Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
18680 | 2dwf RC | 6741 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H CYS 1 1HT CYS 1 -14.488 -1.207 -2.700
2 2H CYS 1 2HT CYS 1 -15.338 -0.074 -3.670
3 3H CYS 1 3HT CYS 1 -15.749 -0.268 -2.016
4 HA CYS 1 HA CYS 1 -13.224 0.782 -3.103
5 1HB CYS 1 2HB CYS 1 -15.735 1.976 -2.690
6 2HB CYS 1 1HB CYS 1 -14.755 2.490 -1.323
7 H TRP 2 H TRP 2 -12.819 -1.367 -1.577
8 HA TRP 2 HA TRP 2 -11.656 -0.243 0.808
9 1HB TRP 2 2HB TRP 2 -12.772 -2.119 2.224
10 2HB TRP 2 1HB TRP 2 -13.663 -0.636 1.895
11 HD1 TRP 2 HD TRP 2 -13.306 -3.833 -0.291
12 HE1 TRP 2 1HE TRP 2 -15.676 -4.662 -0.862
13 HE3 TRP 2 3HE TRP 2 -16.029 -0.400 2.347
14 HZ2 TRP 2 2HZ TRP 2 -18.344 -3.954 -0.274
15 HZ3 TRP 2 3HZ TRP 2 -18.485 -0.545 2.287
16 HH2 TRP 2 HH TRP 2 -19.616 -2.286 1.002
17 H LEU 3 H LEU 3 -10.946 -1.828 -1.692
18 HA LEU 3 HA LEU 3 -9.824 -4.264 -0.547
19 1HB LEU 3 2HB LEU 3 -9.636 -3.182 -3.359
20 2HB LEU 3 1HB LEU 3 -9.099 -4.765 -2.830
21 HG LEU 3 HG LEU 3 -11.951 -3.780 -2.916
22 1HD1 LEU 3 1HD1 LEU 3 -10.367 -5.719 -4.574
23 2HD1 LEU 3 2HD1 LEU 3 -11.275 -4.304 -5.107
24 3HD1 LEU 3 3HD1 LEU 3 -12.129 -5.734 -4.526
25 1HD2 LEU 3 1HD2 LEU 3 -12.308 -6.316 -2.419
26 2HD2 LEU 3 2HD2 LEU 3 -12.001 -5.191 -1.096
27 3HD2 LEU 3 3HD2 LEU 3 -10.697 -6.206 -1.711
28 H CYS 4 H CYS 4 -8.943 -1.133 -0.520
29 HA CYS 4 HA CYS 4 -6.388 -0.892 -1.443
30 1HB CYS 4 2HB CYS 4 -8.047 0.457 0.505
31 2HB CYS 4 1HB CYS 4 -6.351 0.481 0.982
32 H ARG 5 H ARG 5 -6.864 -1.285 2.044
33 HA ARG 5 HA ARG 5 -4.495 -1.970 2.967
34 1HB ARG 5 2HB ARG 5 -6.964 -3.594 3.585
35 2HB ARG 5 1HB ARG 5 -5.518 -3.516 4.580
36 1HG ARG 5 2HG ARG 5 -6.061 -1.518 5.457
37 2HG ARG 5 1HG ARG 5 -6.762 -0.924 3.951
38 1HD ARG 5 2HD ARG 5 -8.018 -2.667 6.048
39 2HD ARG 5 1HD ARG 5 -8.567 -1.105 5.445
40 HE ARG 5 HE ARG 5 -8.711 -2.631 3.245
41 1HH1 ARG 5 1HH1 ARG 5 -9.865 -3.132 6.502
42 2HH1 ARG 5 2HH1 ARG 5 -11.191 -4.131 6.011
43 1HH2 ARG 5 1HH2 ARG 5 -10.457 -3.942 2.600
44 2HH2 ARG 5 2HH2 ARG 5 -11.528 -4.590 3.796
45 H ALA 6 H ALA 6 -6.437 -4.159 1.007
46 HA ALA 6 HA ALA 6 -4.856 -6.457 1.307
47 1HB ALA 6 1HB ALA 6 -7.227 -5.953 0.142
48 2HB ALA 6 2HB ALA 6 -6.294 -7.425 -0.123
49 3HB ALA 6 3HB ALA 6 -6.201 -6.101 -1.285
50 H LEU 7 H LEU 7 -4.900 -4.168 -1.483
51 HA LEU 7 HA LEU 7 -2.569 -5.401 -2.581
52 1HB LEU 7 2HB LEU 7 -2.827 -4.075 -4.432
53 2HB LEU 7 1HB LEU 7 -4.466 -4.178 -3.836
54 HG LEU 7 HG LEU 7 -3.993 -1.944 -4.625
55 1HD1 LEU 7 1HD1 LEU 7 -5.242 -2.513 -2.345
56 2HD1 LEU 7 2HD1 LEU 7 -5.081 -0.877 -2.979
57 3HD1 LEU 7 3HD1 LEU 7 -3.982 -1.448 -1.727
58 1HD2 LEU 7 1HD2 LEU 7 -2.105 -1.233 -2.498
59 2HD2 LEU 7 2HD2 LEU 7 -2.160 -0.731 -4.189
60 3HD2 LEU 7 3HD2 LEU 7 -1.451 -2.286 -3.753
61 H ILE 8 H ILE 8 -3.111 -2.688 -0.458
62 HA ILE 8 HA ILE 8 -0.557 -1.544 -0.872
63 HB ILE 8 HB ILE 8 -0.949 -0.129 0.969
64 1HG1 ILE 8 2HG1 ILE 8 -3.135 -0.730 2.383
65 2HG1 ILE 8 1HG1 ILE 8 -2.644 -2.364 1.949
66 1HG2 ILE 8 1HG2 ILE 8 -2.503 0.050 -1.038
67 2HG2 ILE 8 2HG2 ILE 8 -2.994 0.876 0.439
68 3HG2 ILE 8 3HG2 ILE 8 -3.738 -0.660 0.002
69 1HD1 ILE 8 1HD1 ILE 8 -1.406 -2.237 3.800
70 2HD1 ILE 8 2HD1 ILE 8 -1.458 -0.475 3.834
71 3HD1 ILE 8 3HD1 ILE 8 -0.296 -1.303 2.798
72 H LYS 9 H LYS 9 -1.722 -4.255 0.834
73 HA LYS 9 HA LYS 9 0.567 -4.452 2.572
74 1HB LYS 9 2HB LYS 9 -1.796 -5.228 3.101
75 2HB LYS 9 1HB LYS 9 -1.455 -6.612 2.081
76 1HG LYS 9 2HG LYS 9 -0.517 -7.625 3.809
77 2HG LYS 9 1HG LYS 9 0.700 -6.353 3.877
78 1HD LYS 9 2HD LYS 9 -1.979 -6.350 5.270
79 2HD LYS 9 1HD LYS 9 -0.406 -6.590 6.033
80 1HE LYS 9 2HE LYS 9 -1.002 -4.102 4.467
81 2HE LYS 9 1HE LYS 9 -1.499 -4.255 6.151
82 1HZ LYS 9 1HZ LYS 9 0.679 -4.333 6.872
