS 23 20.134 -0.709 -1.752
229 HG3 LYS 23 HG3 LYS 23 18.940 -1.825 -2.416
230 HD2 LYS 23 HD2 LYS 23 17.565 0.040 -3.144
231 HD3 LYS 23 HD3 LYS 23 18.697 1.181 -2.415
232 HE2 LYS 23 HE2 LYS 23 19.234 -0.682 -4.723
233 HE3 LYS 23 HE3 LYS 23 19.093 1.074 -4.789
234 HZ1 LYS 23 HZ1 LYS 23 21.031 1.034 -3.129
235 HZ2 LYS 23 HZ2 LYS 23 21.362 0.728 -4.757
236 HZ3 LYS 23 HZ3 LYS 23 21.274 -0.561 -3.658
237 H ALA 24 H ALA 24 17.203 -3.344 0.416
238 HA ALA 24 HA ALA 24 17.103 -5.027 -1.929
239 HB1 ALA 24 HB1 ALA 24 17.619 -6.844 -0.391
240 HB2 ALA 24 HB2 ALA 24 17.367 -5.767 0.982
241 HB3 ALA 24 HB3 ALA 24 18.705 -5.479 -0.132
Start of MODEL 8
1 H1 LYS 1 H1 LYS 1 5.885 -18.204 5.383
2 H2 LYS 1 H2 LYS 1 7.165 -17.358 4.669
3 H3 LYS 1 H3 LYS 1 7.367 -18.073 6.195
4 HA LYS 1 HA LYS 1 8.467 -19.450 4.664
5 HB2 LYS 1 HB2 LYS 1 5.742 -20.599 5.301
6 HB3 LYS 1 HB3 LYS 1 7.140 -21.540 4.799
7 HG2 LYS 1 HG2 LYS 1 7.031 -19.850 7.290
8 HG3 LYS 1 HG3 LYS 1 6.714 -21.585 7.237
9 HD2 LYS 1 HD2 LYS 1 9.293 -20.299 6.339
10 HD3 LYS 1 HD3 LYS 1 9.035 -20.997 7.941
11 HE2 LYS 1 HE2 LYS 1 8.857 -22.458 5.307
12 HE3 LYS 1 HE3 LYS 1 10.177 -22.571 6.469
13 HZ1 LYS 1 HZ1 LYS 1 8.544 -23.434 8.095
14 HZ2 LYS 1 HZ2 LYS 1 8.743 -24.439 6.743
15 HZ3 LYS 1 HZ3 LYS 1 7.373 -23.453 6.869
16 H LYS 2 H LYS 2 5.038 -19.514 3.626
17 HA LYS 2 HA LYS 2 6.010 -19.210 0.867
18 HB2 LYS 2 HB2 LYS 2 3.931 -21.138 1.881
19 HB3 LYS 2 HB3 LYS 2 4.058 -20.693 0.186
20 HG2 LYS 2 HG2 LYS 2 6.435 -21.488 0.255
21 HG3 LYS 2 HG3 LYS 2 6.095 -22.124 1.867
22 HD2 LYS 2 HD2 LYS 2 4.382 -23.573 0.984
23 HD3 LYS 2 HD3 LYS 2 4.556 -22.861 -0.622
24 HE2 LYS 2 HE2 LYS 2 6.869 -23.689 -0.711
25 HE3 LYS 2 HE3 LYS 2 6.650 -24.432 0.874
26 HZ1 LYS 2 HZ1 LYS 2 6.360 -26.023 -0.939
27 HZ2 LYS 2 HZ2 LYS 2 5.082 -25.101 -1.562
28 HZ3 LYS 2 HZ3 LYS 2 4.932 -25.840 -0.042
29 H LEU 3 H LEU 3 5.440 -17.251 0.337
30 HA LEU 3 HA LEU 3 4.141 -15.565 -0.412
31 HB2 LEU 3 HB2 LEU 3 1.938 -17.609 -0.146
32 HB3 LEU 3 HB3 LEU 3 1.783 -16.068 -0.969
33 HG LEU 3 HG LEU 3 3.667 -18.285 -1.782
34 HD11 LEU 3 HD11 LEU 3 2.171 -18.582 -3.681
35 HD12 LEU 3 HD12 LEU 3 1.088 -17.349 -3.033
36 HD13 LEU 3 HD13 LEU 3 1.323 -18.864 -2.160
37 HD21 LEU 3 HD21 LEU 3 2.993 -15.653 -3.094
38 HD22 LEU 3 HD22 LEU 3 3.983 -16.926 -3.806
39 HD23 LEU 3 HD23 LEU 3 4.535 -16.090 -2.356
40 H LYS 4 H LYS 4 4.771 -15.165 2.121
41 HA LYS 4 HA LYS 4 2.263 -14.126 3.265
42 HB2 LYS 4 HB2 LYS 4 3.475 -15.859 4.669
43 HB3 LYS 4 HB3 LYS 4 4.773 -14.684 4.850
44 HG2 LYS 4 HG2 LYS 4 3.314 -13.152 5.975
45 HG3 LYS 4 HG3 LYS 4 1.915 -14.177 5.654
46 HD2 LYS 4 HD2 LYS 4 3.030 -15.963 7.016
47 HD3 LYS 4 HD3 LYS 4 4.255 -14.768 7.459
48 HE2 LYS 4 HE2 LYS 4 2.543 -13.348 8.439
49 HE3 LYS 4 HE3 LYS 4 1.289 -14.484 7.947
50 HZ1 LYS 4 HZ1 LYS 4 2.417 -16.159 9.372
51 HZ2 LYS 4 HZ2 LYS 4 1.759 -14.851 10.222
52 HZ3 LYS 4 HZ3 LYS 4 3.431 -14.925 9.948
53 H LEU 5 H LEU 5 5.269 -13.407 1.895
54 HA LEU 5 HA LEU 5 5.256 -10.661 2.910
55 HB2 LEU 5 HB2 LEU 5 7.215 -12.254 1.277
56 HB3 LEU 5 HB3 LEU 5 7.313 -10.507 1.344
57 HG LEU 5 HG LEU 5 7.513 -10.705 3.849
58 HD11 LEU 5 HD11 LEU 5 8.216 -12.854 4.766
59 HD12 LEU 5 HD12 LEU 5 7.928 -13.621 3.204
60 HD13 LEU 5 HD13 LEU 5 6.580 -12.940 4.114
61 HD21 LEU 5 HD21 LEU 5 9.877 -11.335 3.777
62 HD22 LEU 5 HD22 LEU 5 9.439 -10.288 2.427
63 HD23 LEU 5 HD23 LEU 5 9.641 -12.020 2.168
64 H ALA 6 H ALA 6 3.102 -11.592 1.327
65 HA ALA 6 HA ALA 6 3.431 -9.943 -1.089
66 HB1 ALA 6 HB1 ALA 6 1.690 -11.329 -2.130
67 HB2 ALA 6 HB2 ALA 6 1.608 -12.313 -0.670
68 HB3 ALA 6 HB3 ALA 6 3.081 -12.298 -1.639
69 HA PRO 7 HA PRO 7 0.169 -8.009 1.490
70 HB2 PRO 7 HB2 PRO 7 1.476 -5.668 1.981
71 HB3 PRO 7 HB3 PRO 7 1.679 -7.121 2.958
72 HG2 PRO 7 HG2 PRO 7 3.590 -5.851 1.189
73 HG3 PRO 7 HG3 PRO 7 3.841 -7.193 2.317
74 HD2 PRO 7 HD2 PRO 7 3.379 -7.257 -0.584
75 HD3 PRO 7 HD3 PRO 7 4.034 -8.517 0.483
76 H ALA 8 H ALA 8 -0.168 -8.146 -1.193
77 HA ALA 8 HA ALA 8 0.021 -5.706 -2.597
78 HB1 ALA 8 HB1 ALA 8 -1.870 -8.012 -3.066
79 HB2 ALA 8 HB2 ALA 8 -0.239 -7.863 -3.722
80 HB3 ALA 8 HB3 ALA 8 -1.495 -6.727 -4.214
81 H LYS 9 H LYS 9 -2.440 -7.061 -0.494
