Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
627411 | 6chc RC | 30413 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ARG 1 H GLY 1 -4.607 -6.418 3.375
2 HA ARG 1 HA2 GLY 1 -4.701 -3.791 2.031
3 H TYR 2 H TYR 2 -2.622 -3.623 1.263
4 HA TYR 2 HA TYR 2 -0.568 -3.284 3.327
5 HB2 TYR 2 HB2 TYR 2 -0.510 -5.187 1.045
6 HB3 TYR 2 HB3 TYR 2 0.978 -4.313 1.388
7 HD1 TYR 2 HD1 TYR 2 -1.523 -6.633 2.816
8 HD2 TYR 2 HD2 TYR 2 2.329 -4.882 3.254
9 HE1 TYR 2 HE1 TYR 2 -1.005 -8.237 4.606
10 HE2 TYR 2 HE2 TYR 2 2.858 -6.481 5.045
11 HH TYR 2 HH TYR 2 1.461 -9.206 5.553
12 H CYS 3 H CYS 3 1.416 -2.188 2.380
13 HA CYS 3 HA CYS 3 0.562 0.188 1.030
14 HB2 CYS 3 HB2 CYS 3 2.871 -0.690 2.534
15 HB3 CYS 3 HB3 CYS 3 3.370 0.148 1.069
16 H GLN 4 H GLN 4 2.735 0.832 -0.566
17 HA GLN 4 HA GLN 4 2.413 -1.072 -2.790
18 HB2 GLN 4 HB2 GLN 4 3.291 1.691 -3.381
19 HB3 GLN 4 HB3 GLN 4 2.181 0.647 -4.262
20 HG2 GLN 4 HG2 GLN 4 1.510 2.062 -1.693
21 HG3 GLN 4 HG3 GLN 4 1.122 2.668 -3.303
22 HE21 GLN 4 HE21 GLN 4 0.108 0.738 -4.676
23 HE22 GLN 4 HE22 GLN 4 -1.249 -0.007 -3.907
24 H LYS 5 H LYS 5 4.226 -2.297 -2.057
25 HA LYS 5 HA LYS 5 6.471 -2.719 -1.655
26 HB2 LYS 5 HB2 LYS 5 6.161 -1.661 -4.443
27 HB3 LYS 5 HB3 LYS 5 7.755 -2.117 -3.857
28 HG2 LYS 5 HG2 LYS 5 5.682 -4.122 -3.367
29 HG3 LYS 5 HG3 LYS 5 5.994 -3.793 -5.072
30 HD2 LYS 5 HD2 LYS 5 8.237 -4.294 -3.141
31 HD3 LYS 5 HD3 LYS 5 7.375 -5.629 -3.912
32 HE2 LYS 5 HE2 LYS 5 7.978 -3.812 -5.960
33 HE3 LYS 5 HE3 LYS 5 9.434 -3.923 -4.972
34 HZ1 LYS 5 HZ1 LYS 5 8.007 -6.109 -6.366
35 HZ2 LYS 5 HZ2 LYS 5 9.147 -6.408 -5.153
36 HZ3 LYS 5 HZ3 LYS 5 9.610 -5.611 -6.572
37 H TRP 6 H TRP 6 5.987 -0.507 -0.216
38 HA TRP 6 HA TRP 6 7.123 1.892 -0.671
39 HB2 TRP 6 HB2 TRP 6 7.337 2.178 1.637
40 HB3 TRP 6 HB3 TRP 6 6.114 0.915 1.507
41 HD1 TRP 6 HD1 TRP 6 9.036 1.678 3.468
42 HE1 TRP 6 HE1 TRP 6 10.081 -0.433 4.504
43 HE3 TRP 6 HE3 TRP 6 6.685 -1.867 0.630
44 HZ2 TRP 6 HZ2 TRP 6 9.930 -3.232 4.162
45 HZ3 TRP 6 HZ3 TRP 6 7.193 -4.238 1.048
46 HH2 TRP 6 HH2 TRP 6 8.782 -4.903 2.777
47 H NLE 7 H NLE 7 8.738 -1.107 -0.204
48 HA NLE 7 HA NLE 7 11.367 -0.384 0.595
49 HB2 NLE 7 HB2 NLE 7 10.447 -2.691 0.401
50 HB3 NLE 7 HB3 NLE 7 10.618 -2.638 -1.353
51 HG2 NLE 7 HG2 NLE 7 12.935 -2.979 -1.267
52 HG3 NLE 7 HG3 NLE 7 13.164 -1.972 0.157
53 HD2 NLE 7 HD2 NLE 7 13.214 -3.815 1.518
54 HD3 NLE 7 HD3 NLE 7 11.617 -4.337 0.966
55 HE1 NLE 7 HE1 NLE 7 14.194 -4.855 -0.432
56 HE2 NLE 7 HE2 NLE 7 13.294 -5.952 0.446
57 HE3 NLE 7 HE3 NLE 7 12.687 -5.342 -0.981
58 H TRP 8 H TRP 8 9.920 0.553 -2.399
59 HA TRP 8 HA TRP 8 11.965 0.653 -4.226
60 HB2 TRP 8 HB2 TRP 8 9.932 2.836 -3.724
61 HB3 TRP 8 HB3 TRP 8 10.841 2.589 -5.211
62 HD1 TRP 8 HD1 TRP 8 10.374 -0.679 -5.164
63 HE1 TRP 8 HE1 TRP 8 8.077 -1.547 -5.935
64 HE3 TRP 8 HE3 TRP 8 7.643 3.600 -4.553
65 HZ2 TRP 8 HZ2 TRP 8 5.453 -0.550 -6.244
66 HZ3 TRP 8 HZ3 TRP 8 5.246 3.558 -5.109
67 HH2 TRP 8 HH2 TRP 8 4.176 1.527 -5.939
68 H THR 9 H THR 9 13.187 2.645 -4.942
69 HA THR 9 HA THR 9 14.766 3.583 -2.710
70 HB THR 9 HB THR 9 16.018 4.810 -4.615
71 HG1 THR 9 HG1 THR 9 15.624 3.707 -6.668
72 HG21 THR 9 HG21 THR 9 16.311 2.349 -3.479
73 HG22 THR 9 HG22 THR 9 17.447 3.071 -4.621
74 HG23 THR 9 HG23 THR 9 16.219 1.940 -5.192
75 H CYS 10 H CYS 10 12.726 4.736 -1.913
76 HA CYS 10 HA CYS 10 11.448 6.854 -2.941
77 HB2 CYS 10 HB2 CYS 10 11.141 7.709 -0.757
78 HB3 CYS 10 HB3 CYS 10 11.354 5.975 -0.550
79 H ASP 11 H ASP 11 11.776 9.021 -3.337
80 HA ASP 11 HA ASP 11 14.082 10.473 -2.647
81 HB2 ASP 11 HB2 ASP 11 14.311 8.802 -5.017
82 HB3 ASP 11 HB3 ASP 11 14.562 10.505 -5.388
83 H SER 12 H SER 12 11.603 10.029 -5.141
84 HA SER 12 HA SER 12 10.306 12.454 -4.615
85 HB2 SER 12 HB2 SER 12 11.063 13.287 -7.112
86 HB3 SER 12 HB3 SER 12 11.737 13.900 -5.604
87 HG SER 12 HG SER 12 13.358 13.204 -7.073
88 H LYS 13 H LYS 13 11.209 10.673 -7.574
89 HA LYS 13 HA LYS 13 8.593 10.738 -8.657
90 HB2 LYS 13 HB2 LYS 13 11.145 9.969 -9.532
91 HB3 LYS 13 HB3 LYS 13 10.160 8.516 -9.639
92 HG2 LYS 13 HG2 LYS 13 9.707 9.364 -11.681
93 HG3 LYS 13 HG3 LYS 13 8.470 10.236 -10.774
94 HD2 LYS 13 HD2 LYS 13 10.407 11.987 -10.455
95 HD3 LYS 13 HD3 LYS 13 11.049 11.215 -11.907
96 HE2 LYS 13 HE2 LYS 13 9.375 12.004 -13.229
97 HE3 LYS 13 HE3 LYS 13 8.182 11.960 -11.931
98 HZ1 LYS 13 HZ1 LYS 13 8.476 14.193 -12.153
99 HZ2 LYS 13 HZ2 LYS 13 10.094 14.066 -12.629
100 HZ3 LYS 13 HZ3 LYS 13 9.674 13.882 -11.001
101 H ARG 14 H ARG 14 9.958 8.882 -6.190
102 HA ARG 14 HA ARG 14 8.837 6.378 -6.443
103 HB2 ARG 14 HB2 ARG 14 8.771 6.369 -3.918
104 HB3 ARG 14 HB3 ARG 14 10.323 6.785 -4.634
105 HG2 ARG 14 HG2 ARG 14 10.048 8.300 -2.881
106 HG3 ARG 14 HG3 ARG 14 9.627 9.216 -4.329
107 HD2 ARG 14 HD2 ARG 14 7.322 7.860 -3.230
108 HD3 ARG 14 HD3 ARG 14 8.086 8.899 -2.028
109 HE ARG 14 HE ARG 14 7.910 10.429 -4.299
110 HH11 ARG 14 HH11 ARG 14 5.675 8.710 -2.255
111 HH12 ARG 14 HH12 ARG 14 4.359 9.794 -2.562
112 HH21 ARG 14 HH21 ARG 14 6.184 11.861 -4.712
113 HH22 ARG 14 HH22 ARG 14 4.649 11.586 -3.961
114 H ALA 15 H ALA 15 6.988 5.515 -5.052
115 HA ALA 15 HA ALA 15 4.713 7.369 -4.995
116 HB1 ALA 15 HB1 ALA 15 4.156 6.392 -6.983
117 HB2 ALA 15 HB2 ALA 15 4.952 4.869 -6.585
118 HB3 ALA 15 HB3 ALA 15 3.390 5.261 -5.867
119 H CYS 16 H CYS 16 6.431 6.166 -2.926
120 HA CYS 16 HA CYS 16 5.220 4.025 -1.613
121 HB2 CYS 16 HB2 CYS 16 6.817 6.356 -0.546
122 HB3 CYS 16 HB3 CYS 16 6.307 5.002 0.458
123 H CYS 17 H CYS 17 4.483 4.628 0.875
124 HA CYS 17 HA CYS 17 2.071 6.280 0.506
125 HB2 CYS 17 HB2 CYS 17 1.878 4.561 2.795
126 HB3 CYS 17 HB3 CYS 17 0.879 4.587 1.346
127 H GLU 18 H GLU 18 3.693 5.034 3.411
128 HA GLU 18 HA GLU 18 4.102 7.801 4.307
129 HB2 GLU 18 HB2 GLU 18 2.035 6.641 5.307
130 HB3 GLU 18 HB3 GLU 18 3.182 5.640 6.189
131 HG2 GLU 18 HG2 GLU 18 3.391 7.203 7.730
132 HG3 GLU 18 HG3 GLU 18 3.939 8.357 6.515
133 H GLY 19 H GLY 19 6.110 6.362 3.168
134 HA2 GLY 19 HA2 GLY 19 7.944 6.091 5.412
135 HA3 GLY 19 HA3 GLY 19 7.713 4.647 4.438
136 H LEU 20 H LEU 20 7.382 7.463 2.612
137 HA LEU 20 HA LEU 20 9.735 6.893 1.101
138 HB2 LEU 20 HB2 LEU 20 9.057 9.191 0.051
139 HB3 LEU 20 HB3 LEU 20 8.098 7.742 -0.245
140 HG LEU 20 HG LEU 20 6.864 9.930 0.258
141 HD11 LEU 20 HD11 LEU 20 5.509 8.393 2.103
142 HD12 LEU 20 HD12 LEU 20 6.371 7.204 1.127
143 HD13 LEU 20 HD13 LEU 20 5.287 8.361 0.354
144 HD21 LEU 20 HD21 LEU 20 6.741 10.731 2.418
145 HD22 LEU 20 HD22 LEU 20 8.446 10.294 2.293
146 HD23 LEU 20 HD23 LEU 20 7.318 9.221 3.125
147 H ARG 21 H ARG 21 9.295 8.500 3.975
148 HA ARG 21 HA ARG 21 11.111 10.674 3.632
149 HB2 ARG 21 HB2 ARG 21 9.271 9.987 5.538
150 HB3 ARG 21 HB3 ARG 21 10.784 9.625 6.358
151 HG2 ARG 21 HG2 ARG 21 11.338 12.064 5.326
152 HG3 ARG 21 HG3 ARG 21 9.603 12.206 5.620
153 HD2 ARG 21 HD2 ARG 21 11.203 10.989 7.783
154 HD3 ARG 21 HD3 ARG 21 11.476 12.705 7.482
155 HE ARG 21 HE ARG 21 9.144 11.500 8.640
156 HH11 ARG 21 HH11 ARG 21 10.358 14.241 6.869
157 HH12 ARG 21 HH12 ARG 21 9.093 15.303 7.390
158 HH21 ARG 21 HH21 ARG 21 7.472 12.889 9.332
159 HH22 ARG 21 HH22 ARG 21 7.453 14.533 8.793
160 H CYS 22 H CYS 22 12.797 9.349 2.555
161 HA CYS 22 HA CYS 22 14.898 8.757 4.397
162 HB2 CYS 22 HB2 CYS 22 15.214 6.431 3.936
163 HB3 CYS 22 HB3 CYS 22 13.536 6.641 4.431
164 H LYS 23 H LYS 23 16.439 7.125 2.659
165 HA LYS 23 HA LYS 23 17.062 9.104 0.588
166 HB2 LYS 23 HB2 LYS 23 18.732 8.097 2.384
167 HB3 LYS 23 HB3 LYS 23 18.866 6.805 1.199
168 HG2 LYS 23 HG2 LYS 23 20.423 8.033 0.208
169 HG3 LYS 23 HG3 LYS 23 19.126 9.115 -0.302
170 HD2 LYS 23 HD2 LYS 23 20.195 9.493 2.434
171 HD3 LYS 23 HD3 LYS 23 21.247 9.952 1.093
172 HE2 LYS 23 HE2 LYS 23 20.124 11.916 1.376
173 HE3 LYS 23 HE3 LYS 23 19.033 11.124 0.239
174 HZ1 LYS 23 HZ1 LYS 23 17.572 11.788 1.838
175 HZ2 LYS 23 HZ2 LYS 23 18.684 11.629 3.105
176 HZ3 LYS 23 HZ3 LYS 23 17.958 10.253 2.440
177 H LEU 24 H LEU 24 16.513 5.641 1.046
178 HA LEU 24 HA LEU 24 15.841 5.442 -1.799
179 HB2 LEU 24 HB2 LEU 24 17.925 3.941 -0.326
180 HB3 LEU 24 HB3 LEU 24 16.931 3.026 -1.459
181 HG LEU 24 HG LEU 24 17.605 4.657 -3.235
182 HD11 LEU 24 HD11 LEU 24 19.997 5.633 -2.258
183 HD12 LEU 24 HD12 LEU 24 18.856 5.914 -0.942
184 HD13 LEU 24 HD13 LEU 24 18.526 6.561 -2.549
185 HD21 LEU 24 HD21 LEU 24 19.597 3.536 -3.722
186 HD22 LEU 24 HD22 LEU 24 18.701 2.398 -2.715
187 HD23 LEU 24 HD23 LEU 24 20.015 3.347 -2.017
188 H TRP 25 H TRP 25 16.181 2.669 0.271
189 HA TRP 25 HA TRP 25 13.581 1.744 -0.174
190 HB2 TRP 25 HB2 TRP 25 14.590 -0.077 0.650
191 HB3 TRP 25 HB3 TRP 25 15.900 0.898 1.308
192 HD1 TRP 25 HD1 TRP 25 12.359 -0.310 2.312
193 HE1 TRP 25 HE1 TRP 25 12.286 -0.514 4.875
194 HE3 TRP 25 HE3 TRP 25 17.006 1.522 3.403
195 HZ2 TRP 25 HZ2 TRP 25 13.975 0.031 7.071
196 HZ3 TRP 25 HZ3 TRP 25 17.700 1.647 5.761
197 HH2 TRP 25 HH2 TRP 25 16.214 0.917 7.556
198 H CYS 26 H CYS 26 11.797 2.790 0.420
199 HA CYS 26 HA CYS 26 11.396 4.752 2.221
200 HB2 CYS 26 HB2 CYS 26 9.559 2.465 1.514
201 HB3 CYS 26 HB3 CYS 26 9.041 3.823 2.511
202 H ARG 27 H ARG 27 11.540 5.023 4.348
203 HA ARG 27 HA ARG 27 12.154 2.750 6.032
204 HB2 ARG 27 HB2 ARG 27 12.069 5.723 6.535
205 HB3 ARG 27 HB3 ARG 27 12.400 4.549 7.803
206 HG2 ARG 27 HG2 ARG 27 14.049 4.277 5.387
207 HG3 ARG 27 HG3 ARG 27 14.292 5.762 6.308
208 HD2 ARG 27 HD2 ARG 27 14.286 3.046 7.595
209 HD3 ARG 27 HD3 ARG 27 15.746 3.769 6.926
210 HE ARG 27 HE ARG 27 14.419 4.486 9.370
211 HH11 ARG 27 HH11 ARG 27 16.536 5.584 6.833
212 HH12 ARG 27 HH12 ARG 27 17.285 6.805 7.807
213 HH21 ARG 27 HH21 ARG 27 15.398 6.091 10.663
214 HH22 ARG 27 HH22 ARG 27 16.639 7.092 9.987
215 H LYS 28 H LYS 28 9.663 2.329 5.199
216 HA LYS 28 HA LYS 28 7.766 3.417 7.114
217 HB2 LYS 28 HB2 LYS 28 7.458 2.742 4.533
218 HB3 LYS 28 HB3 LYS 28 6.986 1.218 5.274
219 HG2 LYS 28 HG2 LYS 28 5.466 2.742 6.752
220 HG3 LYS 28 HG3 LYS 28 5.673 3.887 5.425
221 HD2 LYS 28 HD2 LYS 28 4.322 2.725 4.068
222 HD3 LYS 28 HD3 LYS 28 5.045 1.181 4.528
223 HE2 LYS 28 HE2 LYS 28 2.994 0.847 5.430
224 HE3 LYS 28 HE3 LYS 28 3.714 1.718 6.784
225 HZ1 LYS 28 HZ1 LYS 28 1.488 2.437 5.234
226 HZ2 LYS 28 HZ2 LYS 28 2.689 3.607 5.005
227 HZ3 LYS 28 HZ3 LYS 28 2.146 3.246 6.565
228 H ILE 29 H ILE 29 6.281 0.752 6.837
229 HA ILE 29 HA ILE 29 6.835 -0.277 9.359
230 HB ILE 29 HB ILE 29 5.413 -2.099 8.847
231 HG12 ILE 29 HG12 ILE 29 6.575 -2.818 6.783
232 HG13 ILE 29 HG13 ILE 29 4.827 -2.778 6.584
233 HG21 ILE 29 HG21 ILE 29 3.882 -0.568 7.038
234 HG22 ILE 29 HG22 ILE 29 3.706 -0.686 8.788
235 HG23 ILE 29 HG23 ILE 29 4.733 0.564 8.088
236 HD11 ILE 29 HD11 ILE 29 5.134 -0.497 5.548
237 HD12 ILE 29 HD12 ILE 29 6.863 -0.856 5.513
238 HD13 ILE 29 HD13 ILE 29 5.731 -1.871 4.618
239 H ILE 30 H ILE 30 8.519 -0.715 6.415
240 HA ILE 30 HA ILE 30 10.430 -1.844 5.900
241 HB ILE 30 HB ILE 30 10.553 -2.751 8.771
242 HG12 ILE 30 HG12 ILE 30 10.338 -0.410 8.974
243 HG13 ILE 30 HG13 ILE 30 12.075 -0.697 9.012
244 HG21 ILE 30 HG21 ILE 30 12.456 -3.699 8.146
245 HG22 ILE 30 HG22 ILE 30 12.215 -3.129 6.497
246 HG23 ILE 30 HG23 ILE 30 13.078 -2.122 7.659
247 HD11 ILE 30 HD11 ILE 30 11.664 1.194 7.633
248 HD12 ILE 30 HD12 ILE 30 12.137 -0.143 6.582
249 HD13 ILE 30 HD13 ILE 30 10.441 0.324 6.705
Start of MODEL 2
1 H1 ARG 1 H GLY 1 3.271 -4.509 4.674
2 HA ARG 1 HA2 GLY 1 0.872 -4.920 6.137
3 H TYR 2 H TYR 2 -0.531 -2.610 5.259
4 HA TYR 2 HA TYR 2 -0.939 -3.371 2.503
5 HB2 TYR 2 HB2 TYR 2 -2.349 -1.489 4.383
6 HB3 TYR 2 HB3 TYR 2 -2.758 -1.560 2.672
7 HD1 TYR 2 HD1 TYR 2 -2.725 -3.468 5.831
8 HD2 TYR 2 HD2 TYR 2 -4.030 -3.377 1.782
9 HE1 TYR 2 HE1 TYR 2 -4.219 -5.370 6.275
10 HE2 TYR 2 HE2 TYR 2 -5.526 -5.278 2.215
11 HH TYR 2 HH TYR 2 -6.093 -6.476 5.429
12 H CYS 3 H CYS 3 0.897 -2.659 1.418
13 HA CYS 3 HA CYS 3 0.892 0.184 0.793
14 HB2 CYS 3 HB2 CYS 3 3.104 -1.223 2.208
15 HB3 CYS 3 HB3 CYS 3 3.545 -0.061 0.961
16 H GLN 4 H GLN 4 3.063 0.386 -0.789
17 HA GLN 4 HA GLN 4 2.692 -1.736 -2.798
18 HB2 GLN 4 HB2 GLN 4 3.480 0.957 -3.739
19 HB3 GLN 4 HB3 GLN 4 2.407 -0.227 -4.476
20 HG2 GLN 4 HG2 GLN 4 1.678 1.464 -2.096
21 HG3 GLN 4 HG3 GLN 4 1.290 1.872 -3.767
22 HE21 GLN 4 HE21 GLN 4 0.312 -0.182 -4.934
23 HE22 GLN 4 HE22 GLN 4 -1.018 -0.893 -4.091
24 H LYS 5 H LYS 5 4.541 -2.822 -1.983
25 HA LYS 5 HA LYS 5 6.791 -3.161 -1.574
26 HB2 LYS 5 HB2 LYS 5 6.489 -2.277 -4.424
27 HB3 LYS 5 HB3 LYS 5 8.077 -2.690 -3.793
28 HG2 LYS 5 HG2 LYS 5 6.931 -4.881 -3.028
29 HG3 LYS 5 HG3 LYS 5 5.697 -4.443 -4.211
30 HD2 LYS 5 HD2 LYS 5 7.133 -5.752 -5.467
31 HD3 LYS 5 HD3 LYS 5 7.718 -4.123 -5.814
32 HE2 LYS 5 HE2 LYS 5 9.593 -4.379 -4.460
33 HE3 LYS 5 HE3 LYS 5 8.879 -5.713 -3.556
34 HZ1 LYS 5 HZ1 LYS 5 8.999 -6.558 -6.177
35 HZ2 LYS 5 HZ2 LYS 5 9.976 -7.070 -4.895
36 HZ3 LYS 5 HZ3 LYS 5 10.484 -5.799 -5.888
37 H TRP 6 H TRP 6 6.186 -0.831 -0.326
38 HA TRP 6 HA TRP 6 7.300 1.541 -0.943
39 HB2 TRP 6 HB2 TRP 6 7.424 2.026 1.341
40 HB3 TRP 6 HB3 TRP 6 6.230 0.733 1.275
41 HD1 TRP 6 HD1 TRP 6 9.076 1.718 3.254
42 HE1 TRP 6 HE1 TRP 6 10.115 -0.278 4.505
43 HE3 TRP 6 HE3 TRP 6 6.864 -2.101 0.670
44 HZ2 TRP 6 HZ2 TRP 6 10.010 -3.098 4.408
45 HZ3 TRP 6 HZ3 TRP 6 7.389 -4.418 1.312
46 HH2 TRP 6 HH2 TRP 6 8.930 -4.904 3.142
47 H NLE 7 H NLE 7 8.946 -1.375 -0.172
48 HA NLE 7 HA NLE 7 11.527 -0.555 0.665
49 HB2 NLE 7 HB2 NLE 7 10.643 -2.889 0.575
50 HB3 NLE 7 HB3 NLE 7 10.907 -2.943 -1.166
51 HG2 NLE 7 HG2 NLE 7 13.215 -3.254 -0.937
52 HG3 NLE 7 HG3 NLE 7 13.364 -2.127 0.406
53 HD2 NLE 7 HD2 NLE 7 13.389 -3.853 1.913
54 HD3 NLE 7 HD3 NLE 7 11.816 -4.433 1.354
55 HE1 NLE 7 HE1 NLE 7 14.442 -5.048 0.091
56 HE2 NLE 7 HE2 NLE 7 13.516 -6.072 1.030
57 HE3 NLE 7 HE3 NLE 7 12.956 -5.589 -0.463
58 H TRP 8 H TRP 8 10.186 0.138 -2.449
59 HA TRP 8 HA TRP 8 12.296 0.168 -4.196
60 HB2 TRP 8 HB2 TRP 8 10.239 2.367 -3.914
61 HB3 TRP 8 HB3 TRP 8 11.182 1.998 -5.355
62 HD1 TRP 8 HD1 TRP 8 10.723 -1.233 -5.143