83 2HZ LYS 9 2HZ LYS 9 0.767 -3.209 5.612
84 3HZ LYS 9 3HZ LYS 9 1.287 -4.799 5.364
85 H ARG 10 H ARG 10 -0.540 -5.676 -0.474
86 HA ARG 10 HA ARG 10 1.416 -7.743 -0.694
87 1HB ARG 10 2HB ARG 10 0.046 -6.338 -2.990
88 2HB ARG 10 1HB ARG 10 0.738 -7.954 -2.982
89 1HG ARG 10 2HG ARG 10 -1.524 -7.255 -1.166
90 2HG ARG 10 1HG ARG 10 -1.819 -7.684 -2.848
91 1HD ARG 10 2HD ARG 10 -1.895 -9.512 -0.996
92 2HD ARG 10 1HD ARG 10 -1.132 -9.863 -2.545
93 HE ARG 10 HE ARG 10 0.194 -9.488 0.025
94 1HH1 ARG 10 1HH1 ARG 10 0.494 -10.042 -3.414
95 2HH1 ARG 10 2HH1 ARG 10 2.121 -10.621 -3.299
96 1HH2 ARG 10 1HH2 ARG 10 2.329 -10.250 0.167
97 2HH2 ARG 10 2HH2 ARG 10 3.162 -10.738 -1.272
98 H ILE 11 H ILE 11 1.409 -4.342 -0.898
99 HA ILE 11 HA ILE 11 3.823 -4.213 -2.530
100 HB ILE 11 HB ILE 11 2.132 -2.125 -1.165
101 1HG1 ILE 11 2HG1 ILE 11 1.508 -2.953 -3.437
102 2HG1 ILE 11 1HG1 ILE 11 1.868 -1.231 -3.396
103 1HG2 ILE 11 1HG2 ILE 11 4.041 -1.036 -0.699
104 2HG2 ILE 11 2HG2 ILE 11 4.019 -0.637 -2.418
105 3HG2 ILE 11 3HG2 ILE 11 4.990 -1.993 -1.837
106 1HD1 ILE 11 1HD1 ILE 11 3.394 -3.459 -4.641
107 2HD1 ILE 11 2HD1 ILE 11 4.253 -2.014 -4.110
108 3HD1 ILE 11 3HD1 ILE 11 2.955 -1.883 -5.297
109 H GLN 12 H GLN 12 2.659 -4.138 0.716
110 HA GLN 12 HA GLN 12 4.709 -3.179 2.223
111 1HB GLN 12 2HB GLN 12 2.454 -4.824 2.558
112 2HB GLN 12 1HB GLN 12 3.788 -5.700 3.281
113 1HG GLN 12 2HG GLN 12 2.286 -3.489 4.228
114 2HG GLN 12 1HG GLN 12 3.426 -4.555 5.075
115 1HE2 GLN 12 1HE2 GLN 12 5.804 -4.025 4.361
116 2HE2 GLN 12 2HE2 GLN 12 6.229 -2.355 4.480
117 H ALA 13 H ALA 13 4.266 -6.547 1.240
118 HA ALA 13 HA ALA 13 6.821 -7.259 2.137
119 1HB ALA 13 1HB ALA 13 4.854 -8.810 1.987
120 2HB ALA 13 2HB ALA 13 6.365 -9.461 1.352
121 3HB ALA 13 3HB ALA 13 5.126 -8.868 0.246
122 H MET 14 H MET 14 5.491 -6.328 -0.952
123 HA MET 14 HA MET 14 7.430 -7.135 -2.725
124 1HB MET 14 2HB MET 14 6.474 -5.693 -4.205
125 2HB MET 14 1HB MET 14 5.250 -5.582 -2.953
126 1HG MET 14 2HG MET 14 5.525 -3.384 -3.147
127 2HG MET 14 1HG MET 14 6.989 -3.620 -2.199
128 1HE MET 14 1HE MET 14 6.585 -1.056 -4.822
129 2HE MET 14 2HE MET 14 8.315 -1.011 -4.480
130 3HE MET 14 3HE MET 14 7.165 -1.288 -3.173
131 H ILE 15 H ILE 15 7.607 -4.673 -0.274
132 HA ILE 15 HA ILE 15 10.477 -4.383 -0.829
133 HB ILE 15 HB ILE 15 10.277 -1.946 -0.148
134 1HG1 ILE 15 2HG1 ILE 15 7.728 -1.386 -1.177
135 2HG1 ILE 15 1HG1 ILE 15 7.487 -2.720 -0.052
136 1HG2 ILE 15 1HG2 ILE 15 9.496 -3.153 -2.732
137 2HG2 ILE 15 2HG2 ILE 15 10.849 -2.094 -2.333
138 3HG2 ILE 15 3HG2 ILE 15 9.235 -1.419 -2.546
139 1HD1 ILE 15 1HD1 ILE 15 7.296 -1.045 1.428
140 2HD1 ILE 15 2HD1 ILE 15 8.249 0.074 0.453
141 3HD1 ILE 15 3HD1 ILE 15 9.057 -1.143 1.442
142 HA PRO 16 HA PRO 16 9.929 -5.325 3.597
143 1HB PRO 16 2HB PRO 16 12.251 -6.664 3.904
144 2HB PRO 16 1HB PRO 16 10.819 -7.408 3.184
145 1HG PRO 16 2HG PRO 16 13.247 -6.291 1.850
146 2HG PRO 16 1HG PRO 16 12.327 -7.754 1.463
147 1HD PRO 16 2HD PRO 16 12.069 -5.377 0.114
148 2HD PRO 16 1HD PRO 16 10.794 -6.605 0.217
149 H LYS 17 H LYS 17 13.078 -4.377 2.204
150 HA LYS 17 HA LYS 17 13.499 -2.652 4.549
151 1HB LYS 17 2HB LYS 17 15.166 -4.541 3.751
152 2HB LYS 17 1HB LYS 17 15.697 -3.291 2.634
153 1HG LYS 17 2HG LYS 17 16.226 -1.817 4.468
154 2HG LYS 17 1HG LYS 17 15.582 -2.981 5.626
155 1HD LYS 17 2HD LYS 17 17.311 -4.570 5.045
156 2HD LYS 17 1HD LYS 17 17.916 -3.495 3.785
157 1HE LYS 17 2HE LYS 17 18.975 -2.144 5.260
158 2HE LYS 17 1HE LYS 17 17.730 -2.341 6.493
159 1HZ LYS 17 1HZ LYS 17 18.789 -4.783 6.452
160 2HZ LYS 17 2HZ LYS 17 19.319 -3.555 7.487
161 3HZ LYS 17 3HZ LYS 17 20.155 -3.868 6.050
162 H GLY 18 H GLY 18 11.782 -1.520 2.902