82 HA LYS 9 HA LYS 9 -4.238 -4.821 -1.018
83 HB2 LYS 9 HB2 LYS 9 -4.514 -7.224 0.797
84 HB3 LYS 9 HB3 LYS 9 -5.755 -6.002 0.559
85 HG2 LYS 9 HG2 LYS 9 -5.885 -6.599 -1.805
86 HG3 LYS 9 HG3 LYS 9 -4.651 -7.837 -1.559
87 HD2 LYS 9 HD2 LYS 9 -6.083 -9.030 -0.034
88 HD3 LYS 9 HD3 LYS 9 -7.294 -7.747 -0.110
89 HE2 LYS 9 HE2 LYS 9 -6.425 -9.548 -2.365
90 HE3 LYS 9 HE3 LYS 9 -7.962 -9.612 -1.502
91 HZ1 LYS 9 HZ1 LYS 9 -8.455 -8.450 -3.422
92 HZ2 LYS 9 HZ2 LYS 9 -6.996 -7.587 -3.415
93 HZ3 LYS 9 HZ3 LYS 9 -8.212 -7.200 -2.296
94 H LEU 10 H LEU 10 -1.545 -5.071 0.729
95 HA LEU 10 HA LEU 10 -2.647 -3.629 3.057
96 HB2 LEU 10 HB2 LEU 10 -0.232 -5.443 2.989
97 HB3 LEU 10 HB3 LEU 10 -0.805 -4.558 4.389
98 HG LEU 10 HG LEU 10 -2.326 -6.756 2.981
99 HD11 LEU 10 HD11 LEU 10 -0.369 -7.605 4.138
100 HD12 LEU 10 HD12 LEU 10 -1.847 -8.072 4.980
101 HD13 LEU 10 HD13 LEU 10 -0.852 -6.757 5.607
102 HD21 LEU 10 HD21 LEU 10 -3.796 -5.103 4.008
103 HD22 LEU 10 HD22 LEU 10 -2.929 -5.269 5.535
104 HD23 LEU 10 HD23 LEU 10 -3.842 -6.631 4.885
105 H ALA 11 H ALA 11 0.443 -4.149 1.368
106 HA ALA 11 HA ALA 11 1.068 -1.305 1.816
107 HB1 ALA 11 HB1 ALA 11 2.418 -2.761 3.248
108 HB2 ALA 11 HB2 ALA 11 3.409 -1.924 2.054
109 HB3 ALA 11 HB3 ALA 11 3.001 -3.624 1.824
110 H LEU 12 H LEU 12 -0.243 -1.703 -0.391
111 HA LEU 12 HA LEU 12 1.396 -2.465 -2.622
112 HB2 LEU 12 HB2 LEU 12 -1.090 -2.697 -2.573
113 HB3 LEU 12 HB3 LEU 12 -1.220 -0.949 -2.596
114 HG LEU 12 HG LEU 12 -0.123 -0.909 -4.807
115 HD11 LEU 12 HD11 LEU 12 0.178 -3.003 -6.038
116 HD12 LEU 12 HD12 LEU 12 -0.276 -3.915 -4.599
117 HD13 LEU 12 HD13 LEU 12 1.199 -2.947 -4.602
118 HD21 LEU 12 HD21 LEU 12 -2.531 -2.717 -4.630
119 HD22 LEU 12 HD22 LEU 12 -1.997 -1.849 -6.069
120 HD23 LEU 12 HD23 LEU 12 -2.555 -0.955 -4.656
121 H LEU 13 H LEU 13 0.474 0.490 -0.988
122 HA LEU 13 HA LEU 13 1.846 2.163 -2.928
123 HB2 LEU 13 HB2 LEU 13 -0.180 3.011 -1.876
124 HB3 LEU 13 HB3 LEU 13 0.529 2.808 -0.286
125 HG LEU 13 HG LEU 13 2.203 4.538 -0.823
126 HD11 LEU 13 HD11 LEU 13 1.946 5.907 -2.815
127 HD12 LEU 13 HD12 LEU 13 0.619 4.884 -3.363
128 HD13 LEU 13 HD13 LEU 13 2.250 4.225 -3.250
129 HD21 LEU 13 HD21 LEU 13 -0.666 5.385 -1.221
130 HD22 LEU 13 HD22 LEU 13 0.663 6.446 -0.752
131 HD23 LEU 13 HD23 LEU 13 0.144 5.152 0.329
132 H TRP 14 H TRP 14 2.366 0.717 0.190
133 HA TRP 14 HA TRP 14 4.731 2.224 0.798
134 HB2 TRP 14 HB2 TRP 14 3.777 -0.362 2.041
135 HB3 TRP 14 HB3 TRP 14 4.957 0.756 2.717
136 HD1 TRP 14 HD1 TRP 14 1.543 -0.160 3.262
137 HE1 TRP 14 HE1 TRP 14 0.166 1.746 4.307
138 HE3 TRP 14 HE3 TRP 14 4.718 3.749 2.343
139 HZ2 TRP 14 HZ2 TRP 14 0.395 4.526 4.702
140 HZ3 TRP 14 HZ3 TRP 14 4.062 6.000 3.098
141 HH2 TRP 14 HH2 TRP 14 1.944 6.376 4.251
142 H LYS 15 H LYS 15 4.092 -0.131 -1.384
143 HA LYS 15 HA LYS 15 6.293 -1.841 -1.326
144 HB2 LYS 15 HB2 LYS 15 4.412 -2.280 -2.757
145 HB3 LYS 15 HB3 LYS 15 4.651 -0.770 -3.621
146 HG2 LYS 15 HG2 LYS 15 6.786 -1.642 -4.490
147 HG3 LYS 15 HG3 LYS 15 6.461 -3.174 -3.674
148 HD2 LYS 15 HD2 LYS 15 4.523 -3.562 -5.011
149 HD3 LYS 15 HD3 LYS 15 4.591 -1.935 -5.688
150 HE2 LYS 15 HE2 LYS 15 6.734 -2.499 -6.763
151 HE3 LYS 15 HE3 LYS 15 6.606 -4.137 -6.120
152 HZ1 LYS 15 HZ1 LYS 15 4.671 -4.532 -7.414
153 HZ2 LYS 15 HZ2 LYS 15 5.839 -3.883 -8.460
154 HZ3 LYS 15 HZ3 LYS 15 4.567 -2.909 -7.894
155 H ALA 16 H ALA 16 5.905 1.384 -2.696
156 HA ALA 16 HA ALA 16 8.387 1.538 -4.016
157 HB1 ALA 16 HB1 ALA 16 8.015 3.944 -4.051
158 HB2 ALA 16 HB2 ALA 16 6.740 3.777 -2.844
159 HB3 ALA 16 HB3 ALA 16 6.530 3.081 -4.451
160 H LEU 17 H LEU 17 7.414 2.136 -0.706
161 HA LEU 17 HA LEU 17 9.904 3.327 0.072
162 HB2 LEU 17 HB2 LEU 17 7.565 2.267 1.650
163 HB3 LEU 17 HB3 LEU 17 9.004 2.904 2.420
164 HG LEU 17 HG LEU 17 8.551 5.067 1.146
165 HD11 LEU 17 HD11 LEU 17 6.976 4.153 -0.491
166 HD12 LEU 17 HD12 LEU 17 6.263 5.473 0.436
167 HD13 LEU 17 HD13 LEU 17 5.835 3.803 0.807
168 HD21 LEU 17 HD21 LEU 17 8.175 4.799 3.544
169 HD22 LEU 17 HD22 LEU 17 6.562 4.161 3.225
170 HD23 LEU 17 HD23 LEU 17 6.947 5.833 2.815
171 H ALA 18 H ALA 18 8.434 0.140 0.244
172 HA ALA 18 HA ALA 18 10.361 -1.112 1.854
173 HB1 ALA 18 HB1 ALA 18 9.488 -3.213 0.972