63 HE1 TRP 8 HE1 TRP 8 8.434 -2.167 -5.858
64 HE3 TRP 8 HE3 TRP 8 7.943 3.035 -4.727
65 HZ2 TRP 8 HZ2 TRP 8 5.796 -1.218 -6.201
66 HZ3 TRP 8 HZ3 TRP 8 5.544 2.938 -5.268
67 HH2 TRP 8 HH2 TRP 8 4.495 0.855 -5.989
68 H THR 9 H THR 9 13.540 2.105 -4.985
69 HA THR 9 HA THR 9 14.999 3.223 -2.753
70 HB THR 9 HB THR 9 16.321 4.321 -4.716
71 HG1 THR 9 HG1 THR 9 14.768 3.841 -6.337
72 HG21 THR 9 HG21 THR 9 17.797 2.595 -4.572
73 HG22 THR 9 HG22 THR 9 16.560 1.371 -4.849
74 HG23 THR 9 HG23 THR 9 16.723 2.113 -3.260
75 H CYS 10 H CYS 10 12.862 4.401 -2.207
76 HA CYS 10 HA CYS 10 11.701 6.450 -3.508
77 HB2 CYS 10 HB2 CYS 10 11.118 7.399 -1.428
78 HB3 CYS 10 HB3 CYS 10 11.337 5.684 -1.094
79 H ASP 11 H ASP 11 12.065 8.625 -3.910
80 HA ASP 11 HA ASP 11 14.771 9.639 -3.386
81 HB2 ASP 11 HB2 ASP 11 13.513 9.126 -5.986
82 HB3 ASP 11 HB3 ASP 11 14.167 10.753 -5.825
83 H SER 12 H SER 12 12.039 10.957 -5.226
84 HA SER 12 HA SER 12 12.102 13.318 -3.490
85 HB2 SER 12 HB2 SER 12 10.753 14.384 -5.305
86 HB3 SER 12 HB3 SER 12 12.327 13.806 -5.851
87 HG SER 12 HG SER 12 11.372 12.430 -7.124
88 H LYS 13 H LYS 13 10.106 10.643 -4.424
89 HA LYS 13 HA LYS 13 8.364 10.919 -2.245
90 HB2 LYS 13 HB2 LYS 13 6.271 11.489 -3.463
91 HB3 LYS 13 HB3 LYS 13 7.421 12.816 -3.393
92 HG2 LYS 13 HG2 LYS 13 8.158 12.211 -5.693
93 HG3 LYS 13 HG3 LYS 13 6.847 11.028 -5.745
94 HD2 LYS 13 HD2 LYS 13 5.210 12.795 -5.427
95 HD3 LYS 13 HD3 LYS 13 6.498 13.992 -5.288
96 HE2 LYS 13 HE2 LYS 13 7.026 12.686 -7.679
97 HE3 LYS 13 HE3 LYS 13 5.270 12.853 -7.653
98 HZ1 LYS 13 HZ1 LYS 13 6.016 15.284 -6.870
99 HZ2 LYS 13 HZ2 LYS 13 5.745 14.871 -8.487
100 HZ3 LYS 13 HZ3 LYS 13 7.322 14.895 -7.872
101 H ARG 14 H ARG 14 8.810 9.732 -5.528
102 HA ARG 14 HA ARG 14 8.318 7.745 -6.529
103 HB2 ARG 14 HB2 ARG 14 9.442 7.198 -3.937
104 HB3 ARG 14 HB3 ARG 14 8.286 5.942 -4.360
105 HG2 ARG 14 HG2 ARG 14 10.622 6.818 -6.043
106 HG3 ARG 14 HG3 ARG 14 10.544 5.357 -5.058
107 HD2 ARG 14 HD2 ARG 14 8.606 4.608 -6.407
108 HD3 ARG 14 HD3 ARG 14 8.809 6.029 -7.433
109 HE ARG 14 HE ARG 14 11.186 4.435 -7.216
110 HH11 ARG 14 HH11 ARG 14 8.162 4.833 -8.895
111 HH12 ARG 14 HH12 ARG 14 8.694 4.007 -10.321
112 HH21 ARG 14 HH21 ARG 14 11.899 3.346 -9.088
113 HH22 ARG 14 HH22 ARG 14 10.820 3.161 -10.430
114 H ALA 15 H ALA 15 6.943 5.526 -5.929
115 HA ALA 15 HA ALA 15 4.224 6.549 -5.587
116 HB1 ALA 15 HB1 ALA 15 5.430 4.225 -6.980
117 HB2 ALA 15 HB2 ALA 15 3.788 4.046 -6.360
118 HB3 ALA 15 HB3 ALA 15 4.162 5.333 -7.507
119 H CYS 16 H CYS 16 6.339 5.727 -3.456
120 HA CYS 16 HA CYS 16 5.396 3.482 -2.071
121 HB2 CYS 16 HB2 CYS 16 6.885 5.945 -1.176
122 HB3 CYS 16 HB3 CYS 16 6.464 4.656 -0.054
123 H CYS 17 H CYS 17 4.786 4.160 0.478
124 HA CYS 17 HA CYS 17 2.145 5.416 0.174
125 HB2 CYS 17 HB2 CYS 17 2.031 4.179 2.593
126 HB3 CYS 17 HB3 CYS 17 1.537 3.433 1.078
127 H GLU 18 H GLU 18 4.024 4.865 3.115
128 HA GLU 18 HA GLU 18 4.201 7.768 3.517
129 HB2 GLU 18 HB2 GLU 18 2.365 6.220 4.841
130 HB3 GLU 18 HB3 GLU 18 3.716 6.226 5.966
131 HG2 GLU 18 HG2 GLU 18 3.649 8.821 5.453
132 HG3 GLU 18 HG3 GLU 18 1.967 8.447 5.087
133 H GLY 19 H GLY 19 6.248 6.057 2.614
134 HA2 GLY 19 HA2 GLY 19 8.125 6.340 4.858
135 HA3 GLY 19 HA3 GLY 19 8.036 4.801 4.013
136 H LEU 20 H LEU 20 7.428 7.277 1.864
137 HA LEU 20 HA LEU 20 9.854 6.846 0.452
138 HB2 LEU 20 HB2 LEU 20 8.964 8.916 -0.855
139 HB3 LEU 20 HB3 LEU 20 8.130 7.366 -0.962
140 HG LEU 20 HG LEU 20 6.731 9.511 -0.701
141 HD11 LEU 20 HD11 LEU 20 5.452 8.079 1.257
142 HD12 LEU 20 HD12 LEU 20 6.438 6.856 0.458
143 HD13 LEU 20 HD13 LEU 20 5.296 7.819 -0.481
144 HD21 LEU 20 HD21 LEU 20 6.492 10.468 1.400
145 HD22 LEU 20 HD22 LEU 20 8.235 10.230 1.270
146 HD23 LEU 20 HD23 LEU 20 7.259 9.108 2.219
147 H ARG 21 H ARG 21 9.218 8.684 3.141
148 HA ARG 21 HA ARG 21 10.856 10.963 2.549
149 HB2 ARG 21 HB2 ARG 21 10.595 11.502 4.928
150 HB3 ARG 21 HB3 ARG 21 9.047 11.122 4.181
151 HG2 ARG 21 HG2 ARG 21 8.699 9.369 5.521
152 HG3 ARG 21 HG3 ARG 21 10.366 8.809 5.375
153 HD2 ARG 21 HD2 ARG 21 10.774 10.990 6.869
154 HD3 ARG 21 HD3 ARG 21 9.128 10.608 7.373
155 HE ARG 21 HE ARG 21 11.509 9.178 8.048
156 HH11 ARG 21 HH11 ARG 21 8.082 8.866 7.523
157 HH12 ARG 21 HH12 ARG 21 7.921 7.469 8.534
158 HH21 ARG 21 HH21 ARG 21 11.311 7.338 9.383
159 HH22 ARG 21 HH22 ARG 21 9.760 6.600 9.592
160 H CYS 22 H CYS 22 12.411 8.959 1.808
161 HA CYS 22 HA CYS 22 14.526 8.973 3.831
162 HB2 CYS 22 HB2 CYS 22 14.968 6.630 3.640
163 HB3 CYS 22 HB3 CYS 22 13.249 6.806 3.977
164 H LYS 23 H LYS 23 16.272 7.270 2.396
165 HA LYS 23 HA LYS 23 16.978 9.062 0.191
166 HB2 LYS 23 HB2 LYS 23 18.540 8.281 2.182
167 HB3 LYS 23 HB3 LYS 23 18.789 6.886 1.139
168 HG2 LYS 23 HG2 LYS 23 20.379 8.058 0.135
169 HG3 LYS 23 HG3 LYS 23 19.099 9.060 -0.551
170 HD2 LYS 23 HD2 LYS 23 19.982 9.699 2.205
171 HD3 LYS 23 HD3 LYS 23 21.108 10.065 0.895
172 HE2 LYS 23 HE2 LYS 23 19.796 11.706 0.044
173 HE3 LYS 23 HE3 LYS 23 18.299 10.882 0.479
174 HZ1 LYS 23 HZ1 LYS 23 19.701 11.675 2.807
175 HZ2 LYS 23 HZ2 LYS 23 18.145 12.104 2.304
176 HZ3 LYS 23 HZ3 LYS 23 19.479 13.009 1.789
177 H LEU 24 H LEU 24 16.396 5.660 0.916
178 HA LEU 24 HA LEU 24 15.962 5.185 -1.937
179 HB2 LEU 24 HB2 LEU 24 18.007 3.908 -0.223
180 HB3 LEU 24 HB3 LEU 24 17.102 2.843 -1.296
181 HG LEU 24 HG LEU 24 17.800 4.384 -3.188
182 HD11 LEU 24 HD11 LEU 24 18.971 5.775 -0.949
183 HD12 LEU 24 HD12 LEU 24 18.782 6.293 -2.624
184 HD13 LEU 24 HD13 LEU 24 20.192 5.350 -2.148
185 HD21 LEU 24 HD21 LEU 24 20.105 3.053 -1.786
186 HD22 LEU 24 HD22 LEU 24 19.833 3.234 -3.518
187 HD23 LEU 24 HD23 LEU 24 18.817 2.143 -2.576
188 H TRP 25 H TRP 25 16.253 2.628 0.409
189 HA TRP 25 HA TRP 25 13.705 1.582 -0.120
190 HB2 TRP 25 HB2 TRP 25 14.726 -0.139 0.884
191 HB3 TRP 25 HB3 TRP 25 15.960 0.923 1.551
192 HD1 TRP 25 HD1 TRP 25 12.385 -0.298 2.416
193 HE1 TRP 25 HE1 TRP 25 12.162 -0.342 4.980
194 HE3 TRP 25 HE3 TRP 25 16.934 1.677 3.661
195 HZ2 TRP 25 HZ2 TRP 25 13.710 0.368 7.232
196 HZ3 TRP 25 HZ3 TRP 25 17.484 1.961 6.041
197 HH2 TRP 25 HH2 TRP 25 15.904 1.321 7.789
198 H CYS 26 H CYS 26 11.884 2.669 0.279
199 HA CYS 26 HA CYS 26 11.330 4.730 1.901
200 HB2 CYS 26 HB2 CYS 26 9.613 2.340 1.256
201 HB3 CYS 26 HB3 CYS 26 8.991 3.703 2.182
202 H ARG 27 H ARG 27 11.253 5.185 4.009
203 HA ARG 27 HA ARG 27 11.928 3.104 5.907
204 HB2 ARG 27 HB2 ARG 27 11.721 6.095 6.022
205 HB3 ARG 27 HB3 ARG 27 11.767 5.160 7.510
206 HG2 ARG 27 HG2 ARG 27 13.927 4.373 7.089
207 HG3 ARG 27 HG3 ARG 27 13.848 4.818 5.383
208 HD2 ARG 27 HD2 ARG 27 14.719 6.809 5.836
209 HD3 ARG 27 HD3 ARG 27 13.408 7.149 6.966
210 HE ARG 27 HE ARG 27 15.070 5.577 8.407
211 HH11 ARG 27 HH11 ARG 27 15.547 8.473 6.534
212 HH12 ARG 27 HH12 ARG 27 16.858 9.046 7.512
213 HH21 ARG 27 HH21 ARG 27 16.796 6.322 9.702
214 HH22 ARG 27 HH22 ARG 27 17.567 7.820 9.311
215 H LYS 28 H LYS 28 9.314 2.986 4.647
216 HA LYS 28 HA LYS 28 7.294 3.901 6.401
217 HB2 LYS 28 HB2 LYS 28 7.330 2.772 3.910
218 HB3 LYS 28 HB3 LYS 28 6.702 1.448 4.885
219 HG2 LYS 28 HG2 LYS 28 5.480 4.041 4.186
220 HG3 LYS 28 HG3 LYS 28 4.740 2.452 4.400
221 HD2 LYS 28 HD2 LYS 28 5.336 2.816 6.910
222 HD3 LYS 28 HD3 LYS 28 5.426 4.519 6.452
223 HE2 LYS 28 HE2 LYS 28 3.116 4.184 5.420
224 HE3 LYS 28 HE3 LYS 28 3.066 2.663 6.309
225 HZ1 LYS 28 HZ1 LYS 28 2.434 3.777 8.096
226 HZ2 LYS 28 HZ2 LYS 28 2.506 5.240 7.249
227 HZ3 LYS 28 HZ3 LYS 28 3.869 4.675 8.075
228 H ILE 29 H ILE 29 5.988 1.138 6.366
229 HA ILE 29 HA ILE 29 6.413 0.469 9.039
230 HB ILE 29 HB ILE 29 5.094 -1.464 8.680
231 HG12 ILE 29 HG12 ILE 29 6.399 -2.387 6.798
232 HG13 ILE 29 HG13 ILE 29 4.666 -2.436 6.485
233 HG21 ILE 29 HG21 ILE 29 4.359 1.055 7.590
234 HG22 ILE 29 HG22 ILE 29 3.641 -0.213 6.595
235 HG23 ILE 29 HG23 ILE 29 3.327 -0.170 8.329
236 HD11 ILE 29 HD11 ILE 29 4.990 -0.278 5.203
237 HD12 ILE 29 HD12 ILE 29 6.720 -0.599 5.306
238 HD13 ILE 29 HD13 ILE 29 5.658 -1.741 4.481
239 H ILE 30 H ILE 30 8.299 -0.241 6.278
240 HA ILE 30 HA ILE 30 10.270 -1.348 6.012
241 HB ILE 30 HB ILE 30 10.266 -1.874 8.980
242 HG12 ILE 30 HG12 ILE 30 9.936 0.460 8.867
243 HG13 ILE 30 HG13 ILE 30 11.677 0.267 9.036
244 HG21 ILE 30 HG21 ILE 30 12.168 -2.209 6.794
245 HG22 ILE 30 HG22 ILE 30 12.830 -1.342 8.178
246 HG23 ILE 30 HG23 ILE 30 12.138 -2.948 8.393
247 HD11 ILE 30 HD11 ILE 30 10.147 0.902 6.530
248 HD12 ILE 30 HD12 ILE 30 11.265 1.948 7.407
249 HD13 ILE 30 HD13 ILE 30 11.867 0.517 6.568
Start of MODEL 3
1 H1 ARG 1 H GLY 1 -0.058 -8.007 0.108
2 HA ARG 1 HA2 GLY 1 0.046 -7.497 2.423
3 H TYR 2 H TYR 2 0.917 -5.092 3.488
4 HA TYR 2 HA TYR 2 -0.994 -3.293 2.318
5 HB2 TYR 2 HB2 TYR 2 0.949 -2.770 4.575
6 HB3 TYR 2 HB3 TYR 2 -0.496 -1.840 4.192
7 HD1 TYR 2 HD1 TYR 2 0.796 -4.905 5.708
8 HD2 TYR 2 HD2 TYR 2 -2.712 -2.711 4.721
9 HE1 TYR 2 HE1 TYR 2 -0.516 -6.338 7.214
10 HE2 TYR 2 HE2 TYR 2 -4.034 -4.135 6.227
11 HH TYR 2 HH TYR 2 -2.702 -7.000 7.686
12 H CYS 3 H CYS 3 -0.340 -0.919 2.076
13 HA CYS 3 HA CYS 3 0.720 0.623 0.778
14 HB2 CYS 3 HB2 CYS 3 2.940 -0.763 2.223
15 HB3 CYS 3 HB3 CYS 3 3.342 0.408 0.971
16 H GLN 4 H GLN 4 2.917 0.670 -0.798
17 HA GLN 4 HA GLN 4 2.496 -1.559 -2.677
18 HB2 GLN 4 HB2 GLN 4 3.337 1.082 -3.742
19 HB3 GLN 4 HB3 GLN 4 2.301 -0.145 -4.460
20 HG2 GLN 4 HG2 GLN 4 1.473 1.650 -2.192
21 HG3 GLN 4 HG3 GLN 4 1.145 1.978 -3.893
22 HE21 GLN 4 HE21 GLN 4 0.337 -0.297 -4.935
23 HE22 GLN 4 HE22 GLN 4 -1.064 -0.914 -4.134
24 H LYS 5 H LYS 5 4.306 -2.669 -1.869
25 HA LYS 5 HA LYS 5 6.544 -3.053 -1.428
26 HB2 LYS 5 HB2 LYS 5 6.275 -2.240 -4.300
27 HB3 LYS 5 HB3 LYS 5 7.858 -2.651 -3.654
28 HG2 LYS 5 HG2 LYS 5 7.391 -4.765 -4.115
29 HG3 LYS 5 HG3 LYS 5 6.208 -4.716 -2.807
30 HD2 LYS 5 HD2 LYS 5 4.968 -5.475 -4.629
31 HD3 LYS 5 HD3 LYS 5 4.609 -3.746 -4.581
32 HE2 LYS 5 HE2 LYS 5 6.680 -3.617 -6.203
33 HE3 LYS 5 HE3 LYS 5 6.257 -5.299 -6.517
34 HZ1 LYS 5 HZ1 LYS 5 4.777 -4.512 -7.949
35 HZ2 LYS 5 HZ2 LYS 5 4.976 -2.920 -7.419
36 HZ3 LYS 5 HZ3 LYS 5 3.881 -3.942 -6.634
37 H TRP 6 H TRP 6 6.004 -0.692 -0.228
38 HA TRP 6 HA TRP 6 7.175 1.642 -0.887
39 HB2 TRP 6 HB2 TRP 6 7.304 2.165 1.384
40 HB3 TRP 6 HB3 TRP 6 6.083 0.898 1.345
41 HD1 TRP 6 HD1 TRP 6 8.934 1.863 3.318
42 HE1 TRP 6 HE1 TRP 6 9.938 -0.130 4.602
43 HE3 TRP 6 HE3 TRP 6 6.681 -1.961 0.780
44 HZ2 TRP 6 HZ2 TRP 6 9.794 -2.948 4.546
45 HZ3 TRP 6 HZ3 TRP 6 7.167 -4.276 1.457
46 HH2 TRP 6 HH2 TRP 6 8.693 -4.757 3.303
47 H NLE 7 H NLE 7 8.750 -1.299 -0.064
48 HA NLE 7 HA NLE 7 11.348 -0.532 0.766
49 HB2 NLE 7 HB2 NLE 7 10.400 -2.848 0.694
50 HB3 NLE 7 HB3 NLE 7 10.683 -2.924 -1.045
51 HG2 NLE 7 HG2 NLE 7 12.974 -3.296 -0.784
52 HG3 NLE 7 HG3 NLE 7 13.143 -2.148 0.538
53 HD2 NLE 7 HD2 NLE 7 13.117 -3.846 2.076
54 HD3 NLE 7 HD3 NLE 7 11.530 -4.391 1.520
55 HE1 NLE 7 HE1 NLE 7 14.141 -5.106 0.283
56 HE2 NLE 7 HE2 NLE 7 13.186 -6.083 1.237
57 HE3 NLE 7 HE3 NLE 7 12.644 -5.616 -0.269
58 H TRP 8 H TRP 8 10.033 0.133 -2.372
59 HA TRP 8 HA TRP 8 12.157 0.103 -4.101
60 HB2 TRP 8 HB2 TRP 8 10.127 2.336 -3.877
61 HB3 TRP 8 HB3 TRP 8 11.077 1.921 -5.304
62 HD1 TRP 8 HD1 TRP 8 10.565 -1.299 -5.017
63 HE1 TRP 8 HE1 TRP 8 8.266 -2.213 -5.732
64 HE3 TRP 8 HE3 TRP 8 7.851 3.025 -4.738
65 HZ2 TRP 8 HZ2 TRP 8 5.651 -1.229 -6.126
66 HZ3 TRP 8 HZ3 TRP 8 5.458 2.952 -5.300
67 HH2 TRP 8 HH2 TRP 8 4.382 0.870 -5.981
68 H THR 9 H THR 9 13.442 2.000 -4.911
69 HA THR 9 HA THR 9 14.895 3.142 -2.689
70 HB THR 9 HB THR 9 16.264 4.180 -4.632
71 HG1 THR 9 HG1 THR 9 15.807 3.490 -6.615
72 HG21 THR 9 HG21 THR 9 17.684 2.447 -4.384
73 HG22 THR 9 HG22 THR 9 16.480 1.259 -4.885
74 HG23 THR 9 HG23 THR 9 16.491 1.860 -3.227
75 H CYS 10 H CYS 10 12.799 4.367 -2.150
76 HA CYS 10 HA CYS 10 11.653 6.402 -3.488
77 HB2 CYS 10 HB2 CYS 10 11.100 7.405 -1.424
78 HB3 CYS 10 HB3 CYS 10 11.287 5.693 -1.061
79 H ASP 11 H ASP 11 12.048 8.553 -3.959
80 HA ASP 11 HA ASP 11 14.794 9.510 -3.516
81 HB2 ASP 11 HB2 ASP 11 13.195 9.554 -6.074
82 HB3 ASP 11 HB3 ASP 11 14.580 10.609 -5.810
83 H SER 12 H SER 12 11.992 10.929 -5.168
84 HA SER 12 HA SER 12 12.164 13.205 -3.312
85 HB2 SER 12 HB2 SER 12 10.500 13.665 -5.644
86 HB3 SER 12 HB3 SER 12 11.913 14.559 -5.085
87 HG SER 12 HG SER 12 11.842 13.175 -7.209
88 H LYS 13 H LYS 13 10.166 10.626 -4.367
89 HA LYS 13 HA LYS 13 8.302 10.930 -2.307
90 HB2 LYS 13 HB2 LYS 13 7.754 12.523 -4.657
91 HB3 LYS 13 HB3 LYS 13 6.480 11.338 -4.399
92 HG2 LYS 13 HG2 LYS 13 6.582 12.212 -1.935
93 HG3 LYS 13 HG3 LYS 13 7.321 13.627 -2.688
94 HD2 LYS 13 HD2 LYS 13 5.309 13.540 -4.301
95 HD3 LYS 13 HD3 LYS 13 4.572 12.493 -3.085
96 HE2 LYS 13 HE2 LYS 13 5.717 15.198 -2.435
97 HE3 LYS 13 HE3 LYS 13 4.041 14.969 -2.928
98 HZ1 LYS 13 HZ1 LYS 13 4.841 13.186 -0.831
99 HZ2 LYS 13 HZ2 LYS 13 3.496 14.208 -0.923
100 HZ3 LYS 13 HZ3 LYS 13 4.983 14.813 -0.384
101 H ARG 14 H ARG 14 8.850 9.787 -5.599
102 HA ARG 14 HA ARG 14 8.333 7.832 -6.654
103 HB2 ARG 14 HB2 ARG 14 9.515 7.240 -4.129
104 HB3 ARG 14 HB3 ARG 14 8.282 6.029 -4.449
105 HG2 ARG 14 HG2 ARG 14 9.495 6.064 -6.838
106 HG3 ARG 14 HG3 ARG 14 10.849 6.527 -5.807
107 HD2 ARG 14 HD2 ARG 14 11.067 4.453 -5.023
108 HD3 ARG 14 HD3 ARG 14 9.344 4.343 -4.659
109 HE ARG 14 HE ARG 14 9.027 3.215 -6.634
110 HH11 ARG 14 HH11 ARG 14 12.200 4.647 -6.608
111 HH12 ARG 14 HH12 ARG 14 12.727 3.822 -8.038
112 HH21 ARG 14 HH21 ARG 14 9.707 2.124 -8.516
113 HH22 ARG 14 HH22 ARG 14 11.308 2.386 -9.124
114 H ALA 15 H ALA 15 6.965 5.577 -6.002
115 HA ALA 15 HA ALA 15 4.240 6.607 -5.718
116 HB1 ALA 15 HB1 ALA 15 4.403 5.367 -7.679
117 HB2 ALA 15 HB2 ALA 15 5.392 4.116 -6.921
118 HB3 ALA 15 HB3 ALA 15 3.676 4.235 -6.537
119 H CYS 16 H CYS 16 6.326 5.830 -3.546
120 HA CYS 16 HA CYS 16 5.344 3.605 -2.141
121 HB2 CYS 16 HB2 CYS 16 6.905 6.038 -1.294
122 HB3 CYS 16 HB3 CYS 16 6.437 4.793 -0.140
123 H CYS 17 H CYS 17 4.764 4.345 0.403
124 HA CYS 17 HA CYS 17 2.113 5.563 0.080
125 HB2 CYS 17 HB2 CYS 17 2.067 4.556 2.590