163 1HA GLY 18 2HA GLY 18 13.350 0.301 1.188
164 2HA GLY 18 1HA GLY 18 11.642 -0.057 0.971
165 H GLY 19 H GLY 19 12.762 2.558 1.147
166 1HA GLY 19 2HA GLY 19 11.133 3.560 3.335
167 2HA GLY 19 1HA GLY 19 12.848 3.925 3.447
168 H ARG 20 H ARG 20 9.995 5.198 2.582
169 HA ARG 20 HA ARG 20 10.924 7.541 1.515
170 1HB ARG 20 2HB ARG 20 10.881 5.416 -0.475
171 2HB ARG 20 1HB ARG 20 9.875 6.777 -0.951
172 1HG ARG 20 2HG ARG 20 11.635 8.147 -1.257
173 2HG ARG 20 1HG ARG 20 12.544 7.459 0.089
174 1HD ARG 20 2HD ARG 20 13.092 5.507 -1.268
175 2HD ARG 20 1HD ARG 20 12.162 6.171 -2.611
176 HE ARG 20 HE ARG 20 13.973 8.116 -2.050
177 1HH1 ARG 20 1HH1 ARG 20 14.218 4.712 -2.777
178 2HH1 ARG 20 2HH1 ARG 20 15.781 4.853 -3.510
179 1HH2 ARG 20 1HH2 ARG 20 16.027 8.304 -3.014
180 2HH2 ARG 20 2HH2 ARG 20 16.809 6.892 -3.644
181 H MET 21 H MET 21 8.386 5.631 -0.047
182 HA MET 21 HA MET 21 6.269 6.550 1.594
183 1HB MET 21 2HB MET 21 6.335 8.677 0.667
184 2HB MET 21 1HB MET 21 6.878 8.092 -0.900
185 1HG MET 21 2HG MET 21 4.651 7.204 -1.359
186 2HG MET 21 1HG MET 21 4.097 7.739 0.223
187 1HE MET 21 1HE MET 21 6.123 10.763 -0.268
188 2HE MET 21 2HE MET 21 4.897 10.282 0.906
189 3HE MET 21 3HE MET 21 4.599 11.647 -0.171
190 H LEU 22 H LEU 22 4.126 5.982 0.654
191 HA LEU 22 HA LEU 22 4.308 3.921 -1.405
192 1HB LEU 22 2HB LEU 22 3.345 3.714 1.388
193 2HB LEU 22 1HB LEU 22 2.446 2.879 0.147
194 HG LEU 22 HG LEU 22 5.370 2.472 0.776
195 1HD1 LEU 22 1HD1 LEU 22 4.650 0.273 1.588
196 2HD1 LEU 22 2HD1 LEU 22 2.969 0.735 1.320
197 3HD1 LEU 22 3HD1 LEU 22 3.938 1.592 2.518
198 1HD2 LEU 22 1HD2 LEU 22 3.594 0.961 -1.137
199 2HD2 LEU 22 2HD2 LEU 22 5.285 0.614 -0.776
200 3HD2 LEU 22 3HD2 LEU 22 4.849 2.110 -1.600
201 HA PRO 23 HA PRO 23 0.399 5.555 -2.710
202 1HB PRO 23 2HB PRO 23 -0.816 3.270 -3.628
203 2HB PRO 23 1HB PRO 23 0.486 4.117 -4.449
204 1HG PRO 23 2HG PRO 23 0.554 1.532 -3.217
205 2HG PRO 23 1HG PRO 23 1.835 2.355 -4.119
206 1HD PRO 23 2HD PRO 23 1.449 2.124 -1.219
207 2HD PRO 23 1HD PRO 23 2.894 2.533 -2.122
208 H GLN 24 H GLN 24 0.179 3.007 -0.355
209 HA GLN 24 HA GLN 24 -2.521 2.749 0.030
210 1HB GLN 24 2HB GLN 24 -1.465 2.902 2.652
211 2HB GLN 24 1HB GLN 24 -1.872 1.466 1.734
212 1HG GLN 24 2HG GLN 24 0.320 1.136 2.414
213 2HG GLN 24 1HG GLN 24 0.464 1.650 0.734
214 1HE2 GLN 24 1HE2 GLN 24 1.753 2.018 3.695
215 2HE2 GLN 24 2HE2 GLN 24 2.431 3.599 3.538
216 H LEU 25 H LEU 25 -0.604 5.532 0.505
217 HA LEU 25 HA LEU 25 -2.440 6.768 2.360
218 1HB LEU 25 2HB LEU 25 -0.059 7.724 0.830
219 2HB LEU 25 1HB LEU 25 -1.120 8.885 1.602
220 HG LEU 25 HG LEU 25 0.649 8.532 3.102
221 1HD1 LEU 25 1HD1 LEU 25 -1.675 8.448 4.056
222 2HD1 LEU 25 2HD1 LEU 25 -0.418 7.720 5.057
223 3HD1 LEU 25 3HD1 LEU 25 -1.503 6.694 4.119
224 1HD2 LEU 25 1HD2 LEU 25 1.251 6.306 1.916
225 2HD2 LEU 25 2HD2 LEU 25 0.255 5.575 3.174
226 3HD2 LEU 25 3HD2 LEU 25 1.671 6.529 3.614
227 H VAL 26 H VAL 26 -1.812 7.071 -1.073
228 HA VAL 26 HA VAL 26 -3.964 8.991 -1.411
229 HB VAL 26 HB VAL 26 -2.857 7.564 -3.764
230 1HG1 VAL 26 1HG1 VAL 26 -3.627 10.386 -3.102
231 2HG1 VAL 26 2HG1 VAL 26 -4.382 9.280 -4.249
232 3HG1 VAL 26 3HG1 VAL 26 -2.795 9.965 -4.598
233 1HG2 VAL 26 1HG2 VAL 26 -0.746 7.791 -2.944
234 2HG2 VAL 26 2HG2 VAL 26 -1.192 9.112 -1.865
235 3HG2 VAL 26 3HG2 VAL 26 -0.948 9.422 -3.585
236 H CYS 27 H CYS 27 -3.327 5.653 -1.569
237 HA CYS 27 HA CYS 27 -5.537 4.765 -3.044
238 1HB CYS 27 2HB CYS 27 -4.426 2.864 -2.791
239 2HB CYS 27 1HB CYS 27 -3.295 3.657 -1.742
240 H ARG 28 H ARG 28 -4.876 5.182 0.371
241 HA ARG 28 HA ARG 28 -7.406 4.258 1.181
242 1HB ARG 28 2HB ARG 28 -5.197 5.762 2.526
243 2HB ARG 28 1HB ARG 28 -6.747 5.582 3.340
244 1HG ARG 28 2HG ARG 28 -6.532 3.122 3.088