174 HB2 ALA 18 HB2 ALA 18 8.650 -2.339 -0.310
175 HB3 ALA 18 HB3 ALA 18 8.176 -2.106 1.372
176 H LEU 19 H LEU 19 10.260 -0.487 -1.604
177 HA LEU 19 HA LEU 19 12.671 -2.073 -2.025
178 HB2 LEU 19 HB2 LEU 19 10.947 -0.572 -3.993
179 HB3 LEU 19 HB3 LEU 19 12.286 -1.624 -4.408
180 HG LEU 19 HG LEU 19 9.748 -2.517 -3.032
181 HD11 LEU 19 HD11 LEU 19 9.330 -1.841 -5.329
182 HD12 LEU 19 HD12 LEU 19 9.240 -3.598 -5.173
183 HD13 LEU 19 HD13 LEU 19 10.670 -2.845 -5.880
184 HD21 LEU 19 HD21 LEU 19 10.582 -4.771 -3.469
185 HD22 LEU 19 HD22 LEU 19 11.701 -3.873 -2.444
186 HD23 LEU 19 HD23 LEU 19 12.060 -4.098 -4.155
187 H LYS 20 H LYS 20 12.393 0.765 -0.726
188 HA LYS 20 HA LYS 20 14.721 1.836 -2.147
189 HB2 LYS 20 HB2 LYS 20 12.769 3.063 -2.956
190 HB3 LYS 20 HB3 LYS 20 12.322 3.468 -1.303
191 HG2 LYS 20 HG2 LYS 20 14.308 4.808 -1.046
192 HG3 LYS 20 HG3 LYS 20 14.881 4.323 -2.643
193 HD2 LYS 20 HD2 LYS 20 12.964 5.419 -3.678
194 HD3 LYS 20 HD3 LYS 20 12.354 5.881 -2.088
195 HE2 LYS 20 HE2 LYS 20 13.518 7.736 -3.192
196 HE3 LYS 20 HE3 LYS 20 14.331 7.246 -1.704
197 HZ1 LYS 20 HZ1 LYS 20 15.142 6.591 -4.488
198 HZ2 LYS 20 HZ2 LYS 20 15.863 5.913 -3.110
199 HZ3 LYS 20 HZ3 LYS 20 15.970 7.580 -3.384
200 H LEU 21 H LEU 21 12.717 2.153 0.774
201 HA LEU 21 HA LEU 21 14.953 3.285 2.221
202 HB2 LEU 21 HB2 LEU 21 12.135 2.586 3.017
203 HB3 LEU 21 HB3 LEU 21 13.326 3.147 4.171
204 HG LEU 21 HG LEU 21 11.994 5.016 3.601
205 HD11 LEU 21 HD11 LEU 21 14.571 5.165 2.051
206 HD12 LEU 21 HD12 LEU 21 14.363 5.497 3.769
207 HD13 LEU 21 HD13 LEU 21 13.605 6.547 2.571
208 HD21 LEU 21 HD21 LEU 21 10.997 4.146 1.544
209 HD22 LEU 21 HD22 LEU 21 12.522 4.408 0.696
210 HD23 LEU 21 HD23 LEU 21 11.614 5.784 1.325
211 H LYS 22 H LYS 22 13.312 0.199 1.906
212 HA LYS 22 HA LYS 22 14.912 -0.965 4.050
213 HB2 LYS 22 HB2 LYS 22 12.931 -2.281 2.185
214 HB3 LYS 22 HB3 LYS 22 13.675 -3.029 3.591
215 HG2 LYS 22 HG2 LYS 22 12.558 -1.394 5.037
216 HG3 LYS 22 HG3 LYS 22 11.796 -0.677 3.614
217 HD2 LYS 22 HD2 LYS 22 10.686 -2.806 3.130
218 HD3 LYS 22 HD3 LYS 22 11.449 -3.525 4.549
219 HE2 LYS 22 HE2 LYS 22 9.509 -1.216 4.549
220 HE3 LYS 22 HE3 LYS 22 9.138 -2.879 5.005
221 HZ1 LYS 22 HZ1 LYS 22 10.977 -2.579 6.723
222 HZ2 LYS 22 HZ2 LYS 22 9.503 -1.797 7.007
223 HZ3 LYS 22 HZ3 LYS 22 10.828 -0.912 6.426
224 H LYS 23 H LYS 23 15.124 -0.371 0.755
225 HA LYS 23 HA LYS 23 17.065 -2.512 0.306
226 HB2 LYS 23 HB2 LYS 23 15.471 -2.316 -1.464
227 HB3 LYS 23 HB3 LYS 23 15.664 -0.573 -1.539
228 HG2 LYS 23 HG2 LYS 23 16.717 -1.707 -3.435
229 HG3 LYS 23 HG3 LYS 23 17.893 -0.827 -2.460
230 HD2 LYS 23 HD2 LYS 23 18.624 -2.879 -1.416
231 HD3 LYS 23 HD3 LYS 23 17.359 -3.790 -2.243
232 HE2 LYS 23 HE2 LYS 23 19.596 -4.036 -3.288
233 HE3 LYS 23 HE3 LYS 23 18.381 -3.373 -4.378
234 HZ1 LYS 23 HZ1 LYS 23 20.632 -2.275 -4.404
235 HZ2 LYS 23 HZ2 LYS 23 20.269 -1.643 -2.872
236 HZ3 LYS 23 HZ3 LYS 23 19.305 -1.237 -4.211
237 H ALA 24 H ALA 24 19.168 -2.105 0.471
238 HA ALA 24 HA ALA 24 20.146 0.545 0.947
239 HB1 ALA 24 HB1 ALA 24 22.343 -0.518 1.085
240 HB2 ALA 24 HB2 ALA 24 21.658 -2.024 0.475
241 HB3 ALA 24 HB3 ALA 24 21.152 -1.400 2.044
Start of MODEL 9
1 H1 LYS 1 H1 LYS 1 -17.087 -2.678 -16.322
2 H2 LYS 1 H2 LYS 1 -17.740 -2.381 -14.789
3 H3 LYS 1 H3 LYS 1 -16.222 -1.740 -15.202
4 HA LYS 1 HA LYS 1 -17.228 -0.345 -16.882
5 HB2 LYS 1 HB2 LYS 1 -19.809 -1.502 -15.805
6 HB3 LYS 1 HB3 LYS 1 -19.703 -0.164 -16.938
7 HG2 LYS 1 HG2 LYS 1 -18.665 -1.628 -18.585
8 HG3 LYS 1 HG3 LYS 1 -18.745 -2.971 -17.442
9 HD2 LYS 1 HD2 LYS 1 -21.146 -1.447 -18.451
10 HD3 LYS 1 HD3 LYS 1 -20.570 -2.969 -19.137
11 HE2 LYS 1 HE2 LYS 1 -20.911 -4.068 -16.980
12 HE3 LYS 1 HE3 LYS 1 -21.472 -2.546 -16.285
13 HZ1 LYS 1 HZ1 LYS 1 -22.775 -3.885 -18.592
14 HZ2 LYS 1 HZ2 LYS 1 -23.363 -2.570 -17.700
15 HZ3 LYS 1 HZ3 LYS 1 -23.266 -4.099 -16.983
16 H LYS 2 H LYS 2 -17.335 -0.996 -13.585
17 HA LYS 2 HA LYS 2 -18.455 1.636 -12.924
18 HB2 LYS 2 HB2 LYS 2 -17.990 -0.789 -11.180
19 HB3 LYS 2 HB3 LYS 2 -18.677 0.735 -10.634
20 HG2 LYS 2 HG2 LYS 2 -20.572 0.419 -12.158
21 HG3 LYS 2 HG3 LYS 2 -19.884 -1.123 -12.676