126 HB3 CYS 17 HB3 CYS 17 1.616 3.630 1.162
127 H GLU 18 H GLU 18 4.159 5.343 2.965
128 HA GLU 18 HA GLU 18 4.269 8.269 3.096
129 HB2 GLU 18 HB2 GLU 18 2.337 7.243 4.466
130 HB3 GLU 18 HB3 GLU 18 3.598 6.651 5.541
131 HG2 GLU 18 HG2 GLU 18 3.615 8.597 6.580
132 HG3 GLU 18 HG3 GLU 18 4.111 9.387 5.084
133 H GLY 19 H GLY 19 6.147 5.937 2.606
134 HA2 GLY 19 HA2 GLY 19 8.080 6.575 4.750
135 HA3 GLY 19 HA3 GLY 19 8.005 5.013 3.950
136 H LEU 20 H LEU 20 7.428 7.416 1.714
137 HA LEU 20 HA LEU 20 9.864 6.944 0.342
138 HB2 LEU 20 HB2 LEU 20 9.010 8.995 -1.014
139 HB3 LEU 20 HB3 LEU 20 8.156 7.456 -1.096
140 HG LEU 20 HG LEU 20 6.789 9.629 -0.890
141 HD11 LEU 20 HD11 LEU 20 5.326 7.961 -0.657
142 HD12 LEU 20 HD12 LEU 20 5.465 8.249 1.077
143 HD13 LEU 20 HD13 LEU 20 6.444 6.998 0.313
144 HD21 LEU 20 HD21 LEU 20 6.534 10.615 1.201
145 HD22 LEU 20 HD22 LEU 20 8.276 10.368 1.077
146 HD23 LEU 20 HD23 LEU 20 7.293 9.264 2.040
147 H ARG 21 H ARG 21 9.213 8.854 2.984
148 HA ARG 21 HA ARG 21 10.902 11.089 2.358
149 HB2 ARG 21 HB2 ARG 21 10.593 11.710 4.706
150 HB3 ARG 21 HB3 ARG 21 9.056 11.322 3.945
151 HG2 ARG 21 HG2 ARG 21 8.664 9.629 5.344
152 HG3 ARG 21 HG3 ARG 21 10.323 9.037 5.239
153 HD2 ARG 21 HD2 ARG 21 9.980 9.688 7.490
154 HD3 ARG 21 HD3 ARG 21 10.982 10.937 6.749
155 HE ARG 21 HE ARG 21 9.314 12.438 7.150
156 HH11 ARG 21 HH11 ARG 21 7.971 9.228 7.255
157 HH12 ARG 21 HH12 ARG 21 6.404 9.758 7.773
158 HH21 ARG 21 HH21 ARG 21 7.255 13.150 7.830
159 HH22 ARG 21 HH22 ARG 21 5.999 11.989 8.098
160 H CYS 22 H CYS 22 12.412 8.991 1.728
161 HA CYS 22 HA CYS 22 14.492 9.045 3.787
162 HB2 CYS 22 HB2 CYS 22 14.893 6.684 3.664
163 HB3 CYS 22 HB3 CYS 22 13.180 6.915 3.996
164 H LYS 23 H LYS 23 16.197 7.216 2.418
165 HA LYS 23 HA LYS 23 17.017 8.939 0.194
166 HB2 LYS 23 HB2 LYS 23 18.507 8.122 2.229
167 HB3 LYS 23 HB3 LYS 23 18.725 6.710 1.204
168 HG2 LYS 23 HG2 LYS 23 20.150 7.774 -0.124
169 HG3 LYS 23 HG3 LYS 23 19.096 9.183 -0.258
170 HD2 LYS 23 HD2 LYS 23 20.658 8.700 2.249
171 HD3 LYS 23 HD3 LYS 23 21.437 9.435 0.845
172 HE2 LYS 23 HE2 LYS 23 20.456 11.400 1.231
173 HE3 LYS 23 HE3 LYS 23 18.869 10.650 1.398
174 HZ1 LYS 23 HZ1 LYS 23 19.516 10.051 3.700
175 HZ2 LYS 23 HZ2 LYS 23 19.415 11.718 3.439
176 HZ3 LYS 23 HZ3 LYS 23 20.927 10.964 3.512
177 H LEU 24 H LEU 24 16.355 5.555 0.975
178 HA LEU 24 HA LEU 24 15.916 5.050 -1.876
179 HB2 LEU 24 HB2 LEU 24 17.892 3.734 -0.112
180 HB3 LEU 24 HB3 LEU 24 16.973 2.687 -1.193
181 HG LEU 24 HG LEU 24 17.757 4.148 -3.091
182 HD11 LEU 24 HD11 LEU 24 20.124 5.144 -2.042
183 HD12 LEU 24 HD12 LEU 24 18.894 5.598 -0.864
184 HD13 LEU 24 HD13 LEU 24 18.718 6.078 -2.553
185 HD21 LEU 24 HD21 LEU 24 20.008 2.849 -1.583
186 HD22 LEU 24 HD22 LEU 24 19.800 2.990 -3.328
187 HD23 LEU 24 HD23 LEU 24 18.745 1.927 -2.396
188 H TRP 25 H TRP 25 16.097 2.524 0.511
189 HA TRP 25 HA TRP 25 13.527 1.548 -0.026
190 HB2 TRP 25 HB2 TRP 25 14.432 -0.188 1.052
191 HB3 TRP 25 HB3 TRP 25 15.748 0.827 1.637
192 HD1 TRP 25 HD1 TRP 25 12.249 -0.403 2.680
193 HE1 TRP 25 HE1 TRP 25 12.063 -0.226 5.241
194 HE3 TRP 25 HE3 TRP 25 16.673 1.965 3.656
195 HZ2 TRP 25 HZ2 TRP 25 13.589 0.782 7.390
196 HZ3 TRP 25 HZ3 TRP 25 17.234 2.500 5.992
197 HH2 TRP 25 HH2 TRP 25 15.721 1.921 7.820
198 H CYS 26 H CYS 26 11.718 2.655 0.343
199 HA CYS 26 HA CYS 26 11.210 4.779 1.911
200 HB2 CYS 26 HB2 CYS 26 9.435 2.427 1.282
201 HB3 CYS 26 HB3 CYS 26 8.839 3.819 2.181
202 H ARG 27 H ARG 27 11.004 5.276 4.015
203 HA ARG 27 HA ARG 27 11.493 3.142 5.954
204 HB2 ARG 27 HB2 ARG 27 11.681 6.148 6.136
205 HB3 ARG 27 HB3 ARG 27 11.852 5.092 7.533
206 HG2 ARG 27 HG2 ARG 27 13.835 4.142 6.705
207 HG3 ARG 27 HG3 ARG 27 13.569 4.798 5.090
208 HD2 ARG 27 HD2 ARG 27 13.844 7.073 6.001
209 HD3 ARG 27 HD3 ARG 27 14.181 6.377 7.585
210 HE ARG 27 HE ARG 27 15.977 5.210 5.856
211 HH11 ARG 27 HH11 ARG 27 15.198 8.439 6.899
212 HH12 ARG 27 HH12 ARG 27 16.812 9.036 6.691
213 HH21 ARG 27 HH21 ARG 27 18.104 5.984 5.577
214 HH22 ARG 27 HH22 ARG 27 18.463 7.638 5.937
215 H LYS 28 H LYS 28 9.369 2.263 5.921
216 HA LYS 28 HA LYS 28 7.510 3.760 7.614
217 HB2 LYS 28 HB2 LYS 28 7.077 3.051 4.816
218 HB3 LYS 28 HB3 LYS 28 5.818 2.427 5.873
219 HG2 LYS 28 HG2 LYS 28 6.689 5.296 5.950
220 HG3 LYS 28 HG3 LYS 28 5.440 4.714 4.848
221 HD2 LYS 28 HD2 LYS 28 5.294 4.171 7.796
222 HD3 LYS 28 HD3 LYS 28 4.714 5.692 7.116
223 HE2 LYS 28 HE2 LYS 28 3.524 3.941 5.451
224 HE3 LYS 28 HE3 LYS 28 3.595 2.966 6.918
225 HZ1 LYS 28 HZ1 LYS 28 2.231 4.408 8.048
226 HZ2 LYS 28 HZ2 LYS 28 1.573 4.497 6.494
227 HZ3 LYS 28 HZ3 LYS 28 2.590 5.728 7.052
228 H ILE 29 H ILE 29 7.007 0.765 5.804
229 HA ILE 29 HA ILE 29 6.656 -0.633 8.362
230 HB ILE 29 HB ILE 29 5.553 -2.402 6.962
231 HG12 ILE 29 HG12 ILE 29 6.742 -1.332 4.843
232 HG13 ILE 29 HG13 ILE 29 5.198 -2.164 4.705
233 HG21 ILE 29 HG21 ILE 29 4.077 -1.031 8.120
234 HG22 ILE 29 HG22 ILE 29 4.488 0.389 7.159
235 HG23 ILE 29 HG23 ILE 29 3.518 -0.904 6.452
236 HD11 ILE 29 HD11 ILE 29 5.602 0.190 3.614
237 HD12 ILE 29 HD12 ILE 29 4.043 -0.242 4.317
238 HD13 ILE 29 HD13 ILE 29 5.176 0.755 5.228
239 H ILE 30 H ILE 30 9.131 -0.539 8.352
240 HA ILE 30 HA ILE 30 10.660 -2.101 6.598
241 HB ILE 30 HB ILE 30 11.473 -1.935 9.458
242 HG12 ILE 30 HG12 ILE 30 10.546 0.231 9.289
243 HG13 ILE 30 HG13 ILE 30 12.259 0.448 8.947
244 HG21 ILE 30 HG21 ILE 30 12.786 -1.751 6.776
245 HG22 ILE 30 HG22 ILE 30 13.604 -1.159 8.219
246 HG23 ILE 30 HG23 ILE 30 13.125 -2.852 8.109
247 HD11 ILE 30 HD11 ILE 30 10.053 1.216 7.381
248 HD12 ILE 30 HD12 ILE 30 11.769 1.385 7.009
249 HD13 ILE 30 HD13 ILE 30 10.894 -0.062 6.503
Start of MODEL 4
1 H1 ARG 1 H GLY 1 2.055 -6.848 1.270
2 HA ARG 1 HA2 GLY 1 0.350 -6.553 2.818
3 H TYR 2 H TYR 2 0.457 -3.663 4.091
4 HA TYR 2 HA TYR 2 -1.756 -2.683 2.451
5 HB2 TYR 2 HB2 TYR 2 -0.826 -1.690 5.153
6 HB3 TYR 2 HB3 TYR 2 -2.338 -1.290 4.344
7 HD1 TYR 2 HD1 TYR 2 -0.990 -3.190 6.886
8 HD2 TYR 2 HD2 TYR 2 -3.701 -3.538 3.626
9 HE1 TYR 2 HE1 TYR 2 -2.079 -5.090 8.005
10 HE2 TYR 2 HE2 TYR 2 -4.800 -5.439 4.735
11 HH TYR 2 HH TYR 2 -3.761 -7.264 6.715
12 H CYS 3 H CYS 3 0.723 -2.391 1.261
13 HA CYS 3 HA CYS 3 0.837 0.494 0.990
14 HB2 CYS 3 HB2 CYS 3 2.976 -1.100 2.273
15 HB3 CYS 3 HB3 CYS 3 3.506 0.064 1.062
16 H GLN 4 H GLN 4 2.999 0.795 -0.600
17 HA GLN 4 HA GLN 4 2.531 -1.085 -2.820
18 HB2 GLN 4 HB2 GLN 4 3.396 1.598 -3.606
19 HB3 GLN 4 HB3 GLN 4 2.113 0.593 -4.262
20 HG2 GLN 4 HG2 GLN 4 1.871 2.165 -1.713
21 HG3 GLN 4 HG3 GLN 4 1.357 2.756 -3.292
22 HE21 GLN 4 HE21 GLN 4 0.078 0.803 -4.459
23 HE22 GLN 4 HE22 GLN 4 -1.257 0.235 -3.522
24 H LYS 5 H LYS 5 4.365 -2.296 -2.195
25 HA LYS 5 HA LYS 5 6.617 -2.722 -1.859
26 HB2 LYS 5 HB2 LYS 5 6.255 -1.552 -4.595
27 HB3 LYS 5 HB3 LYS 5 7.862 -2.019 -4.053
28 HG2 LYS 5 HG2 LYS 5 7.064 -3.876 -5.216
29 HG3 LYS 5 HG3 LYS 5 6.841 -4.290 -3.514
30 HD2 LYS 5 HD2 LYS 5 4.667 -4.599 -3.865
31 HD3 LYS 5 HD3 LYS 5 4.509 -2.932 -4.421
32 HE2 LYS 5 HE2 LYS 5 4.495 -3.524 -6.597
33 HE3 LYS 5 HE3 LYS 5 5.687 -4.802 -6.362
34 HZ1 LYS 5 HZ1 LYS 5 2.827 -4.966 -6.421
35 HZ2 LYS 5 HZ2 LYS 5 3.488 -5.722 -5.058
36 HZ3 LYS 5 HZ3 LYS 5 3.981 -6.188 -6.608
37 H TRP 6 H TRP 6 6.113 -0.546 -0.344
38 HA TRP 6 HA TRP 6 7.248 1.865 -0.721
39 HB2 TRP 6 HB2 TRP 6 7.467 2.075 1.596
40 HB3 TRP 6 HB3 TRP 6 6.248 0.815 1.427
41 HD1 TRP 6 HD1 TRP 6 9.190 1.522 3.390
42 HE1 TRP 6 HE1 TRP 6 10.239 -0.620 4.357
43 HE3 TRP 6 HE3 TRP 6 6.801 -1.936 0.479
44 HZ2 TRP 6 HZ2 TRP 6 10.075 -3.406 3.943
45 HZ3 TRP 6 HZ3 TRP 6 7.304 -4.319 0.829
46 HH2 TRP 6 HH2 TRP 6 8.907 -5.038 2.524
47 H NLE 7 H NLE 7 8.873 -1.143 -0.338
48 HA NLE 7 HA NLE 7 11.497 -0.453 0.476
49 HB2 NLE 7 HB2 NLE 7 10.590 -2.751 0.179
50 HB3 NLE 7 HB3 NLE 7 10.749 -2.619 -1.571
51 HG2 NLE 7 HG2 NLE 7 13.062 -2.971 -1.515
52 HG3 NLE 7 HG3 NLE 7 13.306 -2.009 -0.062
53 HD2 NLE 7 HD2 NLE 7 13.367 -3.891 1.246
54 HD3 NLE 7 HD3 NLE 7 11.771 -4.406 0.682
55 HE1 NLE 7 HE1 NLE 7 14.345 -4.863 -0.745
56 HE2 NLE 7 HE2 NLE 7 13.457 -5.991 0.103
57 HE3 NLE 7 HE3 NLE 7 12.837 -5.340 -1.300
58 H TRP 8 H TRP 8 10.053 0.558 -2.515
59 HA TRP 8 HA TRP 8 12.143 0.771 -4.287
60 HB2 TRP 8 HB2 TRP 8 9.998 2.849 -3.795
61 HB3 TRP 8 HB3 TRP 8 10.964 2.687 -5.259
62 HD1 TRP 8 HD1 TRP 8 10.626 -0.630 -5.222
63 HE1 TRP 8 HE1 TRP 8 8.407 -1.568 -6.128
64 HE3 TRP 8 HE3 TRP 8 7.738 3.570 -4.810
65 HZ2 TRP 8 HZ2 TRP 8 5.782 -0.650 -6.606
66 HZ3 TRP 8 HZ3 TRP 8 5.385 3.456 -5.517
67 HH2 TRP 8 HH2 TRP 8 4.428 1.389 -6.396
68 H THR 9 H THR 9 13.282 2.844 -4.930
69 HA THR 9 HA THR 9 14.784 3.776 -2.647
70 HB THR 9 HB THR 9 16.096 3.304 -4.567
71 HG1 THR 9 HG1 THR 9 15.859 6.132 -4.639
72 HG21 THR 9 HG21 THR 9 15.193 3.430 -6.600
73 HG22 THR 9 HG22 THR 9 15.334 5.185 -6.515
74 HG23 THR 9 HG23 THR 9 13.851 4.393 -5.986
75 H CYS 10 H CYS 10 12.706 4.805 -1.807
76 HA CYS 10 HA CYS 10 11.298 6.873 -2.737
77 HB2 CYS 10 HB2 CYS 10 11.059 7.708 -0.512
78 HB3 CYS 10 HB3 CYS 10 11.268 5.964 -0.381
79 H ASP 11 H ASP 11 11.507 9.024 -3.189
80 HA ASP 11 HA ASP 11 13.709 10.634 -2.492
81 HB2 ASP 11 HB2 ASP 11 14.602 8.928 -4.303
82 HB3 ASP 11 HB3 ASP 11 13.814 10.040 -5.419
83 H SER 12 H SER 12 11.521 10.094 -5.256
84 HA SER 12 HA SER 12 9.813 12.224 -4.718
85 HB2 SER 12 HB2 SER 12 12.312 13.001 -6.028
86 HB3 SER 12 HB3 SER 12 10.879 13.492 -6.930
87 HG SER 12 HG SER 12 11.799 14.331 -4.448
88 H LYS 13 H LYS 13 11.379 10.219 -7.122
89 HA LYS 13 HA LYS 13 9.054 10.363 -8.883
90 HB2 LYS 13 HB2 LYS 13 11.849 9.346 -9.151
91 HB3 LYS 13 HB3 LYS 13 10.605 8.671 -10.195
92 HG2 LYS 13 HG2 LYS 13 10.388 11.519 -10.197
93 HG3 LYS 13 HG3 LYS 13 12.058 11.054 -10.536
94 HD2 LYS 13 HD2 LYS 13 11.297 10.870 -12.653
95 HD3 LYS 13 HD3 LYS 13 10.733 9.291 -12.097
96 HE2 LYS 13 HE2 LYS 13 8.737 9.992 -12.854
97 HE3 LYS 13 HE3 LYS 13 8.673 10.889 -11.340
98 HZ1 LYS 13 HZ1 LYS 13 8.152 12.296 -13.234
99 HZ2 LYS 13 HZ2 LYS 13 9.655 11.955 -13.930
100 HZ3 LYS 13 HZ3 LYS 13 9.573 12.816 -12.475
101 H ARG 14 H ARG 14 9.174 8.993 -6.181
102 HA ARG 14 HA ARG 14 8.532 6.252 -7.021
103 HB2 ARG 14 HB2 ARG 14 9.205 7.404 -4.312
104 HB3 ARG 14 HB3 ARG 14 8.658 5.751 -4.557
105 HG2 ARG 14 HG2 ARG 14 11.172 6.993 -5.652
106 HG3 ARG 14 HG3 ARG 14 11.055 5.797 -4.359
107 HD2 ARG 14 HD2 ARG 14 11.530 4.409 -6.102
108 HD3 ARG 14 HD3 ARG 14 9.773 4.440 -6.233
109 HE ARG 14 HE ARG 14 10.018 5.419 -8.271
110 HH11 ARG 14 HH11 ARG 14 12.894 6.029 -6.406
111 HH12 ARG 14 HH12 ARG 14 13.721 6.834 -7.699
112 HH21 ARG 14 HH21 ARG 14 11.096 6.477 -9.982
113 HH22 ARG 14 HH22 ARG 14 12.696 7.087 -9.733
114 H ALA 15 H ALA 15 6.852 5.325 -5.221
115 HA ALA 15 HA ALA 15 4.636 7.212 -4.919
116 HB1 ALA 15 HB1 ALA 15 3.774 4.582 -5.878
117 HB2 ALA 15 HB2 ALA 15 3.211 6.196 -6.321
118 HB3 ALA 15 HB3 ALA 15 4.669 5.536 -7.062
119 H CYS 16 H CYS 16 6.398 6.106 -2.980
120 HA CYS 16 HA CYS 16 5.417 3.839 -1.670
121 HB2 CYS 16 HB2 CYS 16 6.908 6.258 -0.648
122 HB3 CYS 16 HB3 CYS 16 6.514 4.882 0.378
123 H CYS 17 H CYS 17 4.797 4.414 0.891
124 HA CYS 17 HA CYS 17 2.214 5.809 0.643
125 HB2 CYS 17 HB2 CYS 17 1.979 4.326 2.921
126 HB3 CYS 17 HB3 CYS 17 1.445 3.800 1.327
127 H GLU 18 H GLU 18 3.973 4.828 3.549
128 HA GLU 18 HA GLU 18 4.266 7.662 4.281
129 HB2 GLU 18 HB2 GLU 18 2.331 6.197 5.392
130 HB3 GLU 18 HB3 GLU 18 3.658 5.697 6.431
131 HG2 GLU 18 HG2 GLU 18 4.063 8.291 6.595
132 HG3 GLU 18 HG3 GLU 18 2.356 8.351 6.157
133 H GLY 19 H GLY 19 6.273 6.060 3.160
134 HA2 GLY 19 HA2 GLY 19 8.167 6.019 5.403
135 HA3 GLY 19 HA3 GLY 19 8.027 4.583 4.401
136 H LEU 20 H LEU 20 7.479 7.312 2.551
137 HA LEU 20 HA LEU 20 9.898 6.965 1.085
138 HB2 LEU 20 HB2 LEU 20 9.032 9.152 -0.026
139 HB3 LEU 20 HB3 LEU 20 8.177 7.629 -0.273
140 HG LEU 20 HG LEU 20 6.811 9.761 0.182
141 HD11 LEU 20 HD11 LEU 20 6.477 7.016 1.092
142 HD12 LEU 20 HD12 LEU 20 5.347 8.081 0.254
143 HD13 LEU 20 HD13 LEU 20 5.510 8.173 2.008
144 HD21 LEU 20 HD21 LEU 20 8.322 10.273 2.211
145 HD22 LEU 20 HD22 LEU 20 7.328 9.087 3.056
146 HD23 LEU 20 HD23 LEU 20 6.584 10.530 2.362
147 H ARG 21 H ARG 21 9.296 8.526 3.942
148 HA ARG 21 HA ARG 21 10.928 10.855 3.574
149 HB2 ARG 21 HB2 ARG 21 10.709 11.127 6.005
150 HB3 ARG 21 HB3 ARG 21 9.150 10.833 5.246
151 HG2 ARG 21 HG2 ARG 21 8.821 8.942 6.386
152 HG3 ARG 21 HG3 ARG 21 10.487 8.405 6.162
153 HD2 ARG 21 HD2 ARG 21 9.837 8.829 8.539
154 HD3 ARG 21 HD3 ARG 21 11.243 9.739 7.986
155 HE ARG 21 HE ARG 21 8.837 11.227 7.670
156 HH11 ARG 21 HH11 ARG 21 11.201 10.211 10.015
157 HH12 ARG 21 HH12 ARG 21 10.927 11.560 11.069
158 HH21 ARG 21 HH21 ARG 21 8.469 13.008 9.049
159 HH22 ARG 21 HH22 ARG 21 9.372 13.149 10.518
160 H CYS 22 H CYS 22 12.479 8.960 2.593
161 HA CYS 22 HA CYS 22 14.639 8.779 4.552
162 HB2 CYS 22 HB2 CYS 22 15.069 6.458 4.147
163 HB3 CYS 22 HB3 CYS 22 13.368 6.610 4.571
164 H LYS 23 H LYS 23 16.266 7.121 2.862
165 HA LYS 23 HA LYS 23 16.964 9.122 0.835
166 HB2 LYS 23 HB2 LYS 23 18.562 8.057 2.679
167 HB3 LYS 23 HB3 LYS 23 18.744 6.811 1.450
168 HG2 LYS 23 HG2 LYS 23 20.147 8.072 0.294
169 HG3 LYS 23 HG3 LYS 23 19.007 9.420 0.274
170 HD2 LYS 23 HD2 LYS 23 20.507 8.878 2.784
171 HD3 LYS 23 HD3 LYS 23 21.374 9.620 1.438
172 HE2 LYS 23 HE2 LYS 23 20.435 11.593 1.848
173 HE3 LYS 23 HE3 LYS 23 18.820 10.887 1.802
174 HZ1 LYS 23 HZ1 LYS 23 20.447 11.604 4.068
175 HZ2 LYS 23 HZ2 LYS 23 19.744 10.072 4.197
176 HZ3 LYS 23 HZ3 LYS 23 18.767 11.431 3.953
177 H LEU 24 H LEU 24 16.675 5.592 1.194
178 HA LEU 24 HA LEU 24 16.013 5.452 -1.670
179 HB2 LEU 24 HB2 LEU 24 18.039 3.957 -0.121
180 HB3 LEU 24 HB3 LEU 24 17.084 3.024 -1.272
181 HG LEU 24 HG LEU 24 17.876 4.352 -3.102
182 HD11 LEU 24 HD11 LEU 24 18.788 6.158 -0.935
183 HD12 LEU 24 HD12 LEU 24 18.082 6.535 -2.507
184 HD13 LEU 24 HD13 LEU 24 19.776 6.062 -2.393
185 HD21 LEU 24 HD21 LEU 24 20.169 3.743 -3.119
186 HD22 LEU 24 HD22 LEU 24 19.328 2.524 -2.161