245 2HG ARG 28 1HG ARG 28 -4.924 3.364 2.420
246 1HD ARG 28 2HD ARG 28 -5.903 3.727 5.207
247 2HD ARG 28 1HD ARG 28 -4.413 2.987 4.626
248 HE ARG 28 HE ARG 28 -3.953 5.511 3.994
249 1HH1 ARG 28 1HH1 ARG 28 -5.287 4.174 6.938
250 2HH1 ARG 28 2HH1 ARG 28 -4.711 5.472 7.929
251 1HH2 ARG 28 1HH2 ARG 28 -3.201 7.211 5.303
252 2HH2 ARG 28 2HH2 ARG 28 -3.529 7.193 7.004
253 H LEU 29 H LEU 29 -6.198 7.301 0.070
254 HA LEU 29 HA LEU 29 -8.423 8.829 1.079
255 1HB LEU 29 2HB LEU 29 -6.045 9.387 -0.620
256 2HB LEU 29 1HB LEU 29 -7.402 10.495 -0.711
257 HG LEU 29 HG LEU 29 -5.922 9.781 1.823
258 1HD1 LEU 29 1HD1 LEU 29 -4.447 11.066 0.491
259 2HD1 LEU 29 2HD1 LEU 29 -5.163 12.176 1.659
260 3HD1 LEU 29 3HD1 LEU 29 -5.737 12.160 -0.009
261 1HD2 LEU 29 1HD2 LEU 29 -7.909 10.446 2.679
262 2HD2 LEU 29 2HD2 LEU 29 -8.359 11.345 1.229
263 3HD2 LEU 29 3HD2 LEU 29 -7.228 12.046 2.386
264 H VAL 30 H VAL 30 -7.588 7.235 -1.901
265 HA VAL 30 HA VAL 30 -9.908 8.319 -3.288
266 HB VAL 30 HB VAL 30 -7.886 6.324 -4.304
267 1HG1 VAL 30 1HG1 VAL 30 -9.734 6.161 -5.709
268 2HG1 VAL 30 2HG1 VAL 30 -8.708 7.338 -6.527
269 3HG1 VAL 30 3HG1 VAL 30 -10.100 7.882 -5.591
270 1HG2 VAL 30 1HG2 VAL 30 -7.310 8.884 -3.596
271 2HG2 VAL 30 2HG2 VAL 30 -7.780 9.091 -5.283
272 3HG2 VAL 30 3HG2 VAL 30 -6.475 7.984 -4.860
273 H LEU 31 H LEU 31 -8.851 5.279 -1.916
274 HA LEU 31 HA LEU 31 -11.146 3.895 -2.989
275 1HB LEU 31 2HB LEU 31 -8.638 3.093 -2.095
276 2HB LEU 31 1HB LEU 31 -9.763 2.420 -0.930
277 HG LEU 31 HG LEU 31 -11.029 1.690 -3.158
278 1HD1 LEU 31 1HD1 LEU 31 -9.783 2.329 -4.925
279 2HD1 LEU 31 2HD1 LEU 31 -8.919 0.831 -4.572
280 3HD1 LEU 31 3HD1 LEU 31 -8.285 2.373 -3.995
281 1HD2 LEU 31 1HD2 LEU 31 -8.634 0.186 -2.128
282 2HD2 LEU 31 2HD2 LEU 31 -10.074 -0.481 -2.900
283 3HD2 LEU 31 3HD2 LEU 31 -10.191 0.256 -1.301
284 H ARG 32 H ARG 32 -10.390 5.618 -0.113
285 HA ARG 32 HA ARG 32 -12.147 4.396 1.706
286 1HB ARG 32 2HB ARG 32 -10.693 6.018 2.613
287 2HB ARG 32 1HB ARG 32 -11.139 7.219 1.409
288 1HG ARG 32 2HG ARG 32 -13.222 6.240 3.298
289 2HG ARG 32 1HG ARG 32 -12.008 7.382 3.876
290 1HD ARG 32 2HD ARG 32 -12.962 9.088 2.799
291 2HD ARG 32 1HD ARG 32 -13.113 8.160 1.307
292 HE ARG 32 HE ARG 32 -15.061 7.245 3.077
293 1HH1 ARG 32 1HH1 ARG 32 -14.270 10.160 1.329
294 2HH1 ARG 32 2HH1 ARG 32 -15.915 10.685 1.211
295 1HH2 ARG 32 1HH2 ARG 32 -17.228 7.933 2.921
296 2HH2 ARG 32 2HH2 ARG 32 -17.595 9.423 2.116
297 H CYS 33 H CYS 33 -12.660 6.215 -1.117
298 HA CYS 33 HA CYS 33 -14.870 7.608 -1.125
299 1HB CYS 33 2HB CYS 33 -14.880 7.204 -3.349
300 2HB CYS 33 1HB CYS 33 -13.465 6.230 -3.007
301 H SER 34 H SER 34 -17.098 7.410 -1.051
302 HA SER 34 HA SER 34 -18.449 4.920 -0.815
303 1HB SER 34 2HB SER 34 -17.627 4.761 1.397
304 2HB SER 34 1HB SER 34 -17.884 6.480 1.702
305 HG SER 34 HG SER 34 -20.002 4.679 1.160
Start of MODEL 2
1 1H CYS 1 1HT CYS 1 -13.918 -1.076 -2.803
2 2H CYS 1 2HT CYS 1 -15.306 -0.234 -3.360
3 3H CYS 1 3HT CYS 1 -15.346 -1.057 -1.854
4 HA CYS 1 HA CYS 1 -13.552 1.186 -2.471
5 1HB CYS 1 2HB CYS 1 -15.909 1.870 -2.622
6 2HB CYS 1 1HB CYS 1 -16.227 1.152 -1.047
7 H TRP 2 H TRP 2 -12.565 -1.099 -1.325
8 HA TRP 2 HA TRP 2 -11.553 -0.165 1.117
9 1HB TRP 2 2HB TRP 2 -12.655 -2.244 2.412
10 2HB TRP 2 1HB TRP 2 -13.350 -0.627 2.417
11 HD1 TRP 2 HD TRP 2 -13.652 -3.582 -0.102
12 HE1 TRP 2 1HE TRP 2 -16.153 -3.928 -0.603
13 HE3 TRP 2 3HE TRP 2 -15.595 0.041 2.934
14 HZ2 TRP 2 2HZ TRP 2 -18.624 -2.809 0.183
15 HZ3 TRP 2 3HZ TRP 2 -18.036 0.340 3.002
16 HH2 TRP 2 HH TRP 2 -19.518 -1.056 1.654
17 H LEU 3 H LEU 3 -11.129 -1.932 -1.478
18 HA LEU 3 HA LEU 3 -9.778 -4.212 -0.266
19 1HB LEU 3 2HB LEU 3 -9.746 -3.525 -3.189