22 HD2 LYS 2 HD2 LYS 2 -21.647 -1.401 -10.968
23 HD3 LYS 2 HD3 LYS 2 -20.080 -2.003 -10.423
24 HE2 LYS 2 HE2 LYS 2 -21.157 -0.755 -8.648
25 HE3 LYS 2 HE3 LYS 2 -19.715 0.094 -9.201
26 HZ1 LYS 2 HZ1 LYS 2 -21.448 1.293 -10.727
27 HZ2 LYS 2 HZ2 LYS 2 -21.204 1.795 -9.127
28 HZ3 LYS 2 HZ3 LYS 2 -22.540 0.822 -9.516
29 H LEU 3 H LEU 3 -15.520 0.405 -13.562
30 HA LEU 3 HA LEU 3 -14.246 2.039 -11.472
31 HB2 LEU 3 HB2 LEU 3 -13.857 -0.357 -11.108
32 HB3 LEU 3 HB3 LEU 3 -13.190 -0.494 -12.723
33 HG LEU 3 HG LEU 3 -11.333 0.994 -12.086
34 HD11 LEU 3 HD11 LEU 3 -12.590 0.895 -9.349
35 HD12 LEU 3 HD12 LEU 3 -12.465 2.315 -10.390
36 HD13 LEU 3 HD13 LEU 3 -11.008 1.571 -9.724
37 HD21 LEU 3 HD21 LEU 3 -10.190 -0.569 -10.590
38 HD22 LEU 3 HD22 LEU 3 -11.065 -1.416 -11.864
39 HD23 LEU 3 HD23 LEU 3 -11.732 -1.352 -10.233
40 H LYS 4 H LYS 4 -13.623 3.852 -12.438
41 HA LYS 4 HA LYS 4 -11.906 3.554 -14.812
42 HB2 LYS 4 HB2 LYS 4 -12.613 5.809 -15.533
43 HB3 LYS 4 HB3 LYS 4 -13.939 4.658 -15.520
44 HG2 LYS 4 HG2 LYS 4 -14.713 5.594 -13.385
45 HG3 LYS 4 HG3 LYS 4 -13.396 6.772 -13.440
46 HD2 LYS 4 HD2 LYS 4 -14.277 7.638 -15.564
47 HD3 LYS 4 HD3 LYS 4 -15.606 6.481 -15.477
48 HE2 LYS 4 HE2 LYS 4 -15.029 8.673 -13.488
49 HE3 LYS 4 HE3 LYS 4 -16.287 8.707 -14.722
50 HZ1 LYS 4 HZ1 LYS 4 -16.111 6.853 -12.407
51 HZ2 LYS 4 HZ2 LYS 4 -17.271 6.730 -13.641
52 HZ3 LYS 4 HZ3 LYS 4 -17.244 8.095 -12.633
53 H LEU 5 H LEU 5 -11.537 3.658 -11.833
54 HA LEU 5 HA LEU 5 -9.650 5.907 -11.693
55 HB2 LEU 5 HB2 LEU 5 -10.993 4.373 -9.461
56 HB3 LEU 5 HB3 LEU 5 -9.803 5.640 -9.234
57 HG LEU 5 HG LEU 5 -12.499 6.045 -10.531
58 HD11 LEU 5 HD11 LEU 5 -11.573 6.725 -7.748
59 HD12 LEU 5 HD12 LEU 5 -12.713 5.447 -8.169
60 HD13 LEU 5 HD13 LEU 5 -13.134 7.137 -8.454
61 HD21 LEU 5 HD21 LEU 5 -11.977 8.434 -10.156
62 HD22 LEU 5 HD22 LEU 5 -10.878 7.656 -11.297
63 HD23 LEU 5 HD23 LEU 5 -10.358 7.967 -9.641
64 H ALA 6 H ALA 6 -7.579 5.380 -11.720
65 HA ALA 6 HA ALA 6 -6.849 2.583 -11.151
66 HB1 ALA 6 HB1 ALA 6 -5.392 4.580 -12.872
67 HB2 ALA 6 HB2 ALA 6 -6.441 3.291 -13.465
68 HB3 ALA 6 HB3 ALA 6 -4.944 2.896 -12.619
69 HA PRO 7 HA PRO 7 -4.622 4.792 -7.877
70 HB2 PRO 7 HB2 PRO 7 -5.409 3.295 -5.828
71 HB3 PRO 7 HB3 PRO 7 -6.516 4.450 -6.579
72 HG2 PRO 7 HG2 PRO 7 -6.450 1.491 -6.782
73 HG3 PRO 7 HG3 PRO 7 -7.828 2.597 -6.884
74 HD2 PRO 7 HD2 PRO 7 -6.382 1.418 -9.044
75 HD3 PRO 7 HD3 PRO 7 -7.693 2.611 -9.139
76 H ALA 8 H ALA 8 -3.608 2.616 -9.679
77 HA ALA 8 HA ALA 8 -2.475 0.490 -8.273
78 HB1 ALA 8 HB1 ALA 8 -2.656 0.539 -10.706
79 HB2 ALA 8 HB2 ALA 8 -1.000 0.208 -10.200
80 HB3 ALA 8 HB3 ALA 8 -1.442 1.814 -10.778
81 H LYS 9 H LYS 9 -1.002 3.599 -9.196
82 HA LYS 9 HA LYS 9 1.384 2.996 -7.653
83 HB2 LYS 9 HB2 LYS 9 0.573 5.449 -9.225
84 HB3 LYS 9 HB3 LYS 9 2.133 5.240 -8.443
85 HG2 LYS 9 HG2 LYS 9 1.048 3.453 -10.609
86 HG3 LYS 9 HG3 LYS 9 2.179 4.783 -10.867
87 HD2 LYS 9 HD2 LYS 9 2.684 2.370 -9.125
88 HD3 LYS 9 HD3 LYS 9 3.310 2.602 -10.758
89 HE2 LYS 9 HE2 LYS 9 4.518 4.594 -10.012
90 HE3 LYS 9 HE3 LYS 9 3.893 4.365 -8.380
91 HZ1 LYS 9 HZ1 LYS 9 6.094 3.493 -8.491
92 HZ2 LYS 9 HZ2 LYS 9 5.724 2.556 -9.855
93 HZ3 LYS 9 HZ3 LYS 9 5.025 2.182 -8.358
94 H LEU 10 H LEU 10 -1.542 3.797 -6.653
95 HA LEU 10 HA LEU 10 -0.639 5.847 -4.740
96 HB2 LEU 10 HB2 LEU 10 -2.515 6.529 -6.165
97 HB3 LEU 10 HB3 LEU 10 -3.443 5.146 -5.617
98 HG LEU 10 HG LEU 10 -3.421 6.078 -3.320
99 HD11 LEU 10 HD11 LEU 10 -2.082 8.421 -4.658
100 HD12 LEU 10 HD12 LEU 10 -1.393 7.377 -3.415
101 HD13 LEU 10 HD13 LEU 10 -2.750 8.435 -3.027
102 HD21 LEU 10 HD21 LEU 10 -4.504 7.929 -5.442
103 HD22 LEU 10 HD22 LEU 10 -5.033 7.859 -3.761
104 HD23 LEU 10 HD23 LEU 10 -5.300 6.480 -4.829
105 H ALA 11 H ALA 11 -2.525 2.854 -5.019
106 HA ALA 11 HA ALA 11 -2.871 2.639 -2.165
107 HB1 ALA 11 HB1 ALA 11 -3.479 0.638 -4.342
108 HB2 ALA 11 HB2 ALA 11 -4.600 1.846 -3.712
109 HB3 ALA 11 HB3 ALA 11 -4.018 0.551 -2.666
110 H LEU 12 H LEU 12 -0.759 1.264 -4.605
111 HA LEU 12 HA LEU 12 0.336 -0.665 -2.729
112 HB2 LEU 12 HB2 LEU 12 -0.119 -1.130 -5.179
113 HB3 LEU 12 HB3 LEU 12 1.247 -0.096 -5.544
114 HG LEU 12 HG LEU 12 2.710 -1.628 -4.248