187 HD23 LEU 24 HD23 LEU 24 20.264 3.786 -1.359
188 H TRP 25 H TRP 25 16.251 2.670 0.410
189 HA TRP 25 HA TRP 25 13.656 1.772 -0.173
190 HB2 TRP 25 HB2 TRP 25 14.589 -0.091 0.638
191 HB3 TRP 25 HB3 TRP 25 15.924 0.837 1.311
192 HD1 TRP 25 HD1 TRP 25 12.402 -0.406 2.294
193 HE1 TRP 25 HE1 TRP 25 12.313 -0.611 4.858
194 HE3 TRP 25 HE3 TRP 25 16.988 1.547 3.424
195 HZ2 TRP 25 HZ2 TRP 25 13.969 -0.022 7.067
196 HZ3 TRP 25 HZ3 TRP 25 17.660 1.692 5.786
197 HH2 TRP 25 HH2 TRP 25 16.180 0.924 7.569
198 H CYS 26 H CYS 26 11.836 2.733 0.435
199 HA CYS 26 HA CYS 26 11.387 4.676 2.250
200 HB2 CYS 26 HB2 CYS 26 9.610 2.383 1.441
201 HB3 CYS 26 HB3 CYS 26 9.045 3.654 2.521
202 H ARG 27 H ARG 27 11.286 4.925 4.404
203 HA ARG 27 HA ARG 27 12.065 2.689 6.072
204 HB2 ARG 27 HB2 ARG 27 11.787 5.646 6.483
205 HB3 ARG 27 HB3 ARG 27 11.881 4.574 7.875
206 HG2 ARG 27 HG2 ARG 27 14.055 3.942 7.409
207 HG3 ARG 27 HG3 ARG 27 13.933 4.407 5.711
208 HD2 ARG 27 HD2 ARG 27 15.236 6.099 6.610
209 HD3 ARG 27 HD3 ARG 27 13.620 6.801 6.634
210 HE ARG 27 HE ARG 27 13.840 5.666 9.079
211 HH11 ARG 27 HH11 ARG 27 15.835 7.875 7.276
212 HH12 ARG 27 HH12 ARG 27 16.457 8.670 8.685
213 HH21 ARG 27 HH21 ARG 27 14.651 6.701 10.942
214 HH22 ARG 27 HH22 ARG 27 15.783 8.001 10.770
215 H LYS 28 H LYS 28 9.420 2.645 4.853
216 HA LYS 28 HA LYS 28 7.415 3.319 6.722
217 HB2 LYS 28 HB2 LYS 28 7.502 2.275 4.134
218 HB3 LYS 28 HB3 LYS 28 6.733 1.016 5.093
219 HG2 LYS 28 HG2 LYS 28 5.838 3.850 4.682
220 HG3 LYS 28 HG3 LYS 28 4.989 2.358 4.271
221 HD2 LYS 28 HD2 LYS 28 5.579 2.350 7.065
222 HD3 LYS 28 HD3 LYS 28 4.808 3.881 6.650
223 HE2 LYS 28 HE2 LYS 28 3.694 1.271 5.685
224 HE3 LYS 28 HE3 LYS 28 3.318 1.877 7.297
225 HZ1 LYS 28 HZ1 LYS 28 1.775 2.458 5.331
226 HZ2 LYS 28 HZ2 LYS 28 2.945 3.620 4.956
227 HZ3 LYS 28 HZ3 LYS 28 2.162 3.661 6.454
228 H ILE 29 H ILE 29 6.119 0.610 6.550
229 HA ILE 29 HA ILE 29 6.691 -0.303 9.117
230 HB ILE 29 HB ILE 29 5.333 -2.189 8.666
231 HG12 ILE 29 HG12 ILE 29 6.515 -2.981 6.659
232 HG13 ILE 29 HG13 ILE 29 4.774 -2.948 6.404
233 HG21 ILE 29 HG21 ILE 29 4.552 0.406 7.922
234 HG22 ILE 29 HG22 ILE 29 3.843 -0.691 6.737
235 HG23 ILE 29 HG23 ILE 29 3.523 -0.924 8.454
236 HD11 ILE 29 HD11 ILE 29 6.885 -1.181 5.254
237 HD12 ILE 29 HD12 ILE 29 5.597 -2.074 4.440
238 HD13 ILE 29 HD13 ILE 29 5.215 -0.624 5.368
239 H ILE 30 H ILE 30 8.424 -0.766 6.212
240 HA ILE 30 HA ILE 30 10.378 -1.840 5.753
241 HB ILE 30 HB ILE 30 10.502 -2.687 8.640
242 HG12 ILE 30 HG12 ILE 30 10.148 -0.348 8.780
243 HG13 ILE 30 HG13 ILE 30 11.888 -0.564 8.909
244 HG21 ILE 30 HG21 ILE 30 12.263 -2.864 6.358
245 HG22 ILE 30 HG22 ILE 30 13.023 -1.995 7.690
246 HG23 ILE 30 HG23 ILE 30 12.397 -3.623 7.943
247 HD11 ILE 30 HD11 ILE 30 10.375 0.279 6.450
248 HD12 ILE 30 HD12 ILE 30 11.374 1.308 7.478
249 HD13 ILE 30 HD13 ILE 30 12.116 0.014 6.536
Start of MODEL 5
1 H1 ARG 1 H GLY 1 2.966 -6.446 3.265
2 HA ARG 1 HA2 GLY 1 0.895 -6.446 4.276
3 H TYR 2 H TYR 2 0.436 -3.095 4.417
4 HA TYR 2 HA TYR 2 -1.593 -3.273 2.290
5 HB2 TYR 2 HB2 TYR 2 -2.850 -1.577 3.495
6 HB3 TYR 2 HB3 TYR 2 -2.489 -2.923 4.571
7 HD1 TYR 2 HD1 TYR 2 -2.074 0.615 3.967
8 HD2 TYR 2 HD2 TYR 2 -0.677 -2.671 6.279
9 HE1 TYR 2 HE1 TYR 2 -1.073 2.182 5.580
10 HE2 TYR 2 HE2 TYR 2 0.327 -1.117 7.898
11 HH TYR 2 HH TYR 2 -0.387 1.696 8.432
12 H CYS 3 H CYS 3 1.260 -2.565 1.995
13 HA CYS 3 HA CYS 3 0.937 0.188 0.991
14 HB2 CYS 3 HB2 CYS 3 3.164 -1.152 2.418
15 HB3 CYS 3 HB3 CYS 3 3.618 -0.076 1.102
16 H GLN 4 H GLN 4 3.080 0.418 -0.633
17 HA GLN 4 HA GLN 4 2.688 -1.707 -2.634
18 HB2 GLN 4 HB2 GLN 4 3.449 0.994 -3.578
19 HB3 GLN 4 HB3 GLN 4 2.377 -0.196 -4.308
20 HG2 GLN 4 HG2 GLN 4 1.659 1.469 -1.909
21 HG3 GLN 4 HG3 GLN 4 1.262 1.899 -3.570
22 HE21 GLN 4 HE21 GLN 4 0.407 -0.317 -4.708
23 HE22 GLN 4 HE22 GLN 4 -0.964 -0.975 -3.890
24 H LYS 5 H LYS 5 4.551 -2.802 -1.891
25 HA LYS 5 HA LYS 5 6.808 -3.138 -1.517
26 HB2 LYS 5 HB2 LYS 5 6.429 -2.241 -4.349
27 HB3 LYS 5 HB3 LYS 5 8.049 -2.595 -3.765
28 HG2 LYS 5 HG2 LYS 5 6.841 -4.813 -2.937
29 HG3 LYS 5 HG3 LYS 5 5.778 -4.416 -4.290
30 HD2 LYS 5 HD2 LYS 5 7.293 -5.109 -5.766
31 HD3 LYS 5 HD3 LYS 5 8.543 -4.100 -5.037
32 HE2 LYS 5 HE2 LYS 5 7.730 -6.658 -3.720
33 HE3 LYS 5 HE3 LYS 5 8.825 -6.692 -5.102
34 HZ1 LYS 5 HZ1 LYS 5 9.724 -4.719 -3.342
35 HZ2 LYS 5 HZ2 LYS 5 10.477 -6.178 -3.744
36 HZ3 LYS 5 HZ3 LYS 5 9.420 -6.108 -2.426
37 H TRP 6 H TRP 6 6.213 -0.824 -0.232
38 HA TRP 6 HA TRP 6 7.316 1.559 -0.830
39 HB2 TRP 6 HB2 TRP 6 7.468 2.013 1.456
40 HB3 TRP 6 HB3 TRP 6 6.277 0.717 1.390
41 HD1 TRP 6 HD1 TRP 6 9.135 1.684 3.353
42 HE1 TRP 6 HE1 TRP 6 10.200 -0.323 4.560
43 HE3 TRP 6 HE3 TRP 6 6.929 -2.106 0.727
44 HZ2 TRP 6 HZ2 TRP 6 10.119 -3.142 4.416
45 HZ3 TRP 6 HZ3 TRP 6 7.477 -4.428 1.323
46 HH2 TRP 6 HH2 TRP 6 9.039 -4.934 3.131
47 H NLE 7 H NLE 7 8.976 -1.365 -0.124
48 HA NLE 7 HA NLE 7 11.565 -0.561 0.695
49 HB2 NLE 7 HB2 NLE 7 10.678 -2.895 0.556
50 HB3 NLE 7 HB3 NLE 7 10.937 -2.907 -1.187
51 HG2 NLE 7 HG2 NLE 7 13.241 -3.231 -0.969
52 HG3 NLE 7 HG3 NLE 7 13.400 -2.121 0.385
53 HD2 NLE 7 HD2 NLE 7 13.426 -3.861 1.877
54 HD3 NLE 7 HD3 NLE 7 11.856 -4.442 1.312
55 HE1 NLE 7 HE1 NLE 7 14.484 -5.028 0.042
56 HE2 NLE 7 HE2 NLE 7 13.566 -6.069 0.968
57 HE3 NLE 7 HE3 NLE 7 13.001 -5.572 -0.520
58 H TRP 8 H TRP 8 10.191 0.166 -2.408
59 HA TRP 8 HA TRP 8 12.296 0.252 -4.157
60 HB2 TRP 8 HB2 TRP 8 10.197 2.407 -3.847
61 HB3 TRP 8 HB3 TRP 8 11.144 2.072 -5.295
62 HD1 TRP 8 HD1 TRP 8 10.752 -1.169 -5.121
63 HE1 TRP 8 HE1 TRP 8 8.482 -2.139 -5.844
64 HE3 TRP 8 HE3 TRP 8 7.885 3.038 -4.649
65 HZ2 TRP 8 HZ2 TRP 8 5.824 -1.239 -6.171
66 HZ3 TRP 8 HZ3 TRP 8 5.488 2.897 -5.187
67 HH2 TRP 8 HH2 TRP 8 4.480 0.802 -5.933
68 H THR 9 H THR 9 13.540 2.180 -4.915
69 HA THR 9 HA THR 9 14.985 3.299 -2.684
70 HB THR 9 HB THR 9 16.342 2.628 -4.512
71 HG1 THR 9 HG1 THR 9 17.150 4.797 -5.234
72 HG21 THR 9 HG21 THR 9 15.373 2.531 -6.529
73 HG22 THR 9 HG22 THR 9 15.774 4.241 -6.685
74 HG23 THR 9 HG23 THR 9 14.182 3.759 -6.102
75 H CYS 10 H CYS 10 12.883 4.432 -2.025
76 HA CYS 10 HA CYS 10 11.602 6.467 -3.221
77 HB2 CYS 10 HB2 CYS 10 11.161 7.412 -1.091
78 HB3 CYS 10 HB3 CYS 10 11.375 5.688 -0.812
79 H ASP 11 H ASP 11 11.902 8.620 -3.696
80 HA ASP 11 HA ASP 11 14.594 9.725 -3.289
81 HB2 ASP 11 HB2 ASP 11 13.222 9.174 -5.834
82 HB3 ASP 11 HB3 ASP 11 13.904 10.793 -5.707
83 H SER 12 H SER 12 11.318 10.523 -4.444
84 HA SER 12 HA SER 12 10.806 12.485 -2.532
85 HB2 SER 12 HB2 SER 12 10.991 14.516 -4.086
86 HB3 SER 12 HB3 SER 12 12.498 13.884 -3.419
87 HG SER 12 HG SER 12 12.747 14.237 -5.623
88 H LYS 13 H LYS 13 10.322 11.345 -5.808
89 HA LYS 13 HA LYS 13 7.452 11.946 -5.531
90 HB2 LYS 13 HB2 LYS 13 9.152 12.110 -8.025
91 HB3 LYS 13 HB3 LYS 13 7.395 12.200 -8.021
92 HG2 LYS 13 HG2 LYS 13 7.477 14.217 -6.674
93 HG3 LYS 13 HG3 LYS 13 9.239 14.118 -6.611
94 HD2 LYS 13 HD2 LYS 13 8.909 14.045 -9.262
95 HD3 LYS 13 HD3 LYS 13 7.455 14.948 -8.829
96 HE2 LYS 13 HE2 LYS 13 9.334 16.194 -7.311
97 HE3 LYS 13 HE3 LYS 13 10.283 15.740 -8.727
98 HZ1 LYS 13 HZ1 LYS 13 9.456 17.747 -9.385
99 HZ2 LYS 13 HZ2 LYS 13 8.010 17.582 -8.526
100 HZ3 LYS 13 HZ3 LYS 13 8.232 16.737 -9.974
101 H ARG 14 H ARG 14 8.624 9.553 -4.686
102 HA ARG 14 HA ARG 14 8.381 7.549 -6.726
103 HB2 ARG 14 HB2 ARG 14 9.328 7.691 -4.019
104 HB3 ARG 14 HB3 ARG 14 8.200 6.350 -4.170
105 HG2 ARG 14 HG2 ARG 14 10.651 6.803 -5.862
106 HG3 ARG 14 HG3 ARG 14 10.479 5.619 -4.564
107 HD2 ARG 14 HD2 ARG 14 8.667 4.533 -5.824
108 HD3 ARG 14 HD3 ARG 14 8.893 5.699 -7.129
109 HE ARG 14 HE ARG 14 11.311 4.330 -6.503
110 HH11 ARG 14 HH11 ARG 14 8.278 4.017 -8.185
111 HH12 ARG 14 HH12 ARG 14 8.879 2.856 -9.322
112 HH21 ARG 14 HH21 ARG 14 12.114 2.803 -7.995
113 HH22 ARG 14 HH22 ARG 14 11.061 2.166 -9.214
114 H ALA 15 H ALA 15 7.000 5.501 -5.626
115 HA ALA 15 HA ALA 15 4.248 6.548 -5.504
116 HB1 ALA 15 HB1 ALA 15 4.330 5.336 -7.474
117 HB2 ALA 15 HB2 ALA 15 5.396 4.106 -6.795
118 HB3 ALA 15 HB3 ALA 15 3.696 4.157 -6.325
119 H CYS 16 H CYS 16 6.382 5.750 -3.390
120 HA CYS 16 HA CYS 16 5.475 3.502 -1.991
121 HB2 CYS 16 HB2 CYS 16 6.958 5.981 -1.135
122 HB3 CYS 16 HB3 CYS 16 6.535 4.717 0.018
123 H CYS 17 H CYS 17 4.876 4.181 0.559
124 HA CYS 17 HA CYS 17 2.207 5.375 0.271
125 HB2 CYS 17 HB2 CYS 17 2.211 4.193 2.739
126 HB3 CYS 17 HB3 CYS 17 1.638 3.431 1.260
127 H GLU 18 H GLU 18 4.184 4.958 3.175
128 HA GLU 18 HA GLU 18 4.303 7.872 3.496
129 HB2 GLU 18 HB2 GLU 18 2.373 6.644 4.784
130 HB3 GLU 18 HB3 GLU 18 3.666 6.169 5.875
131 HG2 GLU 18 HG2 GLU 18 3.590 8.135 6.878
132 HG3 GLU 18 HG3 GLU 18 3.876 8.963 5.348
133 H GLY 19 H GLY 19 6.288 5.864 2.744
134 HA2 GLY 19 HA2 GLY 19 8.168 6.297 4.980
135 HA3 GLY 19 HA3 GLY 19 8.093 4.756 4.139
136 H LEU 20 H LEU 20 7.524 7.265 1.997
137 HA LEU 20 HA LEU 20 9.960 6.818 0.606
138 HB2 LEU 20 HB2 LEU 20 9.101 8.899 -0.699
139 HB3 LEU 20 HB3 LEU 20 8.254 7.359 -0.823
140 HG LEU 20 HG LEU 20 6.876 9.516 -0.567
141 HD11 LEU 20 HD11 LEU 20 5.416 7.843 -0.365
142 HD12 LEU 20 HD12 LEU 20 5.565 8.078 1.375
143 HD13 LEU 20 HD13 LEU 20 6.543 6.855 0.563
144 HD21 LEU 20 HD21 LEU 20 6.619 10.462 1.540
145 HD22 LEU 20 HD22 LEU 20 8.361 10.209 1.425
146 HD23 LEU 20 HD23 LEU 20 7.367 9.088 2.358
147 H ARG 21 H ARG 21 9.313 8.635 3.303
148 HA ARG 21 HA ARG 21 10.969 10.911 2.744
149 HB2 ARG 21 HB2 ARG 21 10.691 11.428 5.128
150 HB3 ARG 21 HB3 ARG 21 9.148 11.068 4.362
151 HG2 ARG 21 HG2 ARG 21 10.227 8.652 5.410
152 HG3 ARG 21 HG3 ARG 21 10.283 9.893 6.663
153 HD2 ARG 21 HD2 ARG 21 7.846 9.192 5.031
154 HD3 ARG 21 HD3 ARG 21 8.172 8.600 6.659
155 HE ARG 21 HE ARG 21 8.217 11.461 6.465
156 HH11 ARG 21 HH11 ARG 21 6.182 8.664 6.862
157 HH12 ARG 21 HH12 ARG 21 4.919 9.534 7.669
158 HH21 ARG 21 HH21 ARG 21 6.563 12.618 7.528
159 HH22 ARG 21 HH22 ARG 21 5.137 11.785 8.047
160 H CYS 22 H CYS 22 12.530 8.925 1.996
161 HA CYS 22 HA CYS 22 14.626 8.909 4.034
162 HB2 CYS 22 HB2 CYS 22 15.058 6.562 3.828
163 HB3 CYS 22 HB3 CYS 22 13.342 6.748 4.174
164 H LYS 23 H LYS 23 16.331 7.151 2.564
165 HA LYS 23 HA LYS 23 17.090 8.971 0.396
166 HB2 LYS 23 HB2 LYS 23 18.751 6.742 1.568
167 HB3 LYS 23 HB3 LYS 23 19.304 8.092 0.586
168 HG2 LYS 23 HG2 LYS 23 18.085 9.297 2.762
169 HG3 LYS 23 HG3 LYS 23 18.935 7.911 3.447
170 HD2 LYS 23 HD2 LYS 23 20.577 9.531 3.496
171 HD3 LYS 23 HD3 LYS 23 20.907 8.743 1.951
172 HE2 LYS 23 HE2 LYS 23 20.986 11.028 1.463
173 HE3 LYS 23 HE3 LYS 23 19.384 10.525 0.929
174 HZ1 LYS 23 HZ1 LYS 23 18.610 12.164 2.186
175 HZ2 LYS 23 HZ2 LYS 23 20.107 12.424 2.927
176 HZ3 LYS 23 HZ3 LYS 23 19.049 11.258 3.544
177 H LEU 24 H LEU 24 16.721 5.499 1.059
178 HA LEU 24 HA LEU 24 16.217 5.098 -1.812
179 HB2 LEU 24 HB2 LEU 24 18.171 3.759 -0.049
180 HB3 LEU 24 HB3 LEU 24 17.257 2.712 -1.132
181 HG LEU 24 HG LEU 24 18.103 3.891 -3.060
182 HD11 LEU 24 HD11 LEU 24 20.065 5.572 -2.380
183 HD12 LEU 24 HD12 LEU 24 18.984 5.832 -1.012
184 HD13 LEU 24 HD13 LEU 24 18.405 6.096 -2.658
185 HD21 LEU 24 HD21 LEU 24 20.085 2.829 -3.064
186 HD22 LEU 24 HD22 LEU 24 19.544 2.217 -1.502
187 HD23 LEU 24 HD23 LEU 24 20.626 3.608 -1.578
188 H TRP 25 H TRP 25 16.345 2.516 0.520
189 HA TRP 25 HA TRP 25 13.761 1.588 -0.101
190 HB2 TRP 25 HB2 TRP 25 14.617 -0.219 0.896
191 HB3 TRP 25 HB3 TRP 25 15.972 0.733 1.496
192 HD1 TRP 25 HD1 TRP 25 12.436 -0.390 2.558
193 HE1 TRP 25 HE1 TRP 25 12.319 -0.349 5.129
194 HE3 TRP 25 HE3 TRP 25 17.009 1.673 3.546
195 HZ2 TRP 25 HZ2 TRP 25 13.949 0.453 7.289
196 HZ3 TRP 25 HZ3 TRP 25 17.651 2.046 5.892
197 HH2 TRP 25 HH2 TRP 25 16.152 1.448 7.724
198 H CYS 26 H CYS 26 11.921 2.577 0.387
199 HA CYS 26 HA CYS 26 11.430 4.666 2.021
200 HB2 CYS 26 HB2 CYS 26 9.669 2.312 1.357
201 HB3 CYS 26 HB3 CYS 26 9.078 3.669 2.311
202 H ARG 27 H ARG 27 11.361 5.095 4.136
203 HA ARG 27 HA ARG 27 12.027 2.980 6.002
204 HB2 ARG 27 HB2 ARG 27 11.774 5.973 6.242
205 HB3 ARG 27 HB3 ARG 27 12.002 4.946 7.651
206 HG2 ARG 27 HG2 ARG 27 14.097 4.109 6.695
207 HG3 ARG 27 HG3 ARG 27 13.869 5.167 5.301
208 HD2 ARG 27 HD2 ARG 27 14.455 5.897 8.150
209 HD3 ARG 27 HD3 ARG 27 15.330 6.354 6.688
210 HE ARG 27 HE ARG 27 12.944 7.516 6.301
211 HH11 ARG 27 HH11 ARG 27 15.105 7.488 9.031
212 HH12 ARG 27 HH12 ARG 27 14.632 9.061 9.586
213 HH21 ARG 27 HH21 ARG 27 12.316 9.588 7.019
214 HH22 ARG 27 HH22 ARG 27 13.046 10.252 8.442
215 H LYS 28 H LYS 28 9.393 2.951 4.748
216 HA LYS 28 HA LYS 28 7.409 3.852 6.554
217 HB2 LYS 28 HB2 LYS 28 7.485 2.561 4.042
218 HB3 LYS 28 HB3 LYS 28 6.541 1.527 5.105
219 HG2 LYS 28 HG2 LYS 28 5.862 4.367 5.285
220 HG3 LYS 28 HG3 LYS 28 5.565 3.641 3.704
221 HD2 LYS 28 HD2 LYS 28 3.590 3.091 4.668
222 HD3 LYS 28 HD3 LYS 28 4.533 1.723 5.267
223 HE2 LYS 28 HE2 LYS 28 4.791 2.685 7.386
224 HE3 LYS 28 HE3 LYS 28 4.339 4.288 6.811
225 HZ1 LYS 28 HZ1 LYS 28 2.637 2.951 8.147
226 HZ2 LYS 28 HZ2 LYS 28 2.411 2.056 6.731
227 HZ3 LYS 28 HZ3 LYS 28 2.108 3.719 6.736
228 H ILE 29 H ILE 29 5.927 1.280 6.602
229 HA ILE 29 HA ILE 29 6.473 0.472 9.197
230 HB ILE 29 HB ILE 29 4.978 -1.324 8.881
231 HG12 ILE 29 HG12 ILE 29 6.141 -2.338 6.945
232 HG13 ILE 29 HG13 ILE 29 4.398 -2.270 6.715
233 HG21 ILE 29 HG21 ILE 29 4.106 0.698 6.829
234 HG22 ILE 29 HG22 ILE 29 3.089 -0.304 7.862
235 HG23 ILE 29 HG23 ILE 29 4.057 0.989 8.568
236 HD11 ILE 29 HD11 ILE 29 6.443 -0.425 5.504
237 HD12 ILE 29 HD12 ILE 29 5.513 -1.673 4.674
238 HD13 ILE 29 HD13 ILE 29 4.697 -0.254 5.330
239 H ILE 30 H ILE 30 8.116 -0.319 6.298
240 HA ILE 30 HA ILE 30 10.016 -1.522 5.916
241 HB ILE 30 HB ILE 30 10.071 -2.237 8.842
242 HG12 ILE 30 HG12 ILE 30 9.867 0.146 8.801
243 HG13 ILE 30 HG13 ILE 30 11.570 -0.216 9.062
244 HG21 ILE 30 HG21 ILE 30 11.677 -3.498 7.721
245 HG22 ILE 30 HG22 ILE 30 12.084 -2.181 6.624
246 HG23 ILE 30 HG23 ILE 30 12.582 -2.107 8.314
247 HD11 ILE 30 HD11 ILE 30 12.102 0.320 6.807
248 HD12 ILE 30 HD12 ILE 30 10.396 0.450 6.380