20 2HB LEU 3 1HB LEU 3 -9.553 -5.095 -2.434
21 HG LEU 3 HG LEU 3 -12.138 -3.541 -2.432
22 1HD1 LEU 3 1HD1 LEU 3 -11.061 -5.603 -4.324
23 2HD1 LEU 3 2HD1 LEU 3 -11.813 -4.049 -4.686
24 3HD1 LEU 3 3HD1 LEU 3 -12.795 -5.385 -4.085
25 1HD2 LEU 3 1HD2 LEU 3 -12.873 -6.055 -2.043
26 2HD2 LEU 3 2HD2 LEU 3 -12.402 -5.006 -0.706
27 3HD2 LEU 3 3HD2 LEU 3 -11.248 -6.166 -1.365
28 H CYS 4 H CYS 4 -9.020 -1.076 -0.707
29 HA CYS 4 HA CYS 4 -6.585 -0.921 -1.971
30 1HB CYS 4 2HB CYS 4 -8.167 0.748 -0.394
31 2HB CYS 4 1HB CYS 4 -6.611 0.704 0.427
32 H ARG 5 H ARG 5 -6.871 -1.021 1.574
33 HA ARG 5 HA ARG 5 -4.332 -1.390 2.329
34 1HB ARG 5 2HB ARG 5 -5.083 -2.392 4.328
35 2HB ARG 5 1HB ARG 5 -6.400 -1.359 3.794
36 1HG ARG 5 2HG ARG 5 -6.350 -4.289 3.151
37 2HG ARG 5 1HG ARG 5 -6.973 -3.682 4.684
38 1HD ARG 5 2HD ARG 5 -8.821 -2.785 3.734
39 2HD ARG 5 1HD ARG 5 -7.982 -2.355 2.250
40 HE ARG 5 HE ARG 5 -8.310 -4.563 1.456
41 1HH1 ARG 5 1HH1 ARG 5 -9.915 -3.944 4.502
42 2HH1 ARG 5 2HH1 ARG 5 -11.004 -5.277 4.332
43 1HH2 ARG 5 1HH2 ARG 5 -9.741 -6.313 1.248
44 2HH2 ARG 5 2HH2 ARG 5 -10.905 -6.621 2.493
45 H ALA 6 H ALA 6 -6.316 -3.875 0.836
46 HA ALA 6 HA ALA 6 -4.537 -6.034 1.334
47 1HB ALA 6 1HB ALA 6 -5.902 -6.944 -0.762
48 2HB ALA 6 2HB ALA 6 -6.954 -5.600 -0.316
49 3HB ALA 6 3HB ALA 6 -6.591 -6.864 0.860
50 H LEU 7 H LEU 7 -4.918 -3.787 -1.378
51 HA LEU 7 HA LEU 7 -3.064 -5.134 -3.068
52 1HB LEU 7 2HB LEU 7 -4.634 -3.787 -4.180
53 2HB LEU 7 1HB LEU 7 -4.363 -2.430 -3.105
54 HG LEU 7 HG LEU 7 -2.025 -3.247 -4.714
55 1HD1 LEU 7 1HD1 LEU 7 -4.197 -3.407 -6.162
56 2HD1 LEU 7 2HD1 LEU 7 -2.760 -2.594 -6.783
57 3HD1 LEU 7 3HD1 LEU 7 -4.098 -1.647 -6.132
58 1HD2 LEU 7 1HD2 LEU 7 -3.179 -0.844 -3.490
59 2HD2 LEU 7 2HD2 LEU 7 -2.416 -0.576 -5.057
60 3HD2 LEU 7 3HD2 LEU 7 -1.493 -1.295 -3.738
61 H ILE 8 H ILE 8 -2.928 -2.228 -1.073
62 HA ILE 8 HA ILE 8 -0.190 -1.773 -1.597
63 HB ILE 8 HB ILE 8 -0.328 -0.081 0.204
64 1HG1 ILE 8 2HG1 ILE 8 -2.893 0.248 0.887
65 2HG1 ILE 8 1HG1 ILE 8 -2.910 -1.497 0.661
66 1HG2 ILE 8 1HG2 ILE 8 -1.316 0.056 -2.280
67 2HG2 ILE 8 2HG2 ILE 8 -1.360 1.409 -1.152
68 3HG2 ILE 8 3HG2 ILE 8 -2.785 0.394 -1.366
69 1HD1 ILE 8 1HD1 ILE 8 -2.369 -0.391 2.990
70 2HD1 ILE 8 2HD1 ILE 8 -0.741 -0.342 2.314
71 3HD1 ILE 8 3HD1 ILE 8 -1.588 -1.882 2.465
72 H LYS 9 H LYS 9 -1.711 -4.003 0.344
73 HA LYS 9 HA LYS 9 0.233 -3.997 2.448
74 1HB LYS 9 2HB LYS 9 -1.856 -4.691 3.150
75 2HB LYS 9 1HB LYS 9 -2.092 -5.713 1.742
76 1HG LYS 9 2HG LYS 9 -1.729 -7.005 3.797
77 2HG LYS 9 1HG LYS 9 -0.484 -7.297 2.575
78 1HD LYS 9 2HD LYS 9 0.286 -6.961 5.000
79 2HD LYS 9 1HD LYS 9 1.117 -6.044 3.744
80 1HE LYS 9 2HE LYS 9 0.121 -4.037 4.364
81 2HE LYS 9 1HE LYS 9 -1.234 -4.843 5.151
82 1HZ LYS 9 1HZ LYS 9 -0.096 -5.100 7.065
83 2HZ LYS 9 2HZ LYS 9 0.783 -3.775 6.490
84 3HZ LYS 9 3HZ LYS 9 1.393 -5.341 6.298
85 H ARG 10 H ARG 10 -0.652 -6.279 -0.094
86 HA ARG 10 HA ARG 10 1.574 -7.968 0.306
87 1HB ARG 10 2HB ARG 10 0.456 -7.676 -2.445
88 2HB ARG 10 1HB ARG 10 0.921 -9.130 -1.579
89 1HG ARG 10 2HG ARG 10 -1.166 -9.500 -0.932
90 2HG ARG 10 1HG ARG 10 -1.326 -7.865 -0.292
91 1HD ARG 10 2HD ARG 10 -1.900 -8.867 -3.055
92 2HD ARG 10 1HD ARG 10 -2.970 -8.005 -1.949
93 HE ARG 10 HE ARG 10 -1.275 -6.104 -2.306
94 1HH1 ARG 10 1HH1 ARG 10 -2.271 -8.405 -4.751
95 2HH1 ARG 10 2HH1 ARG 10 -1.929 -7.337 -6.069
96 1HH2 ARG 10 1HH2 ARG 10 -0.833 -4.705 -4.054
97 2HH2 ARG 10 2HH2 ARG 10 -1.118 -5.242 -5.676
98 H ILE 11 H ILE 11 1.072 -4.935 -1.197
99 HA ILE 11 HA ILE 11 3.479 -4.945 -2.746
100 HB ILE 11 HB ILE 11 1.212 -3.198 -2.417
101 1HG1 ILE 11 2HG1 ILE 11 3.468 -3.127 -4.431
102 2HG1 ILE 11 1HG1 ILE 11 2.071 -4.193 -4.536
103 1HG2 ILE 11 1HG2 ILE 11 2.642 -1.810 -1.054