115 HD11 LEU 12 HD11 LEU 12 0.208 -3.295 -4.078
116 HD12 LEU 12 HD12 LEU 12 1.092 -2.574 -2.734
117 HD13 LEU 12 HD13 LEU 12 1.830 -3.862 -3.684
118 HD21 LEU 12 HD21 LEU 12 2.508 -1.839 -6.674
119 HD22 LEU 12 HD22 LEU 12 1.138 -2.930 -6.468
120 HD23 LEU 12 HD23 LEU 12 2.741 -3.411 -5.912
121 H LEU 13 H LEU 13 0.781 1.710 -1.650
122 HA LEU 13 HA LEU 13 3.143 3.027 -2.542
123 HB2 LEU 13 HB2 LEU 13 2.986 4.385 -0.600
124 HB3 LEU 13 HB3 LEU 13 1.358 4.119 -1.188
125 HG LEU 13 HG LEU 13 2.504 2.480 1.069
126 HD11 LEU 13 HD11 LEU 13 1.019 5.096 1.265
127 HD12 LEU 13 HD12 LEU 13 2.703 4.817 1.707
128 HD13 LEU 13 HD13 LEU 13 1.411 4.032 2.614
129 HD21 LEU 13 HD21 LEU 13 0.157 2.162 1.641
130 HD22 LEU 13 HD22 LEU 13 0.470 1.640 -0.015
131 HD23 LEU 13 HD23 LEU 13 -0.324 3.185 0.287
132 H TRP 14 H TRP 14 2.536 0.327 -0.482
133 HA TRP 14 HA TRP 14 4.765 0.388 1.182
134 HB2 TRP 14 HB2 TRP 14 3.268 -1.995 0.080
135 HB3 TRP 14 HB3 TRP 14 4.439 -2.071 1.393
136 HD1 TRP 14 HD1 TRP 14 3.746 -0.439 3.599
137 HE1 TRP 14 HE1 TRP 14 1.422 -0.150 4.664
138 HE3 TRP 14 HE3 TRP 14 0.869 -2.034 -0.312
139 HZ2 TRP 14 HZ2 TRP 14 -1.280 -0.544 3.930
140 HZ3 TRP 14 HZ3 TRP 14 -1.580 -2.048 -0.048
141 HH2 TRP 14 HH2 TRP 14 -2.629 -1.319 2.031
142 H LYS 15 H LYS 15 4.399 -0.993 -2.058
143 HA LYS 15 HA LYS 15 6.972 -2.219 -2.068
144 HB2 LYS 15 HB2 LYS 15 5.225 -1.513 -4.431
145 HB3 LYS 15 HB3 LYS 15 6.557 -2.663 -4.418
146 HG2 LYS 15 HG2 LYS 15 3.984 -2.922 -2.876
147 HG3 LYS 15 HG3 LYS 15 4.399 -3.786 -4.354
148 HD2 LYS 15 HD2 LYS 15 6.224 -4.914 -3.215
149 HD3 LYS 15 HD3 LYS 15 5.902 -3.993 -1.744
150 HE2 LYS 15 HE2 LYS 15 3.698 -5.007 -1.574
151 HE3 LYS 15 HE3 LYS 15 3.975 -5.893 -3.068
152 HZ1 LYS 15 HZ1 LYS 15 5.732 -7.122 -2.019
153 HZ2 LYS 15 HZ2 LYS 15 4.327 -7.245 -1.074
154 HZ3 LYS 15 HZ3 LYS 15 5.585 -6.214 -0.592
155 H ALA 16 H ALA 16 5.802 0.942 -2.744
156 HA ALA 16 HA ALA 16 8.113 1.722 -4.284
157 HB1 ALA 16 HB1 ALA 16 5.893 3.399 -3.122
158 HB2 ALA 16 HB2 ALA 16 5.938 2.722 -4.751
159 HB3 ALA 16 HB3 ALA 16 7.113 3.949 -4.273
160 H LEU 17 H LEU 17 6.887 2.209 -1.008
161 HA LEU 17 HA LEU 17 9.040 3.997 -0.323
162 HB2 LEU 17 HB2 LEU 17 6.920 2.744 1.422
163 HB3 LEU 17 HB3 LEU 17 8.002 4.036 1.900
164 HG LEU 17 HG LEU 17 5.867 4.216 -0.229
165 HD11 LEU 17 HD11 LEU 17 6.042 5.438 2.520
166 HD12 LEU 17 HD12 LEU 17 4.958 4.134 2.027
167 HD13 LEU 17 HD13 LEU 17 4.777 5.745 1.330
168 HD21 LEU 17 HD21 LEU 17 6.420 6.596 -0.305
169 HD22 LEU 17 HD22 LEU 17 7.805 5.605 -0.774
170 HD23 LEU 17 HD23 LEU 17 7.738 6.331 0.833
171 H ALA 18 H ALA 18 8.042 0.737 0.745
172 HA ALA 18 HA ALA 18 10.081 0.493 2.681
173 HB1 ALA 18 HB1 ALA 18 8.544 -1.707 1.315
174 HB2 ALA 18 HB2 ALA 18 8.012 -0.813 2.737
175 HB3 ALA 18 HB3 ALA 18 9.441 -1.842 2.827
176 H LEU 19 H LEU 19 9.916 -0.483 -0.700
177 HA LEU 19 HA LEU 19 12.321 -2.020 -0.597
178 HB2 LEU 19 HB2 LEU 19 10.573 -1.040 -2.821
179 HB3 LEU 19 HB3 LEU 19 12.129 -1.762 -3.171
180 HG LEU 19 HG LEU 19 10.428 -3.441 -3.417
181 HD11 LEU 19 HD11 LEU 19 11.201 -5.117 -1.807
182 HD12 LEU 19 HD12 LEU 19 11.966 -3.842 -0.857
183 HD13 LEU 19 HD13 LEU 19 12.535 -4.190 -2.490
184 HD21 LEU 19 HD21 LEU 19 8.707 -2.408 -2.000
185 HD22 LEU 19 HD22 LEU 19 9.628 -2.864 -0.567
186 HD23 LEU 19 HD23 LEU 19 8.949 -4.111 -1.612
187 H LYS 20 H LYS 20 11.715 1.309 -0.704
188 HA LYS 20 HA LYS 20 14.381 1.850 -1.784
189 HB2 LYS 20 HB2 LYS 20 12.108 3.699 -1.060
190 HB3 LYS 20 HB3 LYS 20 13.713 4.274 -1.499
191 HG2 LYS 20 HG2 LYS 20 11.808 2.706 -3.221
192 HG3 LYS 20 HG3 LYS 20 12.317 4.383 -3.433
193 HD2 LYS 20 HD2 LYS 20 14.621 3.625 -3.818
194 HD3 LYS 20 HD3 LYS 20 14.101 1.950 -3.624
195 HE2 LYS 20 HE2 LYS 20 14.261 2.419 -5.962
196 HE3 LYS 20 HE3 LYS 20 12.553 2.285 -5.549
197 HZ1 LYS 20 HZ1 LYS 20 12.971 4.162 -7.004
198 HZ2 LYS 20 HZ2 LYS 20 14.064 4.820 -5.890
199 HZ3 LYS 20 HZ3 LYS 20 12.418 4.698 -5.494
200 H LEU 21 H LEU 21 12.545 1.895 1.170
201 HA LEU 21 HA LEU 21 14.447 3.195 2.797
202 HB2 LEU 21 HB2 LEU 21 12.382 1.101 3.493
203 HB3 LEU 21 HB3 LEU 21 13.304 2.010 4.674
204 HG LEU 21 HG LEU 21 11.375 3.219 2.689
205 HD11 LEU 21 HD11 LEU 21 11.092 2.696 5.643