249 HD13 ILE 30 HD13 ILE 30 11.126 1.634 7.464
Start of MODEL 6
1 H1 ARG 1 H GLY 1 -2.944 -5.151 -1.543
2 HA ARG 1 HA2 GLY 1 -2.855 -5.924 0.622
3 H TYR 2 H TYR 2 -0.293 -4.123 1.814
4 HA TYR 2 HA TYR 2 -2.167 -2.195 3.010
5 HB2 TYR 2 HB2 TYR 2 0.261 -3.597 4.034
6 HB3 TYR 2 HB3 TYR 2 -0.092 -1.989 4.655
7 HD1 TYR 2 HD1 TYR 2 -0.992 -5.488 4.732
8 HD2 TYR 2 HD2 TYR 2 -2.260 -1.579 5.834
9 HE1 TYR 2 HE1 TYR 2 -2.604 -6.462 6.314
10 HE2 TYR 2 HE2 TYR 2 -3.874 -2.543 7.419
11 HH TYR 2 HH TYR 2 -4.219 -4.606 8.669
12 H CYS 3 H CYS 3 0.897 -2.550 1.346
13 HA CYS 3 HA CYS 3 0.894 0.337 0.835
14 HB2 CYS 3 HB2 CYS 3 3.026 -1.249 2.162
15 HB3 CYS 3 HB3 CYS 3 3.547 -0.057 0.977
16 H GLN 4 H GLN 4 3.081 0.584 -0.725
17 HA GLN 4 HA GLN 4 2.672 -1.374 -2.886
18 HB2 GLN 4 HB2 GLN 4 3.436 1.396 -3.614
19 HB3 GLN 4 HB3 GLN 4 2.405 0.253 -4.464
20 HG2 GLN 4 HG2 GLN 4 1.587 1.704 -1.960
21 HG3 GLN 4 HG3 GLN 4 1.244 2.280 -3.590
22 HE21 GLN 4 HE21 GLN 4 -0.649 1.601 -1.550
23 HE22 GLN 4 HE22 GLN 4 -1.614 0.308 -2.165
24 H LYS 5 H LYS 5 4.524 -2.521 -2.204
25 HA LYS 5 HA LYS 5 6.778 -2.886 -1.830
26 HB2 LYS 5 HB2 LYS 5 6.427 -1.797 -4.598
27 HB3 LYS 5 HB3 LYS 5 8.041 -2.197 -4.024
28 HG2 LYS 5 HG2 LYS 5 6.934 -4.475 -3.387
29 HG3 LYS 5 HG3 LYS 5 5.726 -3.988 -4.581
30 HD2 LYS 5 HD2 LYS 5 7.293 -3.964 -6.320
31 HD3 LYS 5 HD3 LYS 5 8.662 -3.918 -5.207
32 HE2 LYS 5 HE2 LYS 5 7.186 -6.256 -4.629
33 HE3 LYS 5 HE3 LYS 5 7.373 -6.180 -6.380
34 HZ1 LYS 5 HZ1 LYS 5 9.448 -6.363 -4.301
35 HZ2 LYS 5 HZ2 LYS 5 9.821 -5.659 -5.792
36 HZ3 LYS 5 HZ3 LYS 5 9.277 -7.261 -5.725
37 H TRP 6 H TRP 6 6.209 -0.696 -0.369
38 HA TRP 6 HA TRP 6 7.287 1.734 -0.784
39 HB2 TRP 6 HB2 TRP 6 7.465 2.001 1.527
40 HB3 TRP 6 HB3 TRP 6 6.284 0.703 1.374
41 HD1 TRP 6 HD1 TRP 6 9.171 1.538 3.364
42 HE1 TRP 6 HE1 TRP 6 10.270 -0.549 4.391
43 HE3 TRP 6 HE3 TRP 6 6.941 -2.052 0.485
44 HZ2 TRP 6 HZ2 TRP 6 10.199 -3.349 4.030
45 HZ3 TRP 6 HZ3 TRP 6 7.511 -4.411 0.891
46 HH2 TRP 6 HH2 TRP 6 9.108 -5.043 2.626
47 H NLE 7 H NLE 7 8.975 -1.226 -0.341
48 HA NLE 7 HA NLE 7 11.572 -0.463 0.503
49 HB2 NLE 7 HB2 NLE 7 10.707 -2.787 0.221
50 HB3 NLE 7 HB3 NLE 7 10.915 -2.676 -1.524
51 HG2 NLE 7 HG2 NLE 7 13.230 -2.985 -1.396
52 HG3 NLE 7 HG3 NLE 7 13.415 -1.987 0.040
53 HD2 NLE 7 HD2 NLE 7 13.490 -3.840 1.384
54 HD3 NLE 7 HD3 NLE 7 11.913 -4.390 0.809
55 HE1 NLE 7 HE1 NLE 7 14.514 -4.844 -0.563
56 HE2 NLE 7 HE2 NLE 7 13.628 -5.966 0.297
57 HE3 NLE 7 HE3 NLE 7 13.023 -5.356 -1.133
58 H TRP 8 H TRP 8 10.144 0.498 -2.502
59 HA TRP 8 HA TRP 8 12.234 0.716 -4.272
60 HB2 TRP 8 HB2 TRP 8 10.095 2.802 -3.798
61 HB3 TRP 8 HB3 TRP 8 11.045 2.601 -5.267
62 HD1 TRP 8 HD1 TRP 8 10.711 -0.675 -5.270
63 HE1 TRP 8 HE1 TRP 8 8.466 -1.632 -6.089
64 HE3 TRP 8 HE3 TRP 8 7.788 3.471 -4.641
65 HZ2 TRP 8 HZ2 TRP 8 5.806 -0.743 -6.422
66 HZ3 TRP 8 HZ3 TRP 8 5.405 3.335 -5.234
67 HH2 TRP 8 HH2 TRP 8 4.437 1.270 -6.106
68 H THR 9 H THR 9 13.329 2.826 -4.929
69 HA THR 9 HA THR 9 14.806 3.790 -2.626
70 HB THR 9 HB THR 9 16.133 5.042 -4.410
71 HG1 THR 9 HG1 THR 9 14.807 3.280 -6.199
72 HG21 THR 9 HG21 THR 9 17.528 3.289 -4.400
73 HG22 THR 9 HG22 THR 9 16.373 2.266 -5.258
74 HG23 THR 9 HG23 THR 9 16.272 2.435 -3.506
75 H CYS 10 H CYS 10 12.771 4.883 -1.838
76 HA CYS 10 HA CYS 10 11.393 6.927 -2.912
77 HB2 CYS 10 HB2 CYS 10 11.125 7.864 -0.703
78 HB3 CYS 10 HB3 CYS 10 11.171 6.109 -0.567
79 H ASP 11 H ASP 11 11.735 8.928 -3.661
80 HA ASP 11 HA ASP 11 13.655 10.746 -2.811
81 HB2 ASP 11 HB2 ASP 11 14.742 8.705 -4.519
82 HB3 ASP 11 HB3 ASP 11 14.818 10.259 -5.341
83 H SER 12 H SER 12 12.846 9.781 -6.142
84 HA SER 12 HA SER 12 11.624 12.426 -6.518
85 HB2 SER 12 HB2 SER 12 11.814 11.731 -9.005
86 HB3 SER 12 HB3 SER 12 13.296 12.151 -8.144
87 HG SER 12 HG SER 12 12.456 9.719 -9.148
88 H LYS 13 H LYS 13 11.115 9.034 -7.491
89 HA LYS 13 HA LYS 13 8.583 9.248 -8.549
90 HB2 LYS 13 HB2 LYS 13 10.283 7.139 -7.625
91 HB3 LYS 13 HB3 LYS 13 8.644 6.829 -7.068
92 HG2 LYS 13 HG2 LYS 13 8.867 5.747 -9.153
93 HG3 LYS 13 HG3 LYS 13 7.887 7.188 -9.441
94 HD2 LYS 13 HD2 LYS 13 10.307 8.218 -9.917
95 HD3 LYS 13 HD3 LYS 13 10.633 6.538 -10.343
96 HE2 LYS 13 HE2 LYS 13 8.441 8.275 -11.473
97 HE3 LYS 13 HE3 LYS 13 9.930 7.811 -12.298
98 HZ1 LYS 13 HZ1 LYS 13 8.999 5.421 -11.673
99 HZ2 LYS 13 HZ2 LYS 13 8.582 6.211 -13.109
100 HZ3 LYS 13 HZ3 LYS 13 7.528 6.247 -11.786
101 H ARG 14 H ARG 14 9.419 8.542 -5.159
102 HA ARG 14 HA ARG 14 8.200 8.662 -3.236
103 HB2 ARG 14 HB2 ARG 14 8.041 11.127 -4.553
104 HB3 ARG 14 HB3 ARG 14 6.400 10.788 -4.019
105 HG2 ARG 14 HG2 ARG 14 7.101 10.604 -1.746
106 HG3 ARG 14 HG3 ARG 14 8.801 10.683 -2.213
107 HD2 ARG 14 HD2 ARG 14 7.236 12.942 -3.181
108 HD3 ARG 14 HD3 ARG 14 7.240 12.805 -1.424
109 HE ARG 14 HE ARG 14 9.860 12.540 -2.505
110 HH11 ARG 14 HH11 ARG 14 7.402 14.866 -1.684
111 HH12 ARG 14 HH12 ARG 14 8.526 16.160 -1.436
112 HH21 ARG 14 HH21 ARG 14 11.350 14.236 -2.183
113 HH22 ARG 14 HH22 ARG 14 10.770 15.802 -1.720
114 H ALA 15 H ALA 15 7.214 6.840 -5.187
115 HA ALA 15 HA ALA 15 4.320 7.085 -5.160
116 HB1 ALA 15 HB1 ALA 15 5.383 6.251 -7.176
117 HB2 ALA 15 HB2 ALA 15 6.101 4.920 -6.269
118 HB3 ALA 15 HB3 ALA 15 4.351 5.006 -6.469
119 H CYS 16 H CYS 16 6.301 6.412 -2.798
120 HA CYS 16 HA CYS 16 5.410 3.854 -1.879
121 HB2 CYS 16 HB2 CYS 16 6.928 6.114 -0.587
122 HB3 CYS 16 HB3 CYS 16 6.459 4.676 0.314
123 H CYS 17 H CYS 17 4.795 4.210 0.765
124 HA CYS 17 HA CYS 17 2.139 5.446 0.583
125 HB2 CYS 17 HB2 CYS 17 2.085 4.027 2.905
126 HB3 CYS 17 HB3 CYS 17 1.589 3.389 1.341
127 H GLU 18 H GLU 18 4.081 4.737 3.452
128 HA GLU 18 HA GLU 18 4.180 7.603 4.071
129 HB2 GLU 18 HB2 GLU 18 2.350 5.972 5.263
130 HB3 GLU 18 HB3 GLU 18 3.698 5.842 6.383
131 HG2 GLU 18 HG2 GLU 18 3.282 7.842 7.235
132 HG3 GLU 18 HG3 GLU 18 3.252 8.585 5.638
133 H GLY 19 H GLY 19 6.197 5.740 3.099
134 HA2 GLY 19 HA2 GLY 19 8.082 5.973 5.357
135 HA3 GLY 19 HA3 GLY 19 8.015 4.506 4.391
136 H LEU 20 H LEU 20 7.412 7.207 2.493
137 HA LEU 20 HA LEU 20 9.840 6.892 1.042
138 HB2 LEU 20 HB2 LEU 20 8.951 9.067 -0.073
139 HB3 LEU 20 HB3 LEU 20 8.118 7.536 -0.323
140 HG LEU 20 HG LEU 20 6.720 9.648 0.126
141 HD11 LEU 20 HD11 LEU 20 5.294 7.930 0.181
142 HD12 LEU 20 HD12 LEU 20 5.421 8.057 1.936
143 HD13 LEU 20 HD13 LEU 20 6.426 6.900 1.063
144 HD21 LEU 20 HD21 LEU 20 8.220 10.179 2.160
145 HD22 LEU 20 HD22 LEU 20 7.231 8.984 3.000
146 HD23 LEU 20 HD23 LEU 20 6.478 10.418 2.301
147 H ARG 21 H ARG 21 9.220 8.442 3.897
148 HA ARG 21 HA ARG 21 10.813 10.795 3.536
149 HB2 ARG 21 HB2 ARG 21 10.610 11.043 5.971
150 HB3 ARG 21 HB3 ARG 21 9.051 10.737 5.220
151 HG2 ARG 21 HG2 ARG 21 8.754 8.826 6.337
152 HG3 ARG 21 HG3 ARG 21 10.428 8.319 6.107
153 HD2 ARG 21 HD2 ARG 21 10.954 10.167 7.852
154 HD3 ARG 21 HD3 ARG 21 9.242 10.034 8.254
155 HE ARG 21 HE ARG 21 10.397 7.470 8.224
156 HH11 ARG 21 HH11 ARG 21 10.409 10.409 10.088
157 HH12 ARG 21 HH12 ARG 21 10.775 9.614 11.582
158 HH21 ARG 21 HH21 ARG 21 10.881 6.412 10.186
159 HH22 ARG 21 HH22 ARG 21 11.045 7.341 11.638
160 H CYS 22 H CYS 22 12.400 8.964 2.525
161 HA CYS 22 HA CYS 22 14.575 8.801 4.466
162 HB2 CYS 22 HB2 CYS 22 15.043 6.492 4.061
163 HB3 CYS 22 HB3 CYS 22 13.336 6.608 4.479
164 H LYS 23 H LYS 23 16.261 7.226 2.798
165 HA LYS 23 HA LYS 23 16.871 9.226 0.746
166 HB2 LYS 23 HB2 LYS 23 18.624 6.970 1.730
167 HB3 LYS 23 HB3 LYS 23 19.115 8.346 0.750
168 HG2 LYS 23 HG2 LYS 23 18.032 8.610 3.543
169 HG3 LYS 23 HG3 LYS 23 19.750 8.459 3.172
170 HD2 LYS 23 HD2 LYS 23 19.869 10.637 2.738
171 HD3 LYS 23 HD3 LYS 23 18.627 10.473 1.493
172 HE2 LYS 23 HE2 LYS 23 18.027 12.119 3.231
173 HE3 LYS 23 HE3 LYS 23 16.884 10.778 3.136
174 HZ1 LYS 23 HZ1 LYS 23 17.397 10.091 5.189
175 HZ2 LYS 23 HZ2 LYS 23 18.003 11.655 5.408
176 HZ3 LYS 23 HZ3 LYS 23 19.053 10.390 5.008
177 H LEU 24 H LEU 24 16.480 5.731 1.168
178 HA LEU 24 HA LEU 24 15.882 5.527 -1.696
179 HB2 LEU 24 HB2 LEU 24 17.979 4.099 -0.168
180 HB3 LEU 24 HB3 LEU 24 17.054 3.152 -1.332
181 HG LEU 24 HG LEU 24 17.721 4.786 -3.092
182 HD11 LEU 24 HD11 LEU 24 18.475 6.758 -2.377
183 HD12 LEU 24 HD12 LEU 24 20.003 5.935 -2.068
184 HD13 LEU 24 HD13 LEU 24 18.830 6.135 -0.767
185 HD21 LEU 24 HD21 LEU 24 18.905 2.694 -2.875
186 HD22 LEU 24 HD22 LEU 24 19.930 3.367 -1.608
187 HD23 LEU 24 HD23 LEU 24 20.049 3.981 -3.258
188 H TRP 25 H TRP 25 16.268 2.770 0.395
189 HA TRP 25 HA TRP 25 13.712 1.752 -0.138
190 HB2 TRP 25 HB2 TRP 25 14.780 -0.040 0.677
191 HB3 TRP 25 HB3 TRP 25 16.023 0.976 1.404
192 HD1 TRP 25 HD1 TRP 25 12.490 -0.372 2.250
193 HE1 TRP 25 HE1 TRP 25 12.336 -0.644 4.805
194 HE3 TRP 25 HE3 TRP 25 17.042 1.562 3.547
195 HZ2 TRP 25 HZ2 TRP 25 13.932 -0.109 7.071
196 HZ3 TRP 25 HZ3 TRP 25 17.650 1.647 5.929
197 HH2 TRP 25 HH2 TRP 25 16.126 0.828 7.653
198 H CYS 26 H CYS 26 11.889 2.759 0.419
199 HA CYS 26 HA CYS 26 11.379 4.672 2.233
200 HB2 CYS 26 HB2 CYS 26 9.650 2.340 1.425
201 HB3 CYS 26 HB3 CYS 26 9.053 3.620 2.477
202 H ARG 27 H ARG 27 11.348 4.926 4.378
203 HA ARG 27 HA ARG 27 12.077 2.677 6.053
204 HB2 ARG 27 HB2 ARG 27 11.891 5.642 6.453
205 HB3 ARG 27 HB3 ARG 27 11.975 4.574 7.846
206 HG2 ARG 27 HG2 ARG 27 14.116 3.817 7.280
207 HG3 ARG 27 HG3 ARG 27 13.991 4.434 5.632
208 HD2 ARG 27 HD2 ARG 27 15.266 6.094 6.507
209 HD3 ARG 27 HD3 ARG 27 13.684 6.730 6.955
210 HE ARG 27 HE ARG 27 14.172 6.316 9.161
211 HH11 ARG 27 HH11 ARG 27 16.514 4.731 7.130
212 HH12 ARG 27 HH12 ARG 27 17.565 4.315 8.442
213 HH21 ARG 27 HH21 ARG 27 15.548 5.773 10.899
214 HH22 ARG 27 HH22 ARG 27 17.014 4.906 10.587
215 H LYS 28 H LYS 28 9.421 2.709 4.860
216 HA LYS 28 HA LYS 28 7.466 3.451 6.767
217 HB2 LYS 28 HB2 LYS 28 7.474 2.448 4.158
218 HB3 LYS 28 HB3 LYS 28 6.664 1.208 5.108
219 HG2 LYS 28 HG2 LYS 28 5.797 3.968 5.637
220 HG3 LYS 28 HG3 LYS 28 5.429 3.345 4.027
221 HD2 LYS 28 HD2 LYS 28 4.358 1.382 5.056
222 HD3 LYS 28 HD3 LYS 28 4.689 2.052 6.653
223 HE2 LYS 28 HE2 LYS 28 3.249 3.910 6.255
224 HE3 LYS 28 HE3 LYS 28 3.082 3.490 4.550
225 HZ1 LYS 28 HZ1 LYS 28 1.193 2.547 5.283
226 HZ2 LYS 28 HZ2 LYS 28 1.744 2.376 6.873
227 HZ3 LYS 28 HZ3 LYS 28 2.208 1.257 5.693
228 H ILE 29 H ILE 29 6.074 0.782 6.545
229 HA ILE 29 HA ILE 29 6.600 -0.194 9.090
230 HB ILE 29 HB ILE 29 5.220 -2.049 8.589
231 HG12 ILE 29 HG12 ILE 29 6.417 -2.831 6.588
232 HG13 ILE 29 HG13 ILE 29 4.682 -2.763 6.307
233 HG21 ILE 29 HG21 ILE 29 3.802 -0.471 6.651
234 HG22 ILE 29 HG22 ILE 29 3.420 -0.771 8.345
235 HG23 ILE 29 HG23 ILE 29 4.483 0.564 7.906
236 HD11 ILE 29 HD11 ILE 29 6.847 -1.041 5.204
237 HD12 ILE 29 HD12 ILE 29 5.526 -1.862 4.372
238 HD13 ILE 29 HD13 ILE 29 5.203 -0.417 5.328
239 H ILE 30 H ILE 30 8.369 -0.638 6.203
240 HA ILE 30 HA ILE 30 10.310 -1.739 5.752
241 HB ILE 30 HB ILE 30 10.364 -2.588 8.644
242 HG12 ILE 30 HG12 ILE 30 10.139 -0.243 8.773
243 HG13 ILE 30 HG13 ILE 30 11.874 -0.528 8.872
244 HG21 ILE 30 HG21 ILE 30 12.438 -2.347 6.486
245 HG22 ILE 30 HG22 ILE 30 12.858 -2.440 8.196
246 HG23 ILE 30 HG23 ILE 30 11.993 -3.770 7.426
247 HD11 ILE 30 HD11 ILE 30 10.341 0.361 6.440
248 HD12 ILE 30 HD12 ILE 30 11.422 1.344 7.429
249 HD13 ILE 30 HD13 ILE 30 12.068 0.006 6.479
Start of MODEL 7
1 H1 ARG 1 H GLY 1 1.918 -3.313 7.675
2 HA ARG 1 HA2 GLY 1 0.137 -4.656 7.128
3 H TYR 2 H TYR 2 -0.920 -1.949 5.134
4 HA TYR 2 HA TYR 2 -0.354 -3.580 2.745
5 HB2 TYR 2 HB2 TYR 2 -2.414 -2.430 1.765
6 HB3 TYR 2 HB3 TYR 2 -2.703 -3.668 2.982
7 HD1 TYR 2 HD1 TYR 2 -2.983 -0.137 2.164
8 HD2 TYR 2 HD2 TYR 2 -3.407 -3.025 5.258
9 HE1 TYR 2 HE1 TYR 2 -4.295 1.473 3.479
10 HE2 TYR 2 HE2 TYR 2 -4.721 -1.423 6.583
11 HH TYR 2 HH TYR 2 -5.773 0.560 6.560
12 H CYS 3 H CYS 3 0.982 -2.644 1.362
13 HA CYS 3 HA CYS 3 0.878 0.234 0.934
14 HB2 CYS 3 HB2 CYS 3 3.147 -1.201 2.213
15 HB3 CYS 3 HB3 CYS 3 3.548 0.028 1.015
16 H GLN 4 H GLN 4 3.014 0.600 -0.678
17 HA GLN 4 HA GLN 4 2.626 -1.375 -2.830
18 HB2 GLN 4 HB2 GLN 4 3.353 1.408 -3.550
19 HB3 GLN 4 HB3 GLN 4 2.323 0.259 -4.394
20 HG2 GLN 4 HG2 GLN 4 1.528 1.701 -1.878
21 HG3 GLN 4 HG3 GLN 4 1.141 2.257 -3.506
22 HE21 GLN 4 HE21 GLN 4 0.268 0.251 -4.868
23 HE22 GLN 4 HE22 GLN 4 -1.061 -0.556 -4.115
24 H LYS 5 H LYS 5 4.495 -2.516 -2.216
25 HA LYS 5 HA LYS 5 6.759 -2.866 -1.871
26 HB2 LYS 5 HB2 LYS 5 6.371 -1.727 -4.618
27 HB3 LYS 5 HB3 LYS 5 7.988 -2.148 -4.068
28 HG2 LYS 5 HG2 LYS 5 7.548 -4.183 -4.851
29 HG3 LYS 5 HG3 LYS 5 6.534 -4.382 -3.421
30 HD2 LYS 5 HD2 LYS 5 4.591 -3.617 -4.669
31 HD3 LYS 5 HD3 LYS 5 5.596 -3.332 -6.092
32 HE2 LYS 5 HE2 LYS 5 5.814 -5.565 -6.553
33 HE3 LYS 5 HE3 LYS 5 5.620 -6.044 -4.867
34 HZ1 LYS 5 HZ1 LYS 5 3.731 -6.442 -6.613
35 HZ2 LYS 5 HZ2 LYS 5 3.328 -4.843 -6.243
36 HZ3 LYS 5 HZ3 LYS 5 3.361 -6.010 -5.021
37 H TRP 6 H TRP 6 6.184 -0.693 -0.378
38 HA TRP 6 HA TRP 6 7.244 1.748 -0.778
39 HB2 TRP 6 HB2 TRP 6 7.438 1.991 1.537
40 HB3 TRP 6 HB3 TRP 6 6.266 0.686 1.380
41 HD1 TRP 6 HD1 TRP 6 9.160 1.525 3.353
42 HE1 TRP 6 HE1 TRP 6 10.285 -0.565 4.353
43 HE3 TRP 6 HE3 TRP 6 6.937 -2.055 0.457
44 HZ2 TRP 6 HZ2 TRP 6 10.237 -3.361 3.962
45 HZ3 TRP 6 HZ3 TRP 6 7.531 -4.411 0.832
46 HH2 TRP 6 HH2 TRP 6 9.146 -5.049 2.548
47 H NLE 7 H NLE 7 8.953 -1.207 -0.381
48 HA NLE 7 HA NLE 7 11.551 -0.446 0.453
49 HB2 NLE 7 HB2 NLE 7 10.687 -2.768 0.128
50 HB3 NLE 7 HB3 NLE 7 10.901 -2.622 -1.614
51 HG2 NLE 7 HG2 NLE 7 13.212 -2.935 -1.484
52 HG3 NLE 7 HG3 NLE 7 13.397 -1.946 -0.042
53 HD2 NLE 7 HD2 NLE 7 13.482 -3.809 1.289
54 HD3 NLE 7 HD3 NLE 7 11.903 -4.360 0.713
55 HE1 NLE 7 HE1 NLE 7 14.504 -4.797 -0.670
56 HE2 NLE 7 HE2 NLE 7 13.622 -5.926 0.183
57 HE3 NLE 7 HE3 NLE 7 13.012 -5.309 -1.241
58 H TRP 8 H TRP 8 10.094 0.562 -2.523
59 HA TRP 8 HA TRP 8 12.165 0.824 -4.307
60 HB2 TRP 8 HB2 TRP 8 10.042 2.913 -3.770
61 HB3 TRP 8 HB3 TRP 8 10.964 2.716 -5.259
62 HD1 TRP 8 HD1 TRP 8 10.608 -0.547 -5.319
63 HE1 TRP 8 HE1 TRP 8 8.337 -1.480 -6.090
64 HE3 TRP 8 HE3 TRP 8 7.718 3.595 -4.519