104 2HG2 ILE 11 2HG2 ILE 11 2.381 -1.034 -2.618
105 3HG2 ILE 11 3HG2 ILE 11 3.906 -1.855 -2.282
106 1HD1 ILE 11 1HD1 ILE 11 1.574 -2.421 -5.960
107 2HD1 ILE 11 2HD1 ILE 11 2.183 -1.217 -4.825
108 3HD1 ILE 11 3HD1 ILE 11 0.671 -2.060 -4.489
109 H GLN 12 H GLN 12 2.413 -3.847 0.436
110 HA GLN 12 HA GLN 12 4.784 -2.389 1.024
111 1HB GLN 12 2HB GLN 12 3.920 -2.069 3.151
112 2HB GLN 12 1HB GLN 12 2.464 -2.312 2.202
113 1HG GLN 12 2HG GLN 12 1.877 -3.867 3.656
114 2HG GLN 12 1HG GLN 12 3.190 -4.861 3.039
115 1HE2 GLN 12 1HE2 GLN 12 5.370 -3.427 3.964
116 2HE2 GLN 12 2HE2 GLN 12 5.408 -3.517 5.690
117 H ALA 13 H ALA 13 3.904 -5.723 1.116
118 HA ALA 13 HA ALA 13 6.206 -6.433 2.720
119 1HB ALA 13 1HB ALA 13 4.671 -8.591 1.443
120 2HB ALA 13 2HB ALA 13 3.752 -7.559 2.540
121 3HB ALA 13 3HB ALA 13 5.188 -8.404 3.119
122 H MET 14 H MET 14 5.399 -5.981 -0.542
123 HA MET 14 HA MET 14 7.241 -7.857 -1.670
124 1HB MET 14 2HB MET 14 5.674 -5.536 -2.765
125 2HB MET 14 1HB MET 14 6.884 -6.355 -3.744
126 1HG MET 14 2HG MET 14 4.976 -8.141 -2.429
127 2HG MET 14 1HG MET 14 4.262 -7.037 -3.602
128 1HE MET 14 1HE MET 14 6.949 -10.613 -4.298
129 2HE MET 14 2HE MET 14 6.471 -9.874 -2.770
130 3HE MET 14 3HE MET 14 7.826 -9.212 -3.684
131 H ILE 15 H ILE 15 7.359 -4.545 -0.549
132 HA ILE 15 HA ILE 15 9.731 -3.754 -1.857
133 HB ILE 15 HB ILE 15 8.352 -2.104 -0.785
134 1HG1 ILE 15 2HG1 ILE 15 10.902 -1.825 -0.890
135 2HG1 ILE 15 1HG1 ILE 15 10.011 -0.740 0.169
136 1HG2 ILE 15 1HG2 ILE 15 8.870 -2.314 1.953
137 2HG2 ILE 15 2HG2 ILE 15 8.415 -3.933 1.422
138 3HG2 ILE 15 3HG2 ILE 15 7.338 -2.570 1.120
139 1HD1 ILE 15 1HD1 ILE 15 11.915 -2.911 0.835
140 2HD1 ILE 15 2HD1 ILE 15 10.603 -2.584 1.966
141 3HD1 ILE 15 3HD1 ILE 15 11.736 -1.304 1.534
142 HA PRO 16 HA PRO 16 12.370 -6.715 0.317
143 1HB PRO 16 2HB PRO 16 14.655 -6.021 -1.037
144 2HB PRO 16 1HB PRO 16 13.464 -7.184 -1.626
145 1HG PRO 16 2HG PRO 16 13.836 -4.315 -2.360
146 2HG PRO 16 1HG PRO 16 13.406 -5.693 -3.387
147 1HD PRO 16 2HD PRO 16 11.585 -3.885 -2.526
148 2HD PRO 16 1HD PRO 16 11.184 -5.590 -2.811
149 H LYS 17 H LYS 17 14.342 -3.911 -0.592
150 HA LYS 17 HA LYS 17 14.451 -3.014 2.173
151 1HB LYS 17 2HB LYS 17 16.285 -4.819 1.535
152 2HB LYS 17 1HB LYS 17 17.083 -3.420 0.828
153 1HG LYS 17 2HG LYS 17 16.847 -2.284 3.052
154 2HG LYS 17 1HG LYS 17 16.305 -3.833 3.702
155 1HD LYS 17 2HD LYS 17 18.418 -4.858 2.977
156 2HD LYS 17 1HD LYS 17 18.960 -3.291 2.373
157 1HE LYS 17 2HE LYS 17 19.750 -2.810 4.390
158 2HE LYS 17 1HE LYS 17 18.113 -2.901 5.037
159 1HZ LYS 17 1HZ LYS 17 18.458 -4.956 5.872
160 2HZ LYS 17 2HZ LYS 17 20.073 -4.452 5.881
161 3HZ LYS 17 3HZ LYS 17 19.500 -5.429 4.625
162 H GLY 18 H GLY 18 13.299 -1.759 -0.031
163 1HA GLY 18 2HA GLY 18 14.790 0.717 -0.020
164 2HA GLY 18 1HA GLY 18 14.687 -0.048 -1.598
165 H GLY 19 H GLY 19 13.367 2.302 0.186
166 1HA GLY 19 2HA GLY 19 11.259 2.879 -1.478
167 2HA GLY 19 1HA GLY 19 10.573 1.853 -0.228
168 H ARG 20 H ARG 20 10.408 4.822 -1.011
169 HA ARG 20 HA ARG 20 11.053 5.957 1.625
170 1HB ARG 20 2HB ARG 20 10.445 7.434 -0.942
171 2HB ARG 20 1HB ARG 20 11.008 8.138 0.568
172 1HG ARG 20 2HG ARG 20 13.155 7.501 0.230
173 2HG ARG 20 1HG ARG 20 12.700 6.036 -0.642
174 1HD ARG 20 2HD ARG 20 12.060 7.427 -2.578
175 2HD ARG 20 1HD ARG 20 12.606 8.858 -1.704
176 HE ARG 20 HE ARG 20 14.771 7.214 -1.685
177 1HH1 ARG 20 1HH1 ARG 20 12.710 8.482 -4.200
178 2HH1 ARG 20 2HH1 ARG 20 13.964 8.495 -5.394
179 1HH2 ARG 20 1HH2 ARG 20 16.421 7.229 -3.256
180 2HH2 ARG 20 2HH2 ARG 20 16.070 7.783 -4.858
181 H MET 21 H MET 21 8.601 6.381 -0.934
182 HA MET 21 HA MET 21 6.567 6.550 1.191
183 1HB MET 21 2HB MET 21 6.584 8.728 0.363