206 HD12 LEU 21 HD12 LEU 21 10.222 1.869 4.349
207 HD13 LEU 21 HD13 LEU 21 9.947 3.587 4.643
208 HD21 LEU 21 HD21 LEU 21 11.649 5.251 4.028
209 HD22 LEU 21 HD22 LEU 21 13.180 4.741 3.316
210 HD23 LEU 21 HD23 LEU 21 12.856 4.435 5.023
211 H LYS 22 H LYS 22 13.761 -0.295 2.463
212 HA LYS 22 HA LYS 22 16.282 -0.920 3.734
213 HB2 LYS 22 HB2 LYS 22 14.213 -2.744 2.509
214 HB3 LYS 22 HB3 LYS 22 15.591 -3.264 3.466
215 HG2 LYS 22 HG2 LYS 22 14.665 -1.934 5.369
216 HG3 LYS 22 HG3 LYS 22 13.219 -1.668 4.389
217 HD2 LYS 22 HD2 LYS 22 12.955 -4.123 4.197
218 HD3 LYS 22 HD3 LYS 22 14.331 -4.321 5.288
219 HE2 LYS 22 HE2 LYS 22 13.094 -3.016 6.995
220 HE3 LYS 22 HE3 LYS 22 11.702 -2.981 5.911
221 HZ1 LYS 22 HZ1 LYS 22 11.362 -4.751 7.400
222 HZ2 LYS 22 HZ2 LYS 22 12.941 -5.336 7.212
223 HZ3 LYS 22 HZ3 LYS 22 11.829 -5.474 5.935
224 H LYS 23 H LYS 23 15.126 -0.424 0.587
225 HA LYS 23 HA LYS 23 16.075 -0.493 -1.464
226 HB2 LYS 23 HB2 LYS 23 18.575 -0.879 0.178
227 HB3 LYS 23 HB3 LYS 23 18.596 -0.727 -1.575
228 HG2 LYS 23 HG2 LYS 23 17.731 1.485 -1.472
229 HG3 LYS 23 HG3 LYS 23 17.387 1.335 0.251
230 HD2 LYS 23 HD2 LYS 23 20.159 1.180 -0.921
231 HD3 LYS 23 HD3 LYS 23 19.437 2.668 -0.310
232 HE2 LYS 23 HE2 LYS 23 19.938 0.148 1.268
233 HE3 LYS 23 HE3 LYS 23 20.864 1.643 1.375
234 HZ1 LYS 23 HZ1 LYS 23 18.745 2.746 2.060
235 HZ2 LYS 23 HZ2 LYS 23 19.344 1.620 3.174
236 HZ3 LYS 23 HZ3 LYS 23 18.040 1.212 2.177
237 H ALA 24 H ALA 24 15.212 -2.948 0.058
238 HA ALA 24 HA ALA 24 14.942 -5.164 -0.288
239 HB1 ALA 24 HB1 ALA 24 15.123 -5.999 -2.571
240 HB2 ALA 24 HB2 ALA 24 15.987 -4.537 -3.050
241 HB3 ALA 24 HB3 ALA 24 14.303 -4.437 -2.531
Start of MODEL 10
1 H1 LYS 1 H1 LYS 1 -5.918 -7.670 -3.595
2 H2 LYS 1 H2 LYS 1 -7.487 -7.049 -3.741
3 H3 LYS 1 H3 LYS 1 -7.226 -8.513 -2.927
4 HA LYS 1 HA LYS 1 -7.634 -6.702 -1.398
5 HB2 LYS 1 HB2 LYS 1 -4.891 -7.948 -1.430
6 HB3 LYS 1 HB3 LYS 1 -5.456 -6.957 -0.093
7 HG2 LYS 1 HG2 LYS 1 -6.758 -9.502 -1.056
8 HG3 LYS 1 HG3 LYS 1 -5.725 -9.339 0.367
9 HD2 LYS 1 HD2 LYS 1 -7.319 -7.743 1.330
10 HD3 LYS 1 HD3 LYS 1 -8.358 -7.939 -0.081
11 HE2 LYS 1 HE2 LYS 1 -7.578 -10.149 1.818
12 HE3 LYS 1 HE3 LYS 1 -9.106 -9.274 1.861
13 HZ1 LYS 1 HZ1 LYS 1 -9.584 -10.075 -0.371
14 HZ2 LYS 1 HZ2 LYS 1 -9.345 -11.369 0.705
15 HZ3 LYS 1 HZ3 LYS 1 -8.124 -10.942 -0.394
16 H LYS 2 H LYS 2 -7.901 -4.657 -2.133
17 HA LYS 2 HA LYS 2 -5.470 -3.010 -2.188
18 HB2 LYS 2 HB2 LYS 2 -7.694 -2.990 -4.226
19 HB3 LYS 2 HB3 LYS 2 -6.607 -1.628 -4.005
20 HG2 LYS 2 HG2 LYS 2 -5.780 -4.422 -4.766
21 HG3 LYS 2 HG3 LYS 2 -5.925 -3.051 -5.868
22 HD2 LYS 2 HD2 LYS 2 -4.204 -1.857 -4.545
23 HD3 LYS 2 HD3 LYS 2 -4.025 -3.289 -3.529
24 HE2 LYS 2 HE2 LYS 2 -3.548 -3.189 -6.506
25 HE3 LYS 2 HE3 LYS 2 -2.290 -3.131 -5.272
26 HZ1 LYS 2 HZ1 LYS 2 -2.809 -5.315 -4.582
27 HZ2 LYS 2 HZ2 LYS 2 -2.680 -5.360 -6.272
28 HZ3 LYS 2 HZ3 LYS 2 -4.206 -5.376 -5.536
29 H LEU 3 H LEU 3 -7.866 -3.626 -0.366
30 HA LEU 3 HA LEU 3 -8.590 -0.815 0.117
31 HB2 LEU 3 HB2 LEU 3 -10.493 -2.051 -0.833
32 HB3 LEU 3 HB3 LEU 3 -10.371 -3.229 0.459
33 HG LEU 3 HG LEU 3 -10.931 -1.471 2.098
34 HD11 LEU 3 HD11 LEU 3 -11.370 0.263 -0.333
35 HD12 LEU 3 HD12 LEU 3 -10.079 0.459 0.854
36 HD13 LEU 3 HD13 LEU 3 -11.762 0.689 1.333
37 HD21 LEU 3 HD21 LEU 3 -12.698 -2.880 1.206
38 HD22 LEU 3 HD22 LEU 3 -12.902 -1.786 -0.164
39 HD23 LEU 3 HD23 LEU 3 -13.293 -1.239 1.467
40 H LYS 4 H LYS 4 -7.252 -0.378 1.782
41 HA LYS 4 HA LYS 4 -7.615 -1.981 4.223
42 HB2 LYS 4 HB2 LYS 4 -5.148 -0.573 3.204
43 HB3 LYS 4 HB3 LYS 4 -5.321 -1.068 4.881
44 HG2 LYS 4 HG2 LYS 4 -5.549 -3.400 4.155
45 HG3 LYS 4 HG3 LYS 4 -5.351 -2.884 2.477
46 HD2 LYS 4 HD2 LYS 4 -3.121 -2.124 2.903
47 HD3 LYS 4 HD3 LYS 4 -3.306 -2.372 4.638
48 HE2 LYS 4 HE2 LYS 4 -3.364 -4.545 2.549
49 HE3 LYS 4 HE3 LYS 4 -1.977 -4.143 3.561
50 HZ1 LYS 4 HZ1 LYS 4 -3.398 -4.645 5.513
51 HZ2 LYS 4 HZ2 LYS 4 -3.103 -5.990 4.522
52 HZ3 LYS 4 HZ3 LYS 4 -4.600 -5.204 4.454
53 H LEU 5 H LEU 5 -9.136 0.285 3.213
54 HA LEU 5 HA LEU 5 -10.067 2.241 3.854
55 HB2 LEU 5 HB2 LEU 5 -10.189 1.155 6.064
56 HB3 LEU 5 HB3 LEU 5 -8.600 1.788 6.453
57 HG LEU 5 HG LEU 5 -9.503 4.095 6.264