65 HZ2 TRP 8 HZ2 TRP 8 5.671 -0.578 -6.327
66 HZ3 TRP 8 HZ3 TRP 8 5.317 3.475 -5.044
67 HH2 TRP 8 HH2 TRP 8 4.317 1.432 -5.931
68 H THR 9 H THR 9 13.264 2.938 -4.931
69 HA THR 9 HA THR 9 14.740 3.871 -2.611
70 HB THR 9 HB THR 9 16.108 5.100 -4.365
71 HG1 THR 9 HG1 THR 9 14.711 5.171 -6.092
72 HG21 THR 9 HG21 THR 9 17.464 3.314 -4.424
73 HG22 THR 9 HG22 THR 9 16.259 2.317 -5.240
74 HG23 THR 9 HG23 THR 9 16.209 2.502 -3.487
75 H CYS 10 H CYS 10 12.744 4.994 -1.814
76 HA CYS 10 HA CYS 10 11.379 7.046 -2.901
77 HB2 CYS 10 HB2 CYS 10 11.174 8.025 -0.674
78 HB3 CYS 10 HB3 CYS 10 11.080 6.270 -0.580
79 H ASP 11 H ASP 11 11.814 8.944 -3.807
80 HA ASP 11 HA ASP 11 13.651 10.831 -2.918
81 HB2 ASP 11 HB2 ASP 11 14.873 8.710 -4.423
82 HB3 ASP 11 HB3 ASP 11 15.006 10.220 -5.321
83 H SER 12 H SER 12 13.129 9.686 -6.245
84 HA SER 12 HA SER 12 12.116 12.315 -6.967
85 HB2 SER 12 HB2 SER 12 12.039 11.113 -9.301
86 HB3 SER 12 HB3 SER 12 13.590 11.590 -8.609
87 HG SER 12 HG SER 12 13.419 9.370 -9.437
88 H LYS 13 H LYS 13 11.046 9.099 -8.033
89 HA LYS 13 HA LYS 13 8.448 9.750 -8.636
90 HB2 LYS 13 HB2 LYS 13 9.699 7.184 -7.698
91 HB3 LYS 13 HB3 LYS 13 7.975 7.273 -8.036
92 HG2 LYS 13 HG2 LYS 13 9.992 8.152 -10.066
93 HG3 LYS 13 HG3 LYS 13 9.546 6.453 -9.888
94 HD2 LYS 13 HD2 LYS 13 7.288 6.891 -10.446
95 HD3 LYS 13 HD3 LYS 13 7.508 8.635 -10.270
96 HE2 LYS 13 HE2 LYS 13 7.547 8.385 -12.563
97 HE3 LYS 13 HE3 LYS 13 9.265 8.325 -12.169
98 HZ1 LYS 13 HZ1 LYS 13 9.251 6.435 -13.327
99 HZ2 LYS 13 HZ2 LYS 13 7.567 6.287 -13.278
100 HZ3 LYS 13 HZ3 LYS 13 8.503 5.736 -11.981
101 H ARG 14 H ARG 14 9.443 8.137 -5.611
102 HA ARG 14 HA ARG 14 8.573 8.176 -3.511
103 HB2 ARG 14 HB2 ARG 14 7.358 10.816 -4.340
104 HB3 ARG 14 HB3 ARG 14 7.617 10.251 -2.695
105 HG2 ARG 14 HG2 ARG 14 10.123 10.115 -3.898
106 HG3 ARG 14 HG3 ARG 14 9.418 11.626 -4.474
107 HD2 ARG 14 HD2 ARG 14 8.758 11.793 -1.884
108 HD3 ARG 14 HD3 ARG 14 10.219 10.815 -1.745
109 HE ARG 14 HE ARG 14 10.570 13.123 -3.406
110 HH11 ARG 14 HH11 ARG 14 10.542 11.969 -0.122
111 HH12 ARG 14 HH12 ARG 14 11.578 13.227 0.467
112 HH21 ARG 14 HH21 ARG 14 11.933 14.785 -2.643
113 HH22 ARG 14 HH22 ARG 14 12.367 14.830 -0.968
114 H ALA 15 H ALA 15 7.193 6.605 -5.207
115 HA ALA 15 HA ALA 15 4.359 7.244 -5.002
116 HB1 ALA 15 HB1 ALA 15 5.833 4.967 -6.313
117 HB2 ALA 15 HB2 ALA 15 4.074 5.107 -6.275
118 HB3 ALA 15 HB3 ALA 15 5.039 6.331 -7.099
119 H CYS 16 H CYS 16 6.313 6.374 -2.743
120 HA CYS 16 HA CYS 16 5.320 3.882 -1.794
121 HB2 CYS 16 HB2 CYS 16 6.861 6.116 -0.475
122 HB3 CYS 16 HB3 CYS 16 6.394 4.654 0.386
123 H CYS 17 H CYS 17 4.700 4.260 0.839
124 HA CYS 17 HA CYS 17 2.081 5.571 0.640
125 HB2 CYS 17 HB2 CYS 17 1.961 4.151 2.958
126 HB3 CYS 17 HB3 CYS 17 1.470 3.526 1.387
127 H GLU 18 H GLU 18 4.000 4.801 3.512
128 HA GLU 18 HA GLU 18 4.149 7.664 4.149
129 HB2 GLU 18 HB2 GLU 18 2.222 6.351 5.306
130 HB3 GLU 18 HB3 GLU 18 3.505 5.662 6.290
131 HG2 GLU 18 HG2 GLU 18 4.177 8.141 6.678
132 HG3 GLU 18 HG3 GLU 18 2.525 8.474 6.161
133 H GLY 19 H GLY 19 6.122 5.742 3.155
134 HA2 GLY 19 HA2 GLY 19 8.035 5.949 5.393
135 HA3 GLY 19 HA3 GLY 19 7.939 4.492 4.417
136 H LEU 20 H LEU 20 7.363 7.241 2.567
137 HA LEU 20 HA LEU 20 9.780 6.899 1.092
138 HB2 LEU 20 HB2 LEU 20 8.901 9.081 -0.019
139 HB3 LEU 20 HB3 LEU 20 8.056 7.553 -0.265
140 HG LEU 20 HG LEU 20 6.672 9.674 0.190
141 HD11 LEU 20 HD11 LEU 20 5.371 8.099 2.009
142 HD12 LEU 20 HD12 LEU 20 6.366 6.932 1.137
143 HD13 LEU 20 HD13 LEU 20 5.239 7.964 0.257
144 HD21 LEU 20 HD21 LEU 20 7.202 9.015 3.061
145 HD22 LEU 20 HD22 LEU 20 6.445 10.450 2.368
146 HD23 LEU 20 HD23 LEU 20 8.186 10.207 2.211
147 H ARG 21 H ARG 21 9.185 8.436 3.956
148 HA ARG 21 HA ARG 21 10.784 10.786 3.597
149 HB2 ARG 21 HB2 ARG 21 10.595 11.022 6.035
150 HB3 ARG 21 HB3 ARG 21 9.030 10.729 5.289
151 HG2 ARG 21 HG2 ARG 21 8.730 8.813 6.395
152 HG3 ARG 21 HG3 ARG 21 10.401 8.301 6.159
153 HD2 ARG 21 HD2 ARG 21 10.845 10.245 7.905
154 HD3 ARG 21 HD3 ARG 21 9.183 9.880 8.361
155 HE ARG 21 HE ARG 21 11.505 8.257 8.832
156 HH11 ARG 21 HH11 ARG 21 8.045 8.254 8.442
157 HH12 ARG 21 HH12 ARG 21 7.814 6.787 9.333
158 HH21 ARG 21 HH21 ARG 21 11.213 6.325 10.008
159 HH22 ARG 21 HH22 ARG 21 9.617 5.690 10.226
160 H CYS 22 H CYS 22 12.366 8.967 2.569
161 HA CYS 22 HA CYS 22 14.544 8.779 4.504
162 HB2 CYS 22 HB2 CYS 22 15.005 6.475 4.076
163 HB3 CYS 22 HB3 CYS 22 13.295 6.587 4.485
164 H LYS 23 H LYS 23 16.231 7.229 2.823
165 HA LYS 23 HA LYS 23 16.836 9.246 0.786
166 HB2 LYS 23 HB2 LYS 23 18.603 6.986 1.727
167 HB3 LYS 23 HB3 LYS 23 19.081 8.398 0.793
168 HG2 LYS 23 HG2 LYS 23 18.001 8.544 3.595
169 HG3 LYS 23 HG3 LYS 23 19.720 8.458 3.206
170 HD2 LYS 23 HD2 LYS 23 19.740 10.665 2.943
171 HD3 LYS 23 HD3 LYS 23 18.614 10.492 1.593
172 HE2 LYS 23 HE2 LYS 23 17.437 11.906 2.967
173 HE3 LYS 23 HE3 LYS 23 16.826 10.340 3.499
174 HZ1 LYS 23 HZ1 LYS 23 17.383 11.077 5.519
175 HZ2 LYS 23 HZ2 LYS 23 18.421 12.275 4.925
176 HZ3 LYS 23 HZ3 LYS 23 18.971 10.684 5.083
177 H LEU 24 H LEU 24 16.482 5.741 1.177
178 HA LEU 24 HA LEU 24 15.883 5.562 -1.690
179 HB2 LEU 24 HB2 LEU 24 17.973 4.129 -0.164
180 HB3 LEU 24 HB3 LEU 24 17.052 3.182 -1.329
181 HG LEU 24 HG LEU 24 17.725 4.786 -3.096
182 HD11 LEU 24 HD11 LEU 24 18.400 6.793 -2.388
183 HD12 LEU 24 HD12 LEU 24 19.958 6.020 -2.096
184 HD13 LEU 24 HD13 LEU 24 18.801 6.191 -0.777
185 HD21 LEU 24 HD21 LEU 24 19.945 3.445 -1.558
186 HD22 LEU 24 HD22 LEU 24 20.079 4.038 -3.212
187 HD23 LEU 24 HD23 LEU 24 18.959 2.730 -2.833
188 H TRP 25 H TRP 25 16.252 2.798 0.398
189 HA TRP 25 HA TRP 25 13.694 1.788 -0.160
190 HB2 TRP 25 HB2 TRP 25 14.751 -0.017 0.634
191 HB3 TRP 25 HB3 TRP 25 16.005 0.982 1.364
192 HD1 TRP 25 HD1 TRP 25 12.477 -0.373 2.218
193 HE1 TRP 25 HE1 TRP 25 12.333 -0.656 4.774
194 HE3 TRP 25 HE3 TRP 25 17.023 1.577 3.510
195 HZ2 TRP 25 HZ2 TRP 25 13.935 -0.126 7.035
196 HZ3 TRP 25 HZ3 TRP 25 17.641 1.652 5.891
197 HH2 TRP 25 HH2 TRP 25 16.127 0.819 7.615
198 H CYS 26 H CYS 26 11.869 2.777 0.414
199 HA CYS 26 HA CYS 26 11.371 4.677 2.255
200 HB2 CYS 26 HB2 CYS 26 9.624 2.363 1.423
201 HB3 CYS 26 HB3 CYS 26 9.037 3.648 2.474
202 H ARG 27 H ARG 27 11.311 4.899 4.406
203 HA ARG 27 HA ARG 27 12.049 2.629 6.049
204 HB2 ARG 27 HB2 ARG 27 11.795 5.583 6.529
205 HB3 ARG 27 HB3 ARG 27 11.955 4.465 7.876
206 HG2 ARG 27 HG2 ARG 27 13.918 4.289 5.651
207 HG3 ARG 27 HG3 ARG 27 14.049 5.626 6.797
208 HD2 ARG 27 HD2 ARG 27 13.951 3.881 8.629
209 HD3 ARG 27 HD3 ARG 27 14.167 2.674 7.363
210 HE ARG 27 HE ARG 27 16.380 3.203 7.322
211 HH11 ARG 27 HH11 ARG 27 14.629 5.872 8.714
212 HH12 ARG 27 HH12 ARG 27 16.056 6.775 9.103
213 HH21 ARG 27 HH21 ARG 27 18.265 4.384 7.828
214 HH22 ARG 27 HH22 ARG 27 18.124 5.929 8.596
215 H LYS 28 H LYS 28 9.392 2.686 4.829
216 HA LYS 28 HA LYS 28 7.419 3.369 6.731
217 HB2 LYS 28 HB2 LYS 28 7.489 2.301 4.115
218 HB3 LYS 28 HB3 LYS 28 6.573 1.164 5.095
219 HG2 LYS 28 HG2 LYS 28 5.864 3.980 5.501
220 HG3 LYS 28 HG3 LYS 28 5.532 3.352 3.886
221 HD2 LYS 28 HD2 LYS 28 3.588 2.735 4.887
222 HD3 LYS 28 HD3 LYS 28 4.556 1.325 5.323
223 HE2 LYS 28 HE2 LYS 28 4.836 2.036 7.510
224 HE3 LYS 28 HE3 LYS 28 4.505 3.720 7.113
225 HZ1 LYS 28 HZ1 LYS 28 2.710 2.492 8.352
226 HZ2 LYS 28 HZ2 LYS 28 2.433 1.613 6.934
227 HZ3 LYS 28 HZ3 LYS 28 2.214 3.289 6.944
228 H ILE 29 H ILE 29 5.990 0.768 6.565
229 HA ILE 29 HA ILE 29 6.567 -0.254 9.071
230 HB ILE 29 HB ILE 29 5.139 -2.072 8.590
231 HG12 ILE 29 HG12 ILE 29 6.318 -2.849 6.556
232 HG13 ILE 29 HG13 ILE 29 4.572 -2.812 6.339
233 HG21 ILE 29 HG21 ILE 29 4.115 0.201 8.535
234 HG22 ILE 29 HG22 ILE 29 4.206 0.143 6.776
235 HG23 ILE 29 HG23 ILE 29 3.209 -1.023 7.646
236 HD11 ILE 29 HD11 ILE 29 4.821 -0.635 5.181
237 HD12 ILE 29 HD12 ILE 29 6.570 -0.825 5.295
238 HD13 ILE 29 HD13 ILE 29 5.616 -1.979 4.363
239 H ILE 30 H ILE 30 8.243 -0.728 6.125
240 HA ILE 30 HA ILE 30 10.179 -1.832 5.643
241 HB ILE 30 HB ILE 30 10.235 -2.772 8.507
242 HG12 ILE 30 HG12 ILE 30 10.042 -0.414 8.676
243 HG13 ILE 30 HG13 ILE 30 11.763 -0.758 8.824
244 HG21 ILE 30 HG21 ILE 30 12.030 -2.963 6.226
245 HG22 ILE 30 HG22 ILE 30 12.804 -2.286 7.658
246 HG23 ILE 30 HG23 ILE 30 12.023 -3.864 7.740
247 HD11 ILE 30 HD11 ILE 30 10.358 0.209 6.346
248 HD12 ILE 30 HD12 ILE 30 11.376 1.171 7.416
249 HD13 ILE 30 HD13 ILE 30 12.080 -0.148 6.481
Start of MODEL 8
1 H1 ARG 1 H GLY 1 -0.982 -8.734 2.049
2 HA ARG 1 HA2 GLY 1 0.006 -6.881 1.120
3 H TYR 2 H TYR 2 0.201 -4.575 1.324
4 HA TYR 2 HA TYR 2 -1.650 -3.302 3.198
5 HB2 TYR 2 HB2 TYR 2 1.336 -3.529 3.608
6 HB3 TYR 2 HB3 TYR 2 0.307 -2.416 4.501
7 HD1 TYR 2 HD1 TYR 2 1.091 -5.973 3.926
8 HD2 TYR 2 HD2 TYR 2 -1.085 -3.182 6.290
9 HE1 TYR 2 HE1 TYR 2 0.605 -7.744 5.561
10 HE2 TYR 2 HE2 TYR 2 -1.573 -4.947 7.932
11 HH TYR 2 HH TYR 2 -1.530 -7.967 7.454
12 H CYS 3 H CYS 3 1.559 -2.473 1.895
13 HA CYS 3 HA CYS 3 0.349 -0.062 0.710
14 HB2 CYS 3 HB2 CYS 3 2.594 -0.382 2.425
15 HB3 CYS 3 HB3 CYS 3 3.196 0.144 0.856
16 H GLN 4 H GLN 4 2.597 0.645 -0.851
17 HA GLN 4 HA GLN 4 2.458 -1.434 -2.929
18 HB2 GLN 4 HB2 GLN 4 3.281 1.334 -3.623
19 HB3 GLN 4 HB3 GLN 4 2.331 0.179 -4.546
20 HG2 GLN 4 HG2 GLN 4 1.323 1.681 -2.143
21 HG3 GLN 4 HG3 GLN 4 1.060 2.169 -3.817
22 HE21 GLN 4 HE21 GLN 4 -0.893 1.486 -1.789
23 HE22 GLN 4 HE22 GLN 4 -1.807 0.162 -2.416
24 H LYS 5 H LYS 5 4.256 -2.571 -2.051
25 HA LYS 5 HA LYS 5 6.483 -2.916 -1.510
26 HB2 LYS 5 HB2 LYS 5 6.317 -2.009 -4.365
27 HB3 LYS 5 HB3 LYS 5 7.874 -2.431 -3.666
28 HG2 LYS 5 HG2 LYS 5 7.466 -4.607 -3.842
29 HG3 LYS 5 HG3 LYS 5 5.861 -4.443 -3.123
30 HD2 LYS 5 HD2 LYS 5 4.849 -4.477 -5.121
31 HD3 LYS 5 HD3 LYS 5 6.020 -3.359 -5.824
32 HE2 LYS 5 HE2 LYS 5 7.393 -5.038 -6.555
33 HE3 LYS 5 HE3 LYS 5 6.894 -6.148 -5.278
34 HZ1 LYS 5 HZ1 LYS 5 6.044 -6.909 -7.368
35 HZ2 LYS 5 HZ2 LYS 5 5.333 -5.409 -7.693
36 HZ3 LYS 5 HZ3 LYS 5 4.743 -6.369 -6.431
37 H TRP 6 H TRP 6 5.888 -0.648 -0.220
38 HA TRP 6 HA TRP 6 6.991 1.751 -0.750
39 HB2 TRP 6 HB2 TRP 6 7.090 2.163 1.547
40 HB3 TRP 6 HB3 TRP 6 5.905 0.864 1.430
41 HD1 TRP 6 HD1 TRP 6 8.729 1.804 3.464
42 HE1 TRP 6 HE1 TRP 6 9.769 -0.222 4.660
43 HE3 TRP 6 HE3 TRP 6 6.559 -1.943 0.747
44 HZ2 TRP 6 HZ2 TRP 6 9.679 -3.039 4.479
45 HZ3 TRP 6 HZ3 TRP 6 7.089 -4.277 1.323
46 HH2 TRP 6 HH2 TRP 6 8.617 -4.810 3.150
47 H NLE 7 H NLE 7 8.652 -1.175 -0.030
48 HA NLE 7 HA NLE 7 11.222 -0.336 0.837
49 HB2 NLE 7 HB2 NLE 7 10.367 -2.674 0.745
50 HB3 NLE 7 HB3 NLE 7 10.617 -2.722 -0.998
51 HG2 NLE 7 HG2 NLE 7 12.926 -3.028 -0.784
52 HG3 NLE 7 HG3 NLE 7 13.083 -1.890 0.548
53 HD2 NLE 7 HD2 NLE 7 13.083 -3.590 2.092
54 HD3 NLE 7 HD3 NLE 7 11.553 -4.235 1.483
55 HE1 NLE 7 HE1 NLE 7 14.241 -4.746 0.311
56 HE2 NLE 7 HE2 NLE 7 13.329 -5.805 1.224
57 HE3 NLE 7 HE3 NLE 7 12.797 -5.352 -0.291
58 H TRP 8 H TRP 8 9.892 0.392 -2.264
59 HA TRP 8 HA TRP 8 11.983 0.425 -4.026
60 HB2 TRP 8 HB2 TRP 8 9.961 2.649 -3.671
61 HB3 TRP 8 HB3 TRP 8 10.895 2.316 -5.127
62 HD1 TRP 8 HD1 TRP 8 10.395 -0.928 -4.973
63 HE1 TRP 8 HE1 TRP 8 8.098 -1.810 -5.728
64 HE3 TRP 8 HE3 TRP 8 7.684 3.382 -4.519
65 HZ2 TRP 8 HZ2 TRP 8 5.483 -0.810 -6.084
66 HZ3 TRP 8 HZ3 TRP 8 5.290 3.335 -5.088
67 HH2 TRP 8 HH2 TRP 8 4.214 1.281 -5.854
68 H THR 9 H THR 9 13.304 2.298 -4.775
69 HA THR 9 HA THR 9 14.770 3.377 -2.530
70 HB THR 9 HB THR 9 16.144 4.434 -4.482
71 HG1 THR 9 HG1 THR 9 15.774 3.580 -6.461
72 HG21 THR 9 HG21 THR 9 16.513 2.264 -3.003
73 HG22 THR 9 HG22 THR 9 17.562 2.641 -4.370
74 HG23 THR 9 HG23 THR 9 16.262 1.462 -4.555
75 H CYS 10 H CYS 10 12.740 4.653 -1.946
76 HA CYS 10 HA CYS 10 11.604 6.716 -3.255
77 HB2 CYS 10 HB2 CYS 10 11.150 7.749 -1.165
78 HB3 CYS 10 HB3 CYS 10 11.226 6.018 -0.848
79 H ASP 11 H ASP 11 12.065 8.793 -3.845
80 HA ASP 11 HA ASP 11 14.453 10.143 -3.033
81 HB2 ASP 11 HB2 ASP 11 15.094 10.289 -5.632
82 HB3 ASP 11 HB3 ASP 11 15.759 9.058 -4.562
83 H SER 12 H SER 12 12.847 10.278 -6.185
84 HA SER 12 HA SER 12 11.949 12.996 -5.514
85 HB2 SER 12 HB2 SER 12 13.122 11.800 -7.894
86 HB3 SER 12 HB3 SER 12 11.627 12.660 -8.260
87 HG SER 12 HG SER 12 12.679 14.375 -6.855
88 H LYS 13 H LYS 13 10.822 10.639 -7.921
89 HA LYS 13 HA LYS 13 8.173 11.352 -7.940
90 HB2 LYS 13 HB2 LYS 13 9.280 8.557 -8.266
91 HB3 LYS 13 HB3 LYS 13 7.700 9.102 -8.811
92 HG2 LYS 13 HG2 LYS 13 8.706 10.599 -10.401
93 HG3 LYS 13 HG3 LYS 13 10.319 10.216 -9.791
94 HD2 LYS 13 HD2 LYS 13 10.270 8.801 -11.577
95 HD3 LYS 13 HD3 LYS 13 9.529 7.745 -10.373
96 HE2 LYS 13 HE2 LYS 13 7.952 7.515 -11.978
97 HE3 LYS 13 HE3 LYS 13 7.339 9.009 -11.267
98 HZ1 LYS 13 HZ1 LYS 13 8.301 8.559 -13.883
99 HZ2 LYS 13 HZ2 LYS 13 9.254 9.739 -13.134
100 HZ3 LYS 13 HZ3 LYS 13 7.578 9.947 -13.243
101 H ARG 14 H ARG 14 9.638 8.774 -5.960
102 HA ARG 14 HA ARG 14 8.876 7.658 -4.122
103 HB2 ARG 14 HB2 ARG 14 7.753 10.393 -3.485
104 HB3 ARG 14 HB3 ARG 14 8.004 9.093 -2.328
105 HG2 ARG 14 HG2 ARG 14 10.187 9.530 -2.124
106 HG3 ARG 14 HG3 ARG 14 10.393 9.805 -3.856
107 HD2 ARG 14 HD2 ARG 14 10.591 11.970 -3.365
108 HD3 ARG 14 HD3 ARG 14 8.862 11.951 -3.019
109 HE ARG 14 HE ARG 14 11.021 12.061 -1.105
110 HH11 ARG 14 HH11 ARG 14 7.651 11.377 -1.643
111 HH12 ARG 14 HH12 ARG 14 7.202 11.623 0.011
112 HH21 ARG 14 HH21 ARG 14 10.443 12.387 1.078
113 HH22 ARG 14 HH22 ARG 14 8.789 12.199 1.559
114 H ALA 15 H ALA 15 7.417 6.346 -5.364
115 HA ALA 15 HA ALA 15 4.625 7.143 -5.468
116 HB1 ALA 15 HB1 ALA 15 6.110 4.727 -6.473
117 HB2 ALA 15 HB2 ALA 15 4.354 4.880 -6.560
118 HB3 ALA 15 HB3 ALA 15 5.382 6.031 -7.412
119 H CYS 16 H CYS 16 6.341 6.282 -2.984
120 HA CYS 16 HA CYS 16 4.925 4.000 -1.973
121 HB2 CYS 16 HB2 CYS 16 6.714 5.974 -0.541
122 HB3 CYS 16 HB3 CYS 16 6.152 4.439 0.115
123 H CYS 17 H CYS 17 4.056 4.318 0.421
124 HA CYS 17 HA CYS 17 2.116 6.533 0.312
125 HB2 CYS 17 HB2 CYS 17 1.202 4.502 2.077
126 HB3 CYS 17 HB3 CYS 17 0.500 5.008 0.543