184 2HB MET 21 1HB MET 21 6.919 8.209 -1.282
185 1HG MET 21 2HG MET 21 4.650 7.369 -1.509
186 2HG MET 21 1HG MET 21 4.297 7.807 0.159
187 1HE MET 21 1HE MET 21 6.357 10.626 -0.322
188 2HE MET 21 2HE MET 21 5.073 10.481 0.878
189 3HE MET 21 3HE MET 21 5.035 11.793 -0.301
190 H LEU 22 H LEU 22 4.381 5.966 0.460
191 HA LEU 22 HA LEU 22 4.412 3.959 -1.681
192 1HB LEU 22 2HB LEU 22 3.548 3.778 1.143
193 2HB LEU 22 1HB LEU 22 2.524 3.020 -0.055
194 HG LEU 22 HG LEU 22 5.444 2.396 0.413
195 1HD1 LEU 22 1HD1 LEU 22 3.923 1.657 2.217
196 2HD1 LEU 22 2HD1 LEU 22 4.685 0.319 1.357
197 3HD1 LEU 22 3HD1 LEU 22 3.005 0.738 1.025
198 1HD2 LEU 22 1HD2 LEU 22 5.065 0.501 -1.098
199 2HD2 LEU 22 2HD2 LEU 22 4.841 2.048 -1.914
200 3HD2 LEU 22 3HD2 LEU 22 3.438 1.096 -1.425
201 HA PRO 23 HA PRO 23 0.527 5.743 -2.869
202 1HB PRO 23 2HB PRO 23 -0.770 3.524 -3.811
203 2HB PRO 23 1HB PRO 23 0.548 4.332 -4.639
204 1HG PRO 23 2HG PRO 23 0.532 1.731 -3.406
205 2HG PRO 23 1HG PRO 23 1.793 2.479 -4.398
206 1HD PRO 23 2HD PRO 23 1.629 2.241 -1.495
207 2HD PRO 23 1HD PRO 23 2.993 2.687 -2.498
208 H GLN 24 H GLN 24 0.377 3.114 -0.618
209 HA GLN 24 HA GLN 24 -2.274 2.829 -0.089
210 1HB GLN 24 2HB GLN 24 -1.290 2.756 2.464
211 2HB GLN 24 1HB GLN 24 -1.272 1.410 1.344
212 1HG GLN 24 2HG GLN 24 0.873 1.655 2.396
213 2HG GLN 24 1HG GLN 24 1.006 1.999 0.676
214 1HE2 GLN 24 1HE2 GLN 24 2.058 2.937 3.583
215 2HE2 GLN 24 2HE2 GLN 24 2.393 4.603 3.274
216 H LEU 25 H LEU 25 -0.369 5.625 0.404
217 HA LEU 25 HA LEU 25 -2.118 6.743 2.400
218 1HB LEU 25 2HB LEU 25 0.213 7.722 0.854
219 2HB LEU 25 1HB LEU 25 -0.886 8.929 1.490
220 HG LEU 25 HG LEU 25 0.955 8.620 3.019
221 1HD1 LEU 25 1HD1 LEU 25 -1.743 8.433 3.704
222 2HD1 LEU 25 2HD1 LEU 25 -0.404 8.911 4.748
223 3HD1 LEU 25 3HD1 LEU 25 -0.924 7.227 4.698
224 1HD2 LEU 25 1HD2 LEU 25 0.151 5.720 2.963
225 2HD2 LEU 25 2HD2 LEU 25 1.217 6.417 4.183
226 3HD2 LEU 25 3HD2 LEU 25 1.696 6.423 2.486
227 H VAL 26 H VAL 26 -1.668 7.366 -1.037
228 HA VAL 26 HA VAL 26 -3.983 9.104 -1.103
229 HB VAL 26 HB VAL 26 -3.393 8.293 -3.741
230 1HG1 VAL 26 1HG1 VAL 26 -2.314 10.725 -3.651
231 2HG1 VAL 26 2HG1 VAL 26 -3.166 10.748 -2.107
232 3HG1 VAL 26 3HG1 VAL 26 -4.056 10.454 -3.601
233 1HG2 VAL 26 1HG2 VAL 26 -0.984 8.962 -3.900
234 2HG2 VAL 26 2HG2 VAL 26 -1.264 7.408 -3.114
235 3HG2 VAL 26 3HG2 VAL 26 -0.895 8.834 -2.143
236 H CYS 27 H CYS 27 -3.146 5.834 -1.548
237 HA CYS 27 HA CYS 27 -5.364 4.933 -3.007
238 1HB CYS 27 2HB CYS 27 -3.998 3.185 -2.989
239 2HB CYS 27 1HB CYS 27 -3.059 3.835 -1.680
240 H ARG 28 H ARG 28 -4.595 5.136 0.410
241 HA ARG 28 HA ARG 28 -6.972 3.939 1.244
242 1HB ARG 28 2HB ARG 28 -4.903 5.624 2.578
243 2HB ARG 28 1HB ARG 28 -6.418 5.341 3.420
244 1HG ARG 28 2HG ARG 28 -6.044 2.908 3.197
245 2HG ARG 28 1HG ARG 28 -4.478 3.247 2.466
246 1HD ARG 28 2HD ARG 28 -5.384 3.615 5.281
247 2HD ARG 28 1HD ARG 28 -3.895 2.900 4.670
248 HE ARG 28 HE ARG 28 -3.566 5.451 3.962
249 1HH1 ARG 28 1HH1 ARG 28 -4.593 4.031 6.987
250 2HH1 ARG 28 2HH1 ARG 28 -3.999 5.343 7.946
251 1HH2 ARG 28 1HH2 ARG 28 -2.797 7.180 5.228
252 2HH2 ARG 28 2HH2 ARG 28 -2.979 7.130 6.949
253 H LEU 29 H LEU 29 -6.134 7.209 0.400
254 HA LEU 29 HA LEU 29 -8.521 8.366 1.484
255 1HB LEU 29 2HB LEU 29 -6.467 9.418 -0.442
256 2HB LEU 29 1HB LEU 29 -7.821 10.370 0.138
257 HG LEU 29 HG LEU 29 -5.824 9.120 2.010
258 1HD1 LEU 29 1HD1 LEU 29 -4.347 10.500 0.994
259 2HD1 LEU 29 2HD1 LEU 29 -5.117 11.693 2.041
260 3HD1 LEU 29 3HD1 LEU 29 -5.605 11.556 0.352
261 1HD2 LEU 29 1HD2 LEU 29 -6.720 11.299 3.251
262 2HD2 LEU 29 2HD2 LEU 29 -7.543 9.743 3.353
263 3HD2 LEU 29 3HD2 LEU 29 -8.121 10.974 2.230
264 H VAL 30 H VAL 30 -7.667 6.993 -1.588