58 HD11 LEU 5 HD11 LEU 5 -11.915 4.429 6.194
59 HD12 LEU 5 HD12 LEU 5 -12.157 2.695 5.985
60 HD13 LEU 5 HD13 LEU 5 -11.343 3.629 4.729
61 HD21 LEU 5 HD21 LEU 5 -10.792 4.039 8.341
62 HD22 LEU 5 HD22 LEU 5 -9.362 3.012 8.434
63 HD23 LEU 5 HD23 LEU 5 -10.953 2.289 8.195
64 H ALA 6 H ALA 6 -9.320 3.819 2.650
65 HA ALA 6 HA ALA 6 -8.028 5.469 1.786
66 HB1 ALA 6 HB1 ALA 6 -6.819 6.891 3.331
67 HB2 ALA 6 HB2 ALA 6 -6.890 5.643 4.575
68 HB3 ALA 6 HB3 ALA 6 -8.373 6.425 4.025
69 HA PRO 7 HA PRO 7 -4.470 2.410 1.563
70 HB2 PRO 7 HB2 PRO 7 -5.200 2.154 -1.262
71 HB3 PRO 7 HB3 PRO 7 -5.008 0.894 -0.041
72 HG2 PRO 7 HG2 PRO 7 -7.421 1.566 -1.029
73 HG3 PRO 7 HG3 PRO 7 -7.199 1.043 0.652
74 HD2 PRO 7 HD2 PRO 7 -7.514 3.818 -0.442
75 HD3 PRO 7 HD3 PRO 7 -8.242 3.089 1.007
76 H ALA 8 H ALA 8 -5.533 4.996 -0.560
77 HA ALA 8 HA ALA 8 -2.870 5.404 -1.643
78 HB1 ALA 8 HB1 ALA 8 -3.881 7.193 -2.937
79 HB2 ALA 8 HB2 ALA 8 -5.376 7.045 -2.016
80 HB3 ALA 8 HB3 ALA 8 -4.854 5.727 -3.066
81 H LYS 9 H LYS 9 -4.312 6.089 1.203
82 HA LYS 9 HA LYS 9 -2.948 8.673 1.535
83 HB2 LYS 9 HB2 LYS 9 -5.373 8.724 1.908
84 HB3 LYS 9 HB3 LYS 9 -5.219 7.466 3.126
85 HG2 LYS 9 HG2 LYS 9 -3.828 9.001 4.472
86 HG3 LYS 9 HG3 LYS 9 -4.122 10.265 3.271
87 HD2 LYS 9 HD2 LYS 9 -6.541 10.042 3.661
88 HD3 LYS 9 HD3 LYS 9 -6.212 8.832 4.905
89 HE2 LYS 9 HE2 LYS 9 -4.925 10.508 6.166
90 HE3 LYS 9 HE3 LYS 9 -5.315 11.713 4.936
91 HZ1 LYS 9 HZ1 LYS 9 -6.792 11.911 6.816
92 HZ2 LYS 9 HZ2 LYS 9 -7.263 10.287 6.670
93 HZ3 LYS 9 HZ3 LYS 9 -7.670 11.401 5.454
94 H LEU 10 H LEU 10 -3.699 5.668 3.316
95 HA LEU 10 HA LEU 10 -1.705 6.267 5.308
96 HB2 LEU 10 HB2 LEU 10 -3.807 5.116 5.871
97 HB3 LEU 10 HB3 LEU 10 -3.330 3.764 4.860
98 HG LEU 10 HG LEU 10 -1.388 3.377 6.347
99 HD11 LEU 10 HD11 LEU 10 -1.329 4.482 8.533
100 HD12 LEU 10 HD12 LEU 10 -2.653 5.531 8.030
101 HD13 LEU 10 HD13 LEU 10 -1.096 5.622 7.208
102 HD21 LEU 10 HD21 LEU 10 -2.674 2.470 8.227
103 HD22 LEU 10 HD22 LEU 10 -3.434 2.116 6.674
104 HD23 LEU 10 HD23 LEU 10 -4.081 3.395 7.702
105 H ALA 11 H ALA 11 -2.146 3.556 3.034
106 HA ALA 11 HA ALA 11 0.497 2.578 3.410
107 HB1 ALA 11 HB1 ALA 11 -1.409 1.987 1.146
108 HB2 ALA 11 HB2 ALA 11 -1.386 1.151 2.697
109 HB3 ALA 11 HB3 ALA 11 0.001 1.037 1.614
110 H LEU 12 H LEU 12 -1.066 4.158 0.626
111 HA LEU 12 HA LEU 12 -0.250 5.354 -1.120
112 HB2 LEU 12 HB2 LEU 12 0.146 6.939 0.714
113 HB3 LEU 12 HB3 LEU 12 1.736 6.251 0.973
114 HG LEU 12 HG LEU 12 2.433 7.027 -1.256
115 HD11 LEU 12 HD11 LEU 12 -0.310 8.274 -1.355
116 HD12 LEU 12 HD12 LEU 12 0.289 6.975 -2.385
117 HD13 LEU 12 HD13 LEU 12 0.999 8.585 -2.496
118 HD21 LEU 12 HD21 LEU 12 1.241 9.176 0.495
119 HD22 LEU 12 HD22 LEU 12 2.486 9.421 -0.732
120 HD23 LEU 12 HD23 LEU 12 2.830 8.436 0.692
121 H LEU 13 H LEU 13 0.362 3.105 -1.849
122 HA LEU 13 HA LEU 13 1.758 1.638 -2.873
123 HB2 LEU 13 HB2 LEU 13 3.264 4.214 -3.332
124 HB3 LEU 13 HB3 LEU 13 3.767 2.688 -4.028
125 HG LEU 13 HG LEU 13 2.603 3.823 -5.724
126 HD11 LEU 13 HD11 LEU 13 0.673 1.862 -4.494
127 HD12 LEU 13 HD12 LEU 13 2.033 1.462 -5.543
128 HD13 LEU 13 HD13 LEU 13 0.680 2.403 -6.173
129 HD21 LEU 13 HD21 LEU 13 0.374 4.780 -5.475
130 HD22 LEU 13 HD22 LEU 13 1.509 5.516 -4.347
131 HD23 LEU 13 HD23 LEU 13 0.354 4.313 -3.774
132 H TRP 14 H TRP 14 1.973 1.200 -0.372
133 HA TRP 14 HA TRP 14 4.199 1.797 1.112
134 HB2 TRP 14 HB2 TRP 14 2.163 0.623 1.926
135 HB3 TRP 14 HB3 TRP 14 2.725 -0.841 1.131
136 HD1 TRP 14 HD1 TRP 14 4.927 -2.042 2.199
137 HE1 TRP 14 HE1 TRP 14 5.867 -1.998 4.598
138 HE3 TRP 14 HE3 TRP 14 2.415 2.047 3.973
139 HZ2 TRP 14 HZ2 TRP 14 5.571 -0.436 6.935
140 HZ3 TRP 14 HZ3 TRP 14 2.798 2.748 6.303
141 HH2 TRP 14 HH2 TRP 14 4.344 1.528 7.751
142 H LYS 15 H LYS 15 3.820 -0.864 -1.197
143 HA LYS 15 HA LYS 15 6.224 -2.177 -0.571
144 HB2 LYS 15 HB2 LYS 15 4.581 -2.195 -3.107
145 HB3 LYS 15 HB3 LYS 15 5.940 -3.269 -2.806
146 HG2 LYS 15 HG2 LYS 15 3.400 -3.134 -1.193
147 HG3 LYS 15 HG3 LYS 15 3.834 -4.389 -2.353
148 HD2 LYS 15 HD2 LYS 15 5.755 -5.004 -0.983
149 HD3 LYS 15 HD3 LYS 15 5.346 -3.732 0.170
150 HE2 LYS 15 HE2 LYS 15 4.573 -5.867 0.999
151 HE3 LYS 15 HE3 LYS 15 3.192 -4.849 0.594