127 H GLU 18 H GLU 18 4.480 4.851 2.209
128 HA GLU 18 HA GLU 18 4.544 6.999 4.122
129 HB2 GLU 18 HB2 GLU 18 2.781 5.714 5.139
130 HB3 GLU 18 HB3 GLU 18 3.702 4.226 4.970
131 HG2 GLU 18 HG2 GLU 18 4.587 4.533 6.967
132 HG3 GLU 18 HG3 GLU 18 5.281 6.065 6.439
133 H GLY 19 H GLY 19 6.611 7.370 4.565
134 HA2 GLY 19 HA2 GLY 19 8.709 6.591 5.487
135 HA3 GLY 19 HA3 GLY 19 8.467 5.079 4.624
136 H LEU 20 H LEU 20 7.514 7.387 2.526
137 HA LEU 20 HA LEU 20 9.747 7.069 0.830
138 HB2 LEU 20 HB2 LEU 20 8.598 9.108 -0.344
139 HB3 LEU 20 HB3 LEU 20 7.856 7.509 -0.365
140 HG LEU 20 HG LEU 20 6.358 9.542 0.083
141 HD11 LEU 20 HD11 LEU 20 6.365 6.876 1.128
142 HD12 LEU 20 HD12 LEU 20 5.003 7.871 0.615
143 HD13 LEU 20 HD13 LEU 20 5.591 7.971 2.275
144 HD21 LEU 20 HD21 LEU 20 7.272 9.232 2.914
145 HD22 LEU 20 HD22 LEU 20 6.345 10.538 2.173
146 HD23 LEU 20 HD23 LEU 20 8.069 10.379 1.837
147 H ARG 21 H ARG 21 9.350 8.993 3.534
148 HA ARG 21 HA ARG 21 10.939 11.233 2.645
149 HB2 ARG 21 HB2 ARG 21 10.746 12.030 4.936
150 HB3 ARG 21 HB3 ARG 21 9.172 11.524 4.335
151 HG2 ARG 21 HG2 ARG 21 8.946 9.991 5.929
152 HG3 ARG 21 HG3 ARG 21 10.582 9.376 5.682
153 HD2 ARG 21 HD2 ARG 21 11.169 11.695 6.876
154 HD3 ARG 21 HD3 ARG 21 9.576 11.414 7.579
155 HE ARG 21 HE ARG 21 11.210 9.091 7.743
156 HH11 ARG 21 HH11 ARG 21 10.654 12.207 9.193
157 HH12 ARG 21 HH12 ARG 21 11.268 11.740 10.744
158 HH21 ARG 21 HH21 ARG 21 12.022 8.465 9.780
159 HH22 ARG 21 HH22 ARG 21 12.048 9.610 11.075
160 H CYS 22 H CYS 22 12.332 8.929 2.150
161 HA CYS 22 HA CYS 22 14.515 9.098 4.118
162 HB2 CYS 22 HB2 CYS 22 14.961 6.741 3.873
163 HB3 CYS 22 HB3 CYS 22 13.265 6.943 4.296
164 H LYS 23 H LYS 23 16.187 7.293 2.617
165 HA LYS 23 HA LYS 23 16.969 9.124 0.464
166 HB2 LYS 23 HB2 LYS 23 18.500 8.255 2.446
167 HB3 LYS 23 HB3 LYS 23 18.716 6.881 1.368
168 HG2 LYS 23 HG2 LYS 23 20.285 8.013 0.298
169 HG3 LYS 23 HG3 LYS 23 19.062 9.183 -0.205
170 HD2 LYS 23 HD2 LYS 23 20.617 9.289 2.378
171 HD3 LYS 23 HD3 LYS 23 20.969 10.247 0.937
172 HE2 LYS 23 HE2 LYS 23 19.468 11.766 1.545
173 HE3 LYS 23 HE3 LYS 23 18.206 10.536 1.607
174 HZ1 LYS 23 HZ1 LYS 23 19.242 11.929 3.731
175 HZ2 LYS 23 HZ2 LYS 23 19.922 10.386 3.874
176 HZ3 LYS 23 HZ3 LYS 23 18.243 10.566 3.811
177 H LEU 24 H LEU 24 16.278 5.732 1.133
178 HA LEU 24 HA LEU 24 15.836 5.316 -1.729
179 HB2 LEU 24 HB2 LEU 24 17.843 3.954 -0.037
180 HB3 LEU 24 HB3 LEU 24 16.907 2.930 -1.123
181 HG LEU 24 HG LEU 24 17.643 4.471 -2.995
182 HD11 LEU 24 HD11 LEU 24 18.854 5.808 -0.745
183 HD12 LEU 24 HD12 LEU 24 18.679 6.347 -2.415
184 HD13 LEU 24 HD13 LEU 24 20.063 5.360 -1.949
185 HD21 LEU 24 HD21 LEU 24 19.589 3.236 -3.374
186 HD22 LEU 24 HD22 LEU 24 18.613 2.191 -2.342
187 HD23 LEU 24 HD23 LEU 24 19.955 3.106 -1.655
188 H TRP 25 H TRP 25 16.051 2.704 0.562
189 HA TRP 25 HA TRP 25 13.472 1.749 0.021
190 HB2 TRP 25 HB2 TRP 25 14.379 -0.032 1.020
191 HB3 TRP 25 HB3 TRP 25 15.718 0.952 1.604
192 HD1 TRP 25 HD1 TRP 25 12.219 -0.246 2.697
193 HE1 TRP 25 HE1 TRP 25 12.114 -0.178 5.268
194 HE3 TRP 25 HE3 TRP 25 16.738 1.950 3.639
195 HZ2 TRP 25 HZ2 TRP 25 13.732 0.690 7.410
196 HZ3 TRP 25 HZ3 TRP 25 17.384 2.365 5.976
197 HH2 TRP 25 HH2 TRP 25 15.911 1.748 7.823
198 H CYS 26 H CYS 26 11.630 2.737 0.514
199 HA CYS 26 HA CYS 26 11.182 4.824 2.198
200 HB2 CYS 26 HB2 CYS 26 9.357 2.554 1.426
201 HB3 CYS 26 HB3 CYS 26 8.795 3.920 2.380
202 H ARG 27 H ARG 27 11.083 5.170 4.328
203 HA ARG 27 HA ARG 27 11.658 2.978 6.122
204 HB2 ARG 27 HB2 ARG 27 11.267 5.931 6.649
205 HB3 ARG 27 HB3 ARG 27 11.782 4.753 7.849
206 HG2 ARG 27 HG2 ARG 27 13.855 4.436 6.824
207 HG3 ARG 27 HG3 ARG 27 13.317 5.167 5.310
208 HD2 ARG 27 HD2 ARG 27 13.113 7.337 6.489
209 HD3 ARG 27 HD3 ARG 27 13.773 6.579 7.936
210 HE ARG 27 HE ARG 27 15.641 6.066 6.039
211 HH11 ARG 27 HH11 ARG 27 14.074 8.964 7.160
212 HH12 ARG 27 HH12 ARG 27 15.426 9.988 6.811
213 HH21 ARG 27 HH21 ARG 27 17.430 7.403 5.575
214 HH22 ARG 27 HH22 ARG 27 17.336 9.098 5.909
215 H LYS 28 H LYS 28 9.717 1.772 5.971
216 HA LYS 28 HA LYS 28 7.486 2.959 7.485
217 HB2 LYS 28 HB2 LYS 28 7.250 2.455 4.879
218 HB3 LYS 28 HB3 LYS 28 6.918 0.833 5.477
219 HG2 LYS 28 HG2 LYS 28 5.313 2.309 7.082
220 HG3 LYS 28 HG3 LYS 28 5.283 3.265 5.598
221 HD2 LYS 28 HD2 LYS 28 4.537 0.366 5.941
222 HD3 LYS 28 HD3 LYS 28 3.480 1.705 5.487
223 HE2 LYS 28 HE2 LYS 28 5.754 0.567 3.862
224 HE3 LYS 28 HE3 LYS 28 4.032 0.383 3.533
225 HZ1 LYS 28 HZ1 LYS 28 4.586 2.100 2.146
226 HZ2 LYS 28 HZ2 LYS 28 5.744 2.746 3.197
227 HZ3 LYS 28 HZ3 LYS 28 4.097 2.969 3.514
228 H ILE 29 H ILE 29 6.252 0.158 6.919
229 HA ILE 29 HA ILE 29 6.677 -0.960 9.420
230 HB ILE 29 HB ILE 29 5.546 -2.900 8.670
231 HG12 ILE 29 HG12 ILE 29 7.021 -3.329 6.709
232 HG13 ILE 29 HG13 ILE 29 5.311 -3.540 6.344
233 HG21 ILE 29 HG21 ILE 29 3.712 -1.663 8.509
234 HG22 ILE 29 HG22 ILE 29 4.642 -0.289 7.914
235 HG23 ILE 29 HG23 ILE 29 4.020 -1.489 6.781
236 HD11 ILE 29 HD11 ILE 29 5.293 -1.287 5.338
237 HD12 ILE 29 HD12 ILE 29 7.031 -1.184 5.619
238 HD13 ILE 29 HD13 ILE 29 6.385 -2.408 4.528
239 H ILE 30 H ILE 30 8.646 -1.100 6.599
240 HA ILE 30 HA ILE 30 10.726 -1.959 6.243
241 HB ILE 30 HB ILE 30 10.690 -2.906 9.106
242 HG12 ILE 30 HG12 ILE 30 10.274 -0.612 9.332
243 HG13 ILE 30 HG13 ILE 30 12.027 -0.716 9.434
244 HG21 ILE 30 HG21 ILE 30 12.495 -3.410 7.118
245 HG22 ILE 30 HG22 ILE 30 13.191 -1.993 7.906
246 HG23 ILE 30 HG23 ILE 30 12.846 -3.444 8.844
247 HD11 ILE 30 HD11 ILE 30 10.368 0.180 7.097
248 HD12 ILE 30 HD12 ILE 30 11.512 1.126 8.050
249 HD13 ILE 30 HD13 ILE 30 12.096 -0.158 6.991
Start of MODEL 9
1 H1 ARG 1 H GLY 1 0.622 -8.630 1.748
2 HA ARG 1 HA2 GLY 1 1.426 -6.987 0.126
3 H TYR 2 H TYR 2 0.523 -5.585 2.655
4 HA TYR 2 HA TYR 2 -1.114 -3.402 1.923
5 HB2 TYR 2 HB2 TYR 2 0.787 -3.921 4.188
6 HB3 TYR 2 HB3 TYR 2 0.055 -2.334 3.988
7 HD1 TYR 2 HD1 TYR 2 -1.055 -5.911 3.931
8 HD2 TYR 2 HD2 TYR 2 -1.826 -1.941 5.250
9 HE1 TYR 2 HE1 TYR 2 -3.066 -6.699 5.104
10 HE2 TYR 2 HE2 TYR 2 -3.840 -2.718 6.430
11 HH TYR 2 HH TYR 2 -5.341 -5.512 5.856
12 H CYS 3 H CYS 3 -0.358 -1.103 1.962
13 HA CYS 3 HA CYS 3 0.767 0.571 0.905
14 HB2 CYS 3 HB2 CYS 3 2.883 -1.083 2.190
15 HB3 CYS 3 HB3 CYS 3 3.402 0.146 1.039
16 H GLN 4 H GLN 4 2.954 0.775 -0.662
17 HA GLN 4 HA GLN 4 2.493 -1.166 -2.827
18 HB2 GLN 4 HB2 GLN 4 3.299 1.605 -3.530
19 HB3 GLN 4 HB3 GLN 4 2.275 0.475 -4.408
20 HG2 GLN 4 HG2 GLN 4 1.422 1.892 -1.898
21 HG3 GLN 4 HG3 GLN 4 1.117 2.501 -3.523
22 HE21 GLN 4 HE21 GLN 4 -1.007 2.113 -1.969
23 HE22 GLN 4 HE22 GLN 4 -1.895 0.715 -2.454
24 H LYS 5 H LYS 5 4.324 -2.352 -2.167
25 HA LYS 5 HA LYS 5 6.574 -2.761 -1.800
26 HB2 LYS 5 HB2 LYS 5 6.223 -1.669 -4.564
27 HB3 LYS 5 HB3 LYS 5 7.836 -2.085 -4.002
28 HG2 LYS 5 HG2 LYS 5 7.249 -4.357 -3.709
29 HG3 LYS 5 HG3 LYS 5 5.531 -4.009 -3.911
30 HD2 LYS 5 HD2 LYS 5 5.941 -3.367 -6.242
31 HD3 LYS 5 HD3 LYS 5 7.657 -3.724 -6.034
32 HE2 LYS 5 HE2 LYS 5 6.726 -5.622 -7.083
33 HE3 LYS 5 HE3 LYS 5 6.949 -6.069 -5.391
34 HZ1 LYS 5 HZ1 LYS 5 4.766 -6.710 -6.410
35 HZ2 LYS 5 HZ2 LYS 5 4.374 -5.065 -6.460
36 HZ3 LYS 5 HZ3 LYS 5 4.656 -5.821 -4.974
37 H TRP 6 H TRP 6 6.060 -0.568 -0.328
38 HA TRP 6 HA TRP 6 7.180 1.843 -0.744
39 HB2 TRP 6 HB2 TRP 6 7.386 2.099 1.569
40 HB3 TRP 6 HB3 TRP 6 6.180 0.823 1.420
41 HD1 TRP 6 HD1 TRP 6 9.099 1.595 3.385
42 HE1 TRP 6 HE1 TRP 6 10.169 -0.518 4.393
43 HE3 TRP 6 HE3 TRP 6 6.780 -1.939 0.509
44 HZ2 TRP 6 HZ2 TRP 6 10.047 -3.313 4.017
45 HZ3 TRP 6 HZ3 TRP 6 7.311 -4.310 0.897
46 HH2 TRP 6 HH2 TRP 6 8.913 -4.980 2.614
47 H NLE 7 H NLE 7 8.819 -1.148 -0.333
48 HA NLE 7 HA NLE 7 11.436 -0.438 0.489
49 HB2 NLE 7 HB2 NLE 7 10.522 -2.743 0.191
50 HB3 NLE 7 HB3 NLE 7 10.727 -2.620 -1.554
51 HG2 NLE 7 HG2 NLE 7 13.035 -2.976 -1.437
52 HG3 NLE 7 HG3 NLE 7 13.246 -1.988 0.005
53 HD2 NLE 7 HD2 NLE 7 13.295 -3.851 1.338
54 HD3 NLE 7 HD3 NLE 7 11.702 -4.367 0.770
55 HE1 NLE 7 HE1 NLE 7 14.284 -4.866 -0.623
56 HE2 NLE 7 HE2 NLE 7 13.381 -5.974 0.238
57 HE3 NLE 7 HE3 NLE 7 12.779 -5.344 -1.185
58 H TRP 8 H TRP 8 9.997 0.573 -2.493
59 HA TRP 8 HA TRP 8 12.082 0.772 -4.277
60 HB2 TRP 8 HB2 TRP 8 9.972 2.885 -3.784
61 HB3 TRP 8 HB3 TRP 8 10.907 2.668 -5.262
62 HD1 TRP 8 HD1 TRP 8 10.528 -0.599 -5.274
63 HE1 TRP 8 HE1 TRP 8 8.262 -1.522 -6.068
64 HE3 TRP 8 HE3 TRP 8 7.666 3.581 -4.592
65 HZ2 TRP 8 HZ2 TRP 8 5.610 -0.602 -6.365
66 HZ3 TRP 8 HZ3 TRP 8 5.273 3.477 -5.158
67 HH2 TRP 8 HH2 TRP 8 4.270 1.428 -6.026
68 H THR 9 H THR 9 13.180 2.891 -4.931
69 HA THR 9 HA THR 9 14.686 3.819 -2.633
70 HB THR 9 HB THR 9 16.045 3.288 -4.499
71 HG1 THR 9 HG1 THR 9 16.964 5.370 -4.985
72 HG21 THR 9 HG21 THR 9 15.048 3.277 -6.507
73 HG22 THR 9 HG22 THR 9 15.447 4.994 -6.583
74 HG23 THR 9 HG23 THR 9 13.859 4.482 -6.012
75 H CYS 10 H CYS 10 12.726 4.943 -1.777
76 HA CYS 10 HA CYS 10 11.324 6.994 -2.818
77 HB2 CYS 10 HB2 CYS 10 11.204 7.979 -0.582
78 HB3 CYS 10 HB3 CYS 10 11.089 6.225 -0.493
79 H ASP 11 H ASP 11 11.719 8.904 -3.721
80 HA ASP 11 HA ASP 11 13.593 10.781 -2.893
81 HB2 ASP 11 HB2 ASP 11 14.745 8.673 -4.471
82 HB3 ASP 11 HB3 ASP 11 14.839 10.191 -5.360
83 H SER 12 H SER 12 12.911 9.660 -6.201
84 HA SER 12 HA SER 12 11.722 12.279 -6.767
85 HB2 SER 12 HB2 SER 12 12.009 10.519 -9.063
86 HB3 SER 12 HB3 SER 12 12.673 12.131 -8.798
87 HG SER 12 HG SER 12 14.000 9.895 -8.832
88 H LYS 13 H LYS 13 11.118 8.847 -7.521
89 HA LYS 13 HA LYS 13 8.583 9.074 -8.582
90 HB2 LYS 13 HB2 LYS 13 9.754 6.872 -6.878
91 HB3 LYS 13 HB3 LYS 13 8.227 6.731 -7.739
92 HG2 LYS 13 HG2 LYS 13 9.228 6.592 -9.783
93 HG3 LYS 13 HG3 LYS 13 10.638 7.526 -9.281
94 HD2 LYS 13 HD2 LYS 13 11.695 5.705 -8.382
95 HD3 LYS 13 HD3 LYS 13 10.181 4.877 -8.008
96 HE2 LYS 13 HE2 LYS 13 10.940 5.324 -10.859
97 HE3 LYS 13 HE3 LYS 13 11.727 4.034 -9.951
98 HZ1 LYS 13 HZ1 LYS 13 9.612 3.040 -9.507
99 HZ2 LYS 13 HZ2 LYS 13 9.731 3.303 -11.174
100 HZ3 LYS 13 HZ3 LYS 13 8.786 4.332 -10.221
101 H ARG 14 H ARG 14 9.424 8.505 -5.164
102 HA ARG 14 HA ARG 14 8.218 8.746 -3.244
103 HB2 ARG 14 HB2 ARG 14 8.134 11.157 -4.670
104 HB3 ARG 14 HB3 ARG 14 6.490 10.901 -4.104
105 HG2 ARG 14 HG2 ARG 14 7.201 10.807 -1.835
106 HG3 ARG 14 HG3 ARG 14 8.900 10.768 -2.311
107 HD2 ARG 14 HD2 ARG 14 8.043 13.049 -3.527
108 HD3 ARG 14 HD3 ARG 14 7.053 13.036 -2.067
109 HE ARG 14 HE ARG 14 9.662 12.508 -1.284
110 HH11 ARG 14 HH11 ARG 14 7.882 15.099 -2.782
111 HH12 ARG 14 HH12 ARG 14 8.908 16.343 -2.150
112 HH21 ARG 14 HH21 ARG 14 11.019 14.136 -0.445
113 HH22 ARG 14 HH22 ARG 14 10.694 15.795 -0.821
114 H ALA 15 H ALA 15 7.148 6.904 -5.162
115 HA ALA 15 HA ALA 15 4.263 7.248 -5.071
116 HB1 ALA 15 HB1 ALA 15 4.209 5.135 -6.352
117 HB2 ALA 15 HB2 ALA 15 5.206 6.376 -7.113
118 HB3 ALA 15 HB3 ALA 15 5.968 5.049 -6.234
119 H CYS 16 H CYS 16 6.266 6.537 -2.751
120 HA CYS 16 HA CYS 16 5.341 4.005 -1.798
121 HB2 CYS 16 HB2 CYS 16 6.921 6.245 -0.550
122 HB3 CYS 16 HB3 CYS 16 6.436 4.826 0.373
123 H CYS 17 H CYS 17 4.764 4.369 0.842
124 HA CYS 17 HA CYS 17 2.137 5.675 0.698
125 HB2 CYS 17 HB2 CYS 17 2.066 4.240 3.009
126 HB3 CYS 17 HB3 CYS 17 1.545 3.623 1.445
127 H GLU 18 H GLU 18 4.074 4.888 3.550
128 HA GLU 18 HA GLU 18 4.262 7.747 4.186
129 HB2 GLU 18 HB2 GLU 18 2.416 6.127 5.392
130 HB3 GLU 18 HB3 GLU 18 3.773 6.008 6.503
131 HG2 GLU 18 HG2 GLU 18 3.770 8.626 6.259
132 HG3 GLU 18 HG3 GLU 18 2.089 8.351 5.808
133 H GLY 19 H GLY 19 6.241 5.916 3.163
134 HA2 GLY 19 HA2 GLY 19 8.150 6.063 5.403
135 HA3 GLY 19 HA3 GLY 19 8.035 4.601 4.436
136 H LEU 20 H LEU 20 7.474 7.324 2.554
137 HA LEU 20 HA LEU 20 9.876 6.952 1.074
138 HB2 LEU 20 HB2 LEU 20 9.022 9.150 -0.031
139 HB3 LEU 20 HB3 LEU 20 8.157 7.635 -0.274
140 HG LEU 20 HG LEU 20 6.804 9.771 0.191
141 HD11 LEU 20 HD11 LEU 20 5.342 8.088 0.267
142 HD12 LEU 20 HD12 LEU 20 5.500 8.202 2.019
143 HD13 LEU 20 HD13 LEU 20 6.466 7.032 1.125
144 HD21 LEU 20 HD21 LEU 20 7.329 9.099 3.061
145 HD22 LEU 20 HD22 LEU 20 6.604 10.551 2.366
146 HD23 LEU 20 HD23 LEU 20 8.340 10.271 2.210
147 H ARG 21 H ARG 21 9.316 8.520 3.933
148 HA ARG 21 HA ARG 21 10.967 10.833 3.552
149 HB2 ARG 21 HB2 ARG 21 10.780 11.102 5.986
150 HB3 ARG 21 HB3 ARG 21 9.209 10.825 5.245
151 HG2 ARG 21 HG2 ARG 21 8.874 8.932 6.381
152 HG3 ARG 21 HG3 ARG 21 10.532 8.379 6.135
153 HD2 ARG 21 HD2 ARG 21 10.411 8.687 8.434
154 HD3 ARG 21 HD3 ARG 21 11.153 10.184 7.868
155 HE ARG 21 HE ARG 21 9.292 11.331 8.557
156 HH11 ARG 21 HH11 ARG 21 8.588 7.921 8.493
157 HH12 ARG 21 HH12 ARG 21 7.053 8.090 9.278
158 HH21 ARG 21 HH21 ARG 21 7.273 11.565 9.593
159 HH22 ARG 21 HH22 ARG 21 6.306 10.164 9.904
160 H CYS 22 H CYS 22 12.499 8.952 2.543
161 HA CYS 22 HA CYS 22 14.681 8.749 4.471
162 HB2 CYS 22 HB2 CYS 22 15.084 6.425 4.083
163 HB3 CYS 22 HB3 CYS 22 13.385 6.588 4.509
164 H LYS 23 H LYS 23 16.295 7.097 2.788
165 HA LYS 23 HA LYS 23 16.958 9.070 0.726
166 HB2 LYS 23 HB2 LYS 23 18.584 8.043 2.561
167 HB3 LYS 23 HB3 LYS 23 18.751 6.773 1.356
168 HG2 LYS 23 HG2 LYS 23 20.159 8.009 0.181
169 HG3 LYS 23 HG3 LYS 23 18.994 9.332 0.098
170 HD2 LYS 23 HD2 LYS 23 20.558 8.894 2.606
171 HD3 LYS 23 HD3 LYS 23 21.321 9.697 1.231
172 HE2 LYS 23 HE2 LYS 23 20.212 11.593 1.618
173 HE3 LYS 23 HE3 LYS 23 18.674 10.748 1.761
174 HZ1 LYS 23 HZ1 LYS 23 19.005 11.705 3.838
175 HZ2 LYS 23 HZ2 LYS 23 20.655 11.335 3.872
176 HZ3 LYS 23 HZ3 LYS 23 19.506 10.106 4.068
177 H LEU 24 H LEU 24 16.649 5.550 1.140
178 HA LEU 24 HA LEU 24 15.974 5.369 -1.719
179 HB2 LEU 24 HB2 LEU 24 18.002 3.886 -0.162
180 HB3 LEU 24 HB3 LEU 24 17.042 2.946 -1.303
181 HG LEU 24 HG LEU 24 17.823 4.283 -3.143
182 HD11 LEU 24 HD11 LEU 24 18.775 6.056 -0.975
183 HD12 LEU 24 HD12 LEU 24 18.106 6.451 -2.558
184 HD13 LEU 24 HD13 LEU 24 19.785 5.930 -2.415
185 HD21 LEU 24 HD21 LEU 24 19.672 3.060 -3.276
186 HD22 LEU 24 HD22 LEU 24 19.429 2.612 -1.587
187 HD23 LEU 24 HD23 LEU 24 20.450 3.992 -1.997
188 H TRP 25 H TRP 25 16.219 2.615 0.394
189 HA TRP 25 HA TRP 25 13.620 1.714 -0.156
190 HB2 TRP 25 HB2 TRP 25 14.584 -0.131 0.660
191 HB3 TRP 25 HB3 TRP 25 15.892 0.816 1.364
192 HD1 TRP 25 HD1 TRP 25 12.330 -0.398 2.265
193 HE1 TRP 25 HE1 TRP 25 12.190 -0.628 4.825
194 HE3 TRP 25 HE3 TRP 25 16.937 1.442 3.496
195 HZ2 TRP 25 HZ2 TRP 25 13.818 -0.098 7.069
196 HZ3 TRP 25 HZ3 TRP 25 17.569 1.548 5.873
197 HH2 TRP 25 HH2 TRP 25 16.041 0.794 7.620
198 H CYS 26 H CYS 26 11.814 2.718 0.434
199 HA CYS 26 HA CYS 26 11.389 4.679 2.236
200 HB2 CYS 26 HB2 CYS 26 9.579 2.403 1.447
201 HB3 CYS 26 HB3 CYS 26 9.032 3.699 2.506
202 H ARG 27 H ARG 27 11.376 4.946 4.380
203 HA ARG 27 HA ARG 27 12.028 2.670 6.059
204 HB2 ARG 27 HB2 ARG 27 11.991 5.645 6.455
205 HB3 ARG 27 HB3 ARG 27 12.071 4.567 7.841
206 HG2 ARG 27 HG2 ARG 27 14.167 3.746 7.235
207 HG3 ARG 27 HG3 ARG 27 14.013 4.320 5.575
208 HD2 ARG 27 HD2 ARG 27 15.475 5.855 6.508
209 HD3 ARG 27 HD3 ARG 27 13.919 6.670 6.653
210 HE ARG 27 HE ARG 27 14.084 6.511 8.936
211 HH11 ARG 27 HH11 ARG 27 16.447 4.427 7.459
212 HH12 ARG 27 HH12 ARG 27 17.256 4.071 8.948
213 HH21 ARG 27 HH21 ARG 27 15.139 6.050 10.903
214 HH22 ARG 27 HH22 ARG 27 16.512 4.995 10.908
215 H LYS 28 H LYS 28 9.436 2.568 4.984
216 HA LYS 28 HA LYS 28 7.532 3.495 6.923
217 HB2 LYS 28 HB2 LYS 28 7.434 2.527 4.284
218 HB3 LYS 28 HB3 LYS 28 6.526 1.371 5.249
219 HG2 LYS 28 HG2 LYS 28 5.882 4.134 5.892
220 HG3 LYS 28 HG3 LYS 28 5.564 3.719 4.206
221 HD2 LYS 28 HD2 LYS 28 3.654 2.800 4.889
222 HD3 LYS 28 HD3 LYS 28 4.619 1.542 5.665
223 HE2 LYS 28 HE2 LYS 28 3.525 4.069 6.877
224 HE3 LYS 28 HE3 LYS 28 3.168 2.404 7.328
225 HZ1 LYS 28 HZ1 LYS 28 5.661 3.927 7.800
226 HZ2 LYS 28 HZ2 LYS 28 5.602 2.241 7.925
227 HZ3 LYS 28 HZ3 LYS 28 4.647 3.196 8.942
228 H ILE 29 H ILE 29 5.990 0.912 6.655
229 HA ILE 29 HA ILE 29 6.487 -0.168 9.149
230 HB ILE 29 HB ILE 29 5.053 -1.962 8.589
231 HG12 ILE 29 HG12 ILE 29 6.262 -2.706 6.566
232 HG13 ILE 29 HG13 ILE 29 4.522 -2.625 6.301
233 HG21 ILE 29 HG21 ILE 29 4.426 0.706 7.860
234 HG22 ILE 29 HG22 ILE 29 3.630 -0.373 6.716
235 HG23 ILE 29 HG23 ILE 29 3.343 -0.556 8.446
236 HD11 ILE 29 HD11 ILE 29 6.633 -0.731 5.322
237 HD12 ILE 29 HD12 ILE 29 5.538 -1.738 4.374
238 HD13 ILE 29 HD13 ILE 29 4.911 -0.359 5.273
239 H ILE 30 H ILE 30 8.243 -0.600 6.248
240 HA ILE 30 HA ILE 30 10.166 -1.734 5.786
241 HB ILE 30 HB ILE 30 10.141 -2.663 8.657
242 HG12 ILE 30 HG12 ILE 30 10.066 -0.318 8.841
243 HG13 ILE 30 HG13 ILE 30 11.784 -0.697 8.917
244 HG21 ILE 30 HG21 ILE 30 12.086 -2.763 6.429
245 HG22 ILE 30 HG22 ILE 30 12.721 -2.427 8.039
246 HG23 ILE 30 HG23 ILE 30 11.804 -3.906 7.741
247 HD11 ILE 30 HD11 ILE 30 10.270 0.342 6.535
248 HD12 ILE 30 HD12 ILE 30 11.451 1.214 7.514
249 HD13 ILE 30 HD13 ILE 30 11.965 -0.144 6.516
Start of MODEL 10
1 H1 ARG 1 H GLY 1 1.390 -7.205 3.572
2 HA ARG 1 HA2 GLY 1 1.316 -6.757 1.317
3 H TYR 2 H TYR 2 0.760 -4.687 3.237
4 HA TYR 2 HA TYR 2 -1.288 -3.056 1.941
5 HB2 TYR 2 HB2 TYR 2 0.351 -2.512 4.427
6 HB3 TYR 2 HB3 TYR 2 -0.975 -1.519 3.832
7 HD1 TYR 2 HD1 TYR 2 -0.291 -3.535 6.394
8 HD2 TYR 2 HD2 TYR 2 -3.066 -3.362 3.172
9 HE1 TYR 2 HE1 TYR 2 -1.880 -4.883 7.700
10 HE2 TYR 2 HE2 TYR 2 -4.664 -4.708 4.470
11 HH TYR 2 HH TYR 2 -5.019 -5.092 7.125
12 H CYS 3 H CYS 3 -0.721 -0.680 1.678
13 HA CYS 3 HA CYS 3 0.449 0.921 0.567
14 HB2 CYS 3 HB2 CYS 3 2.357 -0.346 2.367
15 HB3 CYS 3 HB3 CYS 3 3.141 0.338 0.947
16 H GLN 4 H GLN 4 2.816 0.947 -0.819
17 HA GLN 4 HA GLN 4 2.467 -1.199 -2.806
18 HB2 GLN 4 HB2 GLN 4 3.459 1.451 -3.709
19 HB3 GLN 4 HB3 GLN 4 2.457 0.278 -4.552
20 HG2 GLN 4 HG2 GLN 4 1.470 1.983 -2.283
21 HG3 GLN 4 HG3 GLN 4 1.327 2.427 -3.982
22 HE21 GLN 4 HE21 GLN 4 -0.799 2.021 -2.108
23 HE22 GLN 4 HE22 GLN 4 -1.763 0.720 -2.708
24 H LYS 5 H LYS 5 4.178 -2.390 -1.906
25 HA LYS 5 HA LYS 5 6.369 -2.828 -1.278
26 HB2 LYS 5 HB2 LYS 5 6.240 -2.102 -4.168
27 HB3 LYS 5 HB3 LYS 5 7.822 -2.392 -3.458
28 HG2 LYS 5 HG2 LYS 5 7.499 -4.550 -3.835
29 HG3 LYS 5 HG3 LYS 5 6.252 -4.518 -2.586
30 HD2 LYS 5 HD2 LYS 5 5.056 -5.364 -4.353
31 HD3 LYS 5 HD3 LYS 5 4.753 -3.637 -4.555
32 HE2 LYS 5 HE2 LYS 5 5.963 -3.517 -6.458
33 HE3 LYS 5 HE3 LYS 5 7.166 -4.676 -5.890
34 HZ1 LYS 5 HZ1 LYS 5 4.903 -6.162 -6.205
35 HZ2 LYS 5 HZ2 LYS 5 6.210 -6.102 -7.279
36 HZ3 LYS 5 HZ3 LYS 5 4.865 -5.108 -7.528
37 H TRP 6 H TRP 6 5.924 -0.544 -0.029
38 HA TRP 6 HA TRP 6 7.094 1.808 -0.584
39 HB2 TRP 6 HB2 TRP 6 7.263 2.218 1.706
40 HB3 TRP 6 HB3 TRP 6 6.048 0.943 1.631
41 HD1 TRP 6 HD1 TRP 6 8.913 1.831 3.608
42 HE1 TRP 6 HE1 TRP 6 9.964 -0.212 4.765
43 HE3 TRP 6 HE3 TRP 6 6.687 -1.879 0.884
44 HZ2 TRP 6 HZ2 TRP 6 9.865 -3.025 4.551
45 HZ3 TRP 6 HZ3 TRP 6 7.219 -4.219 1.423
46 HH2 TRP 6 HH2 TRP 6 8.774 -4.779 3.219
47 H NLE 7 H NLE 7 8.677 -1.173 0.053
48 HA NLE 7 HA NLE 7 11.305 -0.410 0.848
49 HB2 NLE 7 HB2 NLE 7 10.366 -2.719 0.812
50 HB3 NLE 7 HB3 NLE 7 10.557 -2.795 -0.937
51 HG2 NLE 7 HG2 NLE 7 12.871 -3.142 -0.803
52 HG3 NLE 7 HG3 NLE 7 13.090 -2.041 0.552
53 HD2 NLE 7 HD2 NLE 7 13.097 -3.784 2.044
54 HD3 NLE 7 HD3 NLE 7 11.514 -4.344 1.490
55 HE1 NLE 7 HE1 NLE 7 14.122 -4.953 0.191
56 HE2 NLE 7 HE2 NLE 7 13.202 -5.987 1.122
57 HE3 NLE 7 HE3 NLE 7 12.627 -5.476 -0.359
58 H TRP 8 H TRP 8 9.894 0.328 -2.216
59 HA TRP 8 HA TRP 8 11.968 0.274 -4.021
60 HB2 TRP 8 HB2 TRP 8 9.927 2.487 -3.715
61 HB3 TRP 8 HB3 TRP 8 10.861 2.133 -5.167
62 HD1 TRP 8 HD1 TRP 8 10.406 -1.111 -4.942
63 HE1 TRP 8 HE1 TRP 8 8.118 -2.042 -5.664
64 HE3 TRP 8 HE3 TRP 8 7.634 3.167 -4.559
65 HZ2 TRP 8 HZ2 TRP 8 5.486 -1.087 -6.023
66 HZ3 TRP 8 HZ3 TRP 8 5.239 3.073 -5.112
67 HH2 TRP 8 HH2 TRP 8 4.188 0.990 -5.830
68 H THR 9 H THR 9 13.129 2.285 -4.888
69 HA THR 9 HA THR 9 14.735 3.339 -2.726
70 HB THR 9 HB THR 9 15.943 4.493 -4.705
71 HG1 THR 9 HG1 THR 9 14.700 4.265 -6.445
72 HG21 THR 9 HG21 THR 9 16.120 1.566 -5.082
73 HG22 THR 9 HG22 THR 9 16.351 2.154 -3.434
74 HG23 THR 9 HG23 THR 9 17.386 2.745 -4.735
75 H CYS 10 H CYS 10 12.693 4.507 -1.953
76 HA CYS 10 HA CYS 10 11.435 6.598 -3.135
77 HB2 CYS 10 HB2 CYS 10 10.918 7.420 -0.998
78 HB3 CYS 10 HB3 CYS 10 11.209 5.703 -0.732
79 H ASP 11 H ASP 11 11.737 8.913 -3.080
80 HA ASP 11 HA ASP 11 14.290 10.052 -2.499
81 HB2 ASP 11 HB2 ASP 11 13.920 8.921 -5.103
82 HB3 ASP 11 HB3 ASP 11 14.024 10.672 -5.256
83 H SER 12 H SER 12 11.211 10.327 -4.195
84 HA SER 12 HA SER 12 10.481 12.707 -2.889
85 HB2 SER 12 HB2 SER 12 12.324 13.381 -4.680
86 HB3 SER 12 HB3 SER 12 10.944 13.315 -5.775
87 HG SER 12 HG SER 12 10.821 14.743 -3.342
88 H LYS 13 H LYS 13 10.136 10.645 -5.709
89 HA LYS 13 HA LYS 13 7.285 10.503 -5.293
90 HB2 LYS 13 HB2 LYS 13 8.479 11.931 -7.635
91 HB3 LYS 13 HB3 LYS 13 6.999 11.009 -7.861
92 HG2 LYS 13 HG2 LYS 13 6.433 12.464 -5.618
93 HG3 LYS 13 HG3 LYS 13 7.434 13.579 -6.550
94 HD2 LYS 13 HD2 LYS 13 5.849 12.736 -8.514
95 HD3 LYS 13 HD3 LYS 13 4.752 12.458 -7.158
96 HE2 LYS 13 HE2 LYS 13 4.379 14.665 -8.069
97 HE3 LYS 13 HE3 LYS 13 5.075 14.799 -6.453
98 HZ1 LYS 13 HZ1 LYS 13 6.990 15.661 -7.246
99 HZ2 LYS 13 HZ2 LYS 13 5.988 16.169 -8.509
100 HZ3 LYS 13 HZ3 LYS 13 6.942 14.785 -8.691
101 H ARG 14 H ARG 14 8.635 8.404 -4.853
102 HA ARG 14 HA ARG 14 9.060 6.858 -7.292
103 HB2 ARG 14 HB2 ARG 14 10.041 6.750 -4.551
104 HB3 ARG 14 HB3 ARG 14 9.521 5.174 -5.133
105 HG2 ARG 14 HG2 ARG 14 11.454 6.959 -6.595
106 HG3 ARG 14 HG3 ARG 14 11.928 5.661 -5.498
107 HD2 ARG 14 HD2 ARG 14 11.411 4.042 -6.980
108 HD3 ARG 14 HD3 ARG 14 10.003 4.909 -7.593
109 HE ARG 14 HE ARG 14 12.362 6.210 -8.422
110 HH11 ARG 14 HH11 ARG 14 10.503 3.326 -9.011
111 HH12 ARG 14 HH12 ARG 14 11.033 3.161 -10.653
112 HH21 ARG 14 HH21 ARG 14 13.070 6.004 -10.582
113 HH22 ARG 14 HH22 ARG 14 12.496 4.685 -11.543
114 H ALA 15 H ALA 15 6.375 7.692 -6.180
115 HA ALA 15 HA ALA 15 4.273 6.803 -6.221
116 HB1 ALA 15 HB1 ALA 15 3.871 4.701 -7.202
117 HB2 ALA 15 HB2 ALA 15 5.290 5.342 -8.031
118 HB3 ALA 15 HB3 ALA 15 5.478 4.109 -6.785
119 H CYS 16 H CYS 16 6.460 6.394 -3.964
120 HA CYS 16 HA CYS 16 5.497 4.238 -2.390
121 HB2 CYS 16 HB2 CYS 16 7.510 6.306 -2.170
122 HB3 CYS 16 HB3 CYS 16 6.649 6.105 -0.647
123 H CYS 17 H CYS 17 4.550 4.538 -0.189
124 HA CYS 17 HA CYS 17 2.485 6.642 -0.244
125 HB2 CYS 17 HB2 CYS 17 1.178 4.973 1.210
126 HB3 CYS 17 HB3 CYS 17 1.318 4.620 -0.509
127 H GLU 18 H GLU 18 4.502 4.633 1.873
128 HA GLU 18 HA GLU 18 4.638 6.862 3.760
129 HB2 GLU 18 HB2 GLU 18 3.008 4.673 4.244
130 HB3 GLU 18 HB3 GLU 18 4.477 4.292 5.132
131 HG2 GLU 18 HG2 GLU 18 4.171 5.947 6.633
132 HG3 GLU 18 HG3 GLU 18 3.419 7.026 5.460
133 H GLY 19 H GLY 19 6.618 7.151 4.629
134 HA2 GLY 19 HA2 GLY 19 8.729 6.451 5.442
135 HA3 GLY 19 HA3 GLY 19 8.550 4.951 4.545
136 H LEU 20 H LEU 20 7.628 7.351 2.499
137 HA LEU 20 HA LEU 20 9.881 7.074 0.827
138 HB2 LEU 20 HB2 LEU 20 8.811 9.152 -0.302
139 HB3 LEU 20 HB3 LEU 20 7.974 7.601 -0.335
140 HG LEU 20 HG LEU 20 6.629 9.747 0.158
141 HD11 LEU 20 HD11 LEU 20 5.144 8.160 0.587
142 HD12 LEU 20 HD12 LEU 20 5.705 8.136 2.258
143 HD13 LEU 20 HD13 LEU 20 6.419 7.041 1.076
144 HD21 LEU 20 HD21 LEU 20 6.617 10.581 2.344
145 HD22 LEU 20 HD22 LEU 20 8.329 10.435 1.940
146 HD23 LEU 20 HD23 LEU 20 7.557 9.221 2.963
147 H ARG 21 H ARG 21 9.504 8.857 3.621
148 HA ARG 21 HA ARG 21 11.107 11.131 2.879
149 HB2 ARG 21 HB2 ARG 21 10.975 11.742 5.233
150 HB3 ARG 21 HB3 ARG 21 9.387 11.303 4.626
151 HG2 ARG 21 HG2 ARG 21 10.389 8.926 5.609
152 HG3 ARG 21 HG3 ARG 21 10.943 10.135 6.769
153 HD2 ARG 21 HD2 ARG 21 8.791 9.296 7.458
154 HD3 ARG 21 HD3 ARG 21 8.623 10.974 6.939
155 HE ARG 21 HE ARG 21 8.081 9.081 4.852
156 HH11 ARG 21 HH11 ARG 21 6.739 10.778 7.579
157 HH12 ARG 21 HH12 ARG 21 5.107 10.673 7.009
158 HH21 ARG 21 HH21 ARG 21 5.936 8.934 4.091
159 HH22 ARG 21 HH22 ARG 21 4.649 9.622 5.024
160 H CYS 22 H CYS 22 12.493 8.901 2.156
161 HA CYS 22 HA CYS 22 14.754 8.963 4.032
162 HB2 CYS 22 HB2 CYS 22 15.140 6.602 3.784
163 HB3 CYS 22 HB3 CYS 22 13.467 6.829 4.280
164 H LYS 23 H LYS 23 16.334 7.160 2.469
165 HA LYS 23 HA LYS 23 17.003 8.959 0.256
166 HB2 LYS 23 HB2 LYS 23 18.618 7.998 2.169
167 HB3 LYS 23 HB3 LYS 23 18.793 6.705 0.990
168 HG2 LYS 23 HG2 LYS 23 20.545 8.328 0.696
169 HG3 LYS 23 HG3 LYS 23 19.463 8.363 -0.697
170 HD2 LYS 23 HD2 LYS 23 20.100 10.621 0.061
171 HD3 LYS 23 HD3 LYS 23 18.360 10.339 0.167
172 HE2 LYS 23 HE2 LYS 23 18.523 9.955 2.542
173 HE3 LYS 23 HE3 LYS 23 20.282 10.062 2.477
174 HZ1 LYS 23 HZ1 LYS 23 18.310 12.167 2.540
175 HZ2 LYS 23 HZ2 LYS 23 19.527 12.403 1.389
176 HZ3 LYS 23 HZ3 LYS 23 19.935 12.189 3.017
177 H LEU 24 H LEU 24 16.314 5.574 0.974
178 HA LEU 24 HA LEU 24 15.689 5.160 -1.852
179 HB2 LEU 24 HB2 LEU 24 17.757 3.740 -0.269
180 HB3 LEU 24 HB3 LEU 24 16.770 2.774 -1.366
181 HG LEU 24 HG LEU 24 17.476 4.392 -3.192
182 HD11 LEU 24 HD11 LEU 24 18.602 6.202 -2.579
183 HD12 LEU 24 HD12 LEU 24 19.955 5.154 -2.158
184 HD13 LEU 24 HD13 LEU 24 18.773 5.603 -0.929
185 HD21 LEU 24 HD21 LEU 24 19.248 3.047 -3.748
186 HD22 LEU 24 HD22 LEU 24 18.451 2.046 -2.535
187 HD23 LEU 24 HD23 LEU 24 19.871 2.997 -2.097
188 H TRP 25 H TRP 25 16.023 2.526 0.389
189 HA TRP 25 HA TRP 25 13.417 1.588 0.022
190 HB2 TRP 25 HB2 TRP 25 14.398 -0.179 0.978
191 HB3 TRP 25 HB3 TRP 25 15.738 0.823 1.527
192 HD1 TRP 25 HD1 TRP 25 12.273 -0.395 2.707
193 HE1 TRP 25 HE1 TRP 25 12.236 -0.341 5.280
194 HE3 TRP 25 HE3 TRP 25 16.815 1.798 3.538
195 HZ2 TRP 25 HZ2 TRP 25 13.911 0.520 7.382
196 HZ3 TRP 25 HZ3 TRP 25 17.522 2.203 5.858
197 HH2 TRP 25 HH2 TRP 25 16.099 1.577 7.740
198 H CYS 26 H CYS 26 11.640 2.685 0.550
199 HA CYS 26 HA CYS 26 11.258 4.766 2.218
200 HB2 CYS 26 HB2 CYS 26 9.434 2.465 1.566
201 HB3 CYS 26 HB3 CYS 26 8.899 3.775 2.613
202 H ARG 27 H ARG 27 11.356 5.180 4.329
203 HA ARG 27 HA ARG 27 11.839 2.954 6.159
204 HB2 ARG 27 HB2 ARG 27 12.265 5.926 6.346
205 HB3 ARG 27 HB3 ARG 27 12.357 4.894 7.765
206 HG2 ARG 27 HG2 ARG 27 14.199 3.687 6.866
207 HG3 ARG 27 HG3 ARG 27 14.018 4.472 5.297
208 HD2 ARG 27 HD2 ARG 27 15.825 5.555 6.361
209 HD3 ARG 27 HD3 ARG 27 14.456 6.658 6.488
210 HE ARG 27 HE ARG 27 14.339 5.279 8.805
211 HH11 ARG 27 HH11 ARG 27 16.898 6.994 7.183
212 HH12 ARG 27 HH12 ARG 27 17.706 7.438 8.650
213 HH21 ARG 27 HH21 ARG 27 15.395 5.856 10.742
214 HH22 ARG 27 HH22 ARG 27 16.853 6.789 10.675
215 H LYS 28 H LYS 28 9.831 2.100 6.569
216 HA LYS 28 HA LYS 28 8.205 3.537 8.448
217 HB2 LYS 28 HB2 LYS 28 7.411 3.335 5.628
218 HB3 LYS 28 HB3 LYS 28 6.182 2.788 6.759
219 HG2 LYS 28 HG2 LYS 28 7.537 5.475 6.850
220 HG3 LYS 28 HG3 LYS 28 5.944 5.158 6.161
221 HD2 LYS 28 HD2 LYS 28 6.748 4.704 9.034
222 HD3 LYS 28 HD3 LYS 28 5.777 6.052 8.435
223 HE2 LYS 28 HE2 LYS 28 4.296 4.096 7.466
224 HE3 LYS 28 HE3 LYS 28 5.057 3.182 8.766
225 HZ1 LYS 28 HZ1 LYS 28 2.843 4.589 9.095
226 HZ2 LYS 28 HZ2 LYS 28 3.974 5.786 9.480
227 HZ3 LYS 28 HZ3 LYS 28 3.955 4.332 10.343
228 H ILE 29 H ILE 29 6.993 1.063 6.271
229 HA ILE 29 HA ILE 29 6.730 -0.750 8.545
230 HB ILE 29 HB ILE 29 5.350 -2.117 6.932
231 HG12 ILE 29 HG12 ILE 29 6.497 -0.720 4.972
232 HG13 ILE 29 HG13 ILE 29 4.889 -1.412 4.803
233 HG21 ILE 29 HG21 ILE 29 3.461 -0.360 6.915
234 HG22 ILE 29 HG22 ILE 29 4.121 -0.879 8.466
235 HG23 ILE 29 HG23 ILE 29 4.617 0.663 7.768
236 HD11 ILE 29 HD11 ILE 29 5.354 1.063 4.136
237 HD12 ILE 29 HD12 ILE 29 3.853 0.624 4.954
238 HD13 ILE 29 HD13 ILE 29 5.177 1.353 5.865
239 H ILE 30 H ILE 30 9.144 -1.026 8.441
240 HA ILE 30 HA ILE 30 10.429 -2.330 6.320
241 HB ILE 30 HB ILE 30 11.248 -2.882 9.139
242 HG12 ILE 30 HG12 ILE 30 10.745 -0.604 9.408
243 HG13 ILE 30 HG13 ILE 30 12.455 -0.604 8.993
244 HG21 ILE 30 HG21 ILE 30 13.282 -1.888 7.379
245 HG22 ILE 30 HG22 ILE 30 13.153 -3.463 8.161
246 HG23 ILE 30 HG23 ILE 30 12.388 -3.192 6.595
247 HD11 ILE 30 HD11 ILE 30 11.052 -0.440 6.569
248 HD12 ILE 30 HD12 ILE 30 10.277 0.689 7.682
249 HD13 ILE 30 HD13 ILE 30 12.006 0.812 7.364