152 HZ1 LYS 15 HZ1 LYS 15 4.293 -6.957 -1.189
153 HZ2 LYS 15 HZ2 LYS 15 2.865 -6.067 -1.421
154 HZ3 LYS 15 HZ3 LYS 15 2.971 -7.179 -0.148
155 H ALA 16 H ALA 16 5.559 0.582 -2.591
156 HA ALA 16 HA ALA 16 7.991 0.495 -4.080
157 HB1 ALA 16 HB1 ALA 16 6.053 1.730 -4.895
158 HB2 ALA 16 HB2 ALA 16 7.449 2.793 -4.716
159 HB3 ALA 16 HB3 ALA 16 6.157 2.822 -3.513
160 H LEU 17 H LEU 17 6.905 2.312 -1.226
161 HA LEU 17 HA LEU 17 9.394 3.566 -0.737
162 HB2 LEU 17 HB2 LEU 17 7.013 3.008 1.020
163 HB3 LEU 17 HB3 LEU 17 8.458 3.769 1.651
164 HG LEU 17 HG LEU 17 6.870 5.480 1.180
165 HD11 LEU 17 HD11 LEU 17 8.953 5.436 -0.993
166 HD12 LEU 17 HD12 LEU 17 9.176 6.023 0.654
167 HD13 LEU 17 HD13 LEU 17 8.068 6.856 -0.435
168 HD21 LEU 17 HD21 LEU 17 6.698 4.387 -1.623
169 HD22 LEU 17 HD22 LEU 17 5.901 5.844 -1.023
170 HD23 LEU 17 HD23 LEU 17 5.452 4.264 -0.381
171 H ALA 18 H ALA 18 7.995 0.507 0.208
172 HA ALA 18 HA ALA 18 9.904 -0.246 2.135
173 HB1 ALA 18 HB1 ALA 18 8.224 -1.999 0.345
174 HB2 ALA 18 HB2 ALA 18 7.750 -1.359 1.918
175 HB3 ALA 18 HB3 ALA 18 9.074 -2.521 1.801
176 H LEU 19 H LEU 19 9.988 -0.253 -1.340
177 HA LEU 19 HA LEU 19 12.136 -2.060 -1.688
178 HB2 LEU 19 HB2 LEU 19 11.202 0.260 -3.378
179 HB3 LEU 19 HB3 LEU 19 12.476 -0.840 -3.866
180 HG LEU 19 HG LEU 19 9.612 -1.628 -3.320
181 HD11 LEU 19 HD11 LEU 19 9.826 -0.284 -5.346
182 HD12 LEU 19 HD12 LEU 19 9.466 -1.966 -5.735
183 HD13 LEU 19 HD13 LEU 19 11.107 -1.350 -5.926
184 HD21 LEU 19 HD21 LEU 19 10.279 -3.788 -4.276
185 HD22 LEU 19 HD22 LEU 19 11.183 -3.416 -2.808
186 HD23 LEU 19 HD23 LEU 19 11.946 -3.220 -4.385
187 H LYS 20 H LYS 20 12.087 1.510 -1.575
188 HA LYS 20 HA LYS 20 14.954 1.632 -1.571
189 HB2 LYS 20 HB2 LYS 20 14.698 4.035 -1.386
190 HB3 LYS 20 HB3 LYS 20 13.604 3.409 -2.608
191 HG2 LYS 20 HG2 LYS 20 11.747 3.558 -1.025
192 HG3 LYS 20 HG3 LYS 20 12.848 4.189 0.201
193 HD2 LYS 20 HD2 LYS 20 12.201 5.483 -2.450
194 HD3 LYS 20 HD3 LYS 20 11.620 6.003 -0.865
195 HE2 LYS 20 HE2 LYS 20 13.816 6.601 -0.169
196 HE3 LYS 20 HE3 LYS 20 14.540 5.834 -1.582
197 HZ1 LYS 20 HZ1 LYS 20 13.372 7.496 -2.962
198 HZ2 LYS 20 HZ2 LYS 20 14.503 8.182 -1.907
199 HZ3 LYS 20 HZ3 LYS 20 12.849 8.280 -1.551
200 H LEU 21 H LEU 21 12.591 1.162 0.807
201 HA LEU 21 HA LEU 21 13.967 2.216 3.055
202 HB2 LEU 21 HB2 LEU 21 11.518 1.454 2.878
203 HB3 LEU 21 HB3 LEU 21 12.123 -0.176 3.076
204 HG LEU 21 HG LEU 21 11.201 0.933 5.148
205 HD11 LEU 21 HD11 LEU 21 14.061 -0.005 5.259
206 HD12 LEU 21 HD12 LEU 21 12.629 -1.032 5.288
207 HD13 LEU 21 HD13 LEU 21 12.944 0.079 6.621
208 HD21 LEU 21 HD21 LEU 21 12.144 3.157 4.739
209 HD22 LEU 21 HD22 LEU 21 13.763 2.504 4.991
210 HD23 LEU 21 HD23 LEU 21 12.602 2.520 6.318
211 H LYS 22 H LYS 22 13.831 -1.013 1.572
212 HA LYS 22 HA LYS 22 15.783 -2.211 3.250
213 HB2 LYS 22 HB2 LYS 22 15.048 -2.908 0.397
214 HB3 LYS 22 HB3 LYS 22 15.913 -3.946 1.518
215 HG2 LYS 22 HG2 LYS 22 13.961 -4.174 2.898
216 HG3 LYS 22 HG3 LYS 22 13.087 -2.988 1.922
217 HD2 LYS 22 HD2 LYS 22 13.257 -4.462 -0.023
218 HD3 LYS 22 HD3 LYS 22 14.132 -5.645 0.949
219 HE2 LYS 22 HE2 LYS 22 11.768 -6.243 0.693
220 HE3 LYS 22 HE3 LYS 22 12.194 -5.946 2.377
221 HZ1 LYS 22 HZ1 LYS 22 10.036 -4.960 1.485
222 HZ2 LYS 22 HZ2 LYS 22 11.017 -3.815 0.710
223 HZ3 LYS 22 HZ3 LYS 22 11.045 -3.952 2.396
224 H LYS 23 H LYS 23 15.887 -0.206 0.448
225 HA LYS 23 HA LYS 23 18.620 -0.859 -0.254
226 HB2 LYS 23 HB2 LYS 23 16.638 -0.373 -1.836
227 HB3 LYS 23 HB3 LYS 23 16.914 1.316 -1.441
228 HG2 LYS 23 HG2 LYS 23 19.115 1.239 -2.387
229 HG3 LYS 23 HG3 LYS 23 18.988 -0.508 -2.645
230 HD2 LYS 23 HD2 LYS 23 17.039 -0.084 -4.132
231 HD3 LYS 23 HD3 LYS 23 17.330 1.647 -3.949
232 HE2 LYS 23 HE2 LYS 23 19.505 1.432 -4.973
233 HE3 LYS 23 HE3 LYS 23 19.319 -0.323 -5.061
234 HZ1 LYS 23 HZ1 LYS 23 17.553 1.629 -6.435
235 HZ2 LYS 23 HZ2 LYS 23 17.514 -0.059 -6.597
236 HZ3 LYS 23 HZ3 LYS 23 18.844 0.819 -7.176
237 H ALA 24 H ALA 24 17.517 0.798 2.205
238 HA ALA 24 HA ALA 24 19.320 3.098 1.889
239 HB1 ALA 24 HB1 ALA 24 18.070 4.151 3.703
240 HB2 ALA 24 HB2 ALA 24 17.053 2.717 3.844
241 HB3 ALA 24 HB3 ALA 24 17.002 3.695 2.378