265 HA VAL 30 HA VAL 30 -10.063 8.045 -2.851
266 HB VAL 30 HB VAL 30 -8.045 6.162 -4.056
267 1HG1 VAL 30 1HG1 VAL 30 -9.811 6.064 -5.500
268 2HG1 VAL 30 2HG1 VAL 30 -8.999 7.495 -6.134
269 3HG1 VAL 30 3HG1 VAL 30 -10.396 7.671 -5.073
270 1HG2 VAL 30 1HG2 VAL 30 -7.478 8.693 -3.194
271 2HG2 VAL 30 2HG2 VAL 30 -7.961 8.974 -4.866
272 3HG2 VAL 30 3HG2 VAL 30 -6.645 7.857 -4.504
273 H LEU 31 H LEU 31 -8.751 4.849 -2.083
274 HA LEU 31 HA LEU 31 -11.146 3.581 -2.981
275 1HB LEU 31 2HB LEU 31 -8.735 2.586 -2.827
276 2HB LEU 31 1HB LEU 31 -9.223 2.163 -1.196
277 HG LEU 31 HG LEU 31 -10.951 0.728 -1.968
278 1HD1 LEU 31 1HD1 LEU 31 -12.112 1.662 -3.675
279 2HD1 LEU 31 2HD1 LEU 31 -11.112 0.560 -4.620
280 3HD1 LEU 31 3HD1 LEU 31 -10.665 2.261 -4.483
281 1HD2 LEU 31 1HD2 LEU 31 -9.180 -0.106 -4.108
282 2HD2 LEU 31 2HD2 LEU 31 -9.599 -0.921 -2.603
283 3HD2 LEU 31 3HD2 LEU 31 -8.309 0.275 -2.628
284 H ARG 32 H ARG 32 -10.257 5.089 -0.042
285 HA ARG 32 HA ARG 32 -11.919 3.574 1.702
286 1HB ARG 32 2HB ARG 32 -10.297 4.995 2.727
287 2HB ARG 32 1HB ARG 32 -10.864 6.400 1.835
288 1HG ARG 32 2HG ARG 32 -12.924 5.182 3.499
289 2HG ARG 32 1HG ARG 32 -11.526 5.750 4.413
290 1HD ARG 32 2HD ARG 32 -12.236 7.846 4.229
291 2HD ARG 32 1HD ARG 32 -12.202 7.721 2.471
292 HE ARG 32 HE ARG 32 -14.479 7.422 2.470
293 1HH1 ARG 32 1HH1 ARG 32 -13.279 7.129 5.735
294 2HH1 ARG 32 2HH1 ARG 32 -14.857 7.130 6.448
295 1HH2 ARG 32 1HH2 ARG 32 -16.555 7.419 3.407
296 2HH2 ARG 32 2HH2 ARG 32 -16.717 7.294 5.126
297 H CYS 33 H CYS 33 -12.329 6.276 -0.412
298 HA CYS 33 HA CYS 33 -14.168 7.683 -0.747
299 1HB CYS 33 2HB CYS 33 -15.003 6.808 -2.666
300 2HB CYS 33 1HB CYS 33 -13.715 5.655 -2.393
301 H SER 34 H SER 34 -16.842 6.925 -1.259
302 HA SER 34 HA SER 34 -18.874 6.832 -0.246
303 1HB SER 34 2HB SER 34 -17.469 4.641 0.743
304 2HB SER 34 1HB SER 34 -18.119 5.417 2.187
305 HG SER 34 HG SER 34 -20.142 5.096 1.470
Start of MODEL 3
1 1H CYS 1 1HT CYS 1 -13.473 -1.105 -3.054
2 2H CYS 1 2HT CYS 1 -14.791 -0.113 -3.528
3 3H CYS 1 3HT CYS 1 -14.822 -0.919 -2.013
4 HA CYS 1 HA CYS 1 -12.767 1.043 -2.732
5 1HB CYS 1 2HB CYS 1 -15.592 1.426 -2.120
6 2HB CYS 1 1HB CYS 1 -14.553 2.248 -0.961
7 H TRP 2 H TRP 2 -12.568 -1.513 -1.340
8 HA TRP 2 HA TRP 2 -11.471 -0.502 1.145
9 1HB TRP 2 2HB TRP 2 -12.639 -2.623 2.269
10 2HB TRP 2 1HB TRP 2 -13.390 -1.033 2.244
11 HD1 TRP 2 HD TRP 2 -13.421 -4.188 -0.038
12 HE1 TRP 2 1HE TRP 2 -15.830 -4.515 -0.884
13 HE3 TRP 2 3HE TRP 2 -15.607 -0.113 2.141
14 HZ2 TRP 2 2HZ TRP 2 -18.325 -3.215 -0.659
15 HZ3 TRP 2 3HZ TRP 2 -18.009 0.274 1.775
16 HH2 TRP 2 HH TRP 2 -19.339 -1.246 0.404
17 H LEU 3 H LEU 3 -10.844 -2.127 -1.489
18 HA LEU 3 HA LEU 3 -9.535 -4.444 -0.301
19 1HB LEU 3 2HB LEU 3 -8.887 -4.033 -3.085
20 2HB LEU 3 1HB LEU 3 -9.683 -5.389 -2.317
21 HG LEU 3 HG LEU 3 -11.048 -2.868 -3.269
22 1HD1 LEU 3 1HD1 LEU 3 -10.103 -4.861 -4.835
23 2HD1 LEU 3 2HD1 LEU 3 -11.526 -3.888 -5.209
24 3HD1 LEU 3 3HD1 LEU 3 -11.714 -5.470 -4.453
25 1HD2 LEU 3 1HD2 LEU 3 -13.029 -4.624 -2.920
26 2HD2 LEU 3 2HD2 LEU 3 -12.501 -3.513 -1.656
27 3HD2 LEU 3 3HD2 LEU 3 -11.934 -5.182 -1.656
28 H CYS 4 H CYS 4 -8.825 -1.291 -0.525
29 HA CYS 4 HA CYS 4 -6.356 -0.950 -1.635
30 1HB CYS 4 2HB CYS 4 -8.016 0.444 0.203
31 2HB CYS 4 1HB CYS 4 -6.370 0.479 0.827
32 H ARG 5 H ARG 5 -6.640 -1.275 1.887
33 HA ARG 5 HA ARG 5 -4.093 -1.693 2.587
34 1HB ARG 5 2HB ARG 5 -5.157 -3.482 4.281
35 2HB ARG 5 1HB ARG 5 -5.347 -1.747 4.464
36 1HG ARG 5 2HG ARG 5 -7.437 -3.022 4.779
37 2HG ARG 5 1HG ARG 5 -7.534 -1.818 3.494
38 1HD ARG 5 2HD ARG 5 -7.607 -3.402 1.832
39 2HD ARG 5 1HD ARG 5 -6.753 -4.607 2.796
40 HE ARG 5 HE ARG 5 -9.221 -4.108 4.005
41 1HH1 ARG 5 1HH1 ARG 5 -7.957 -5.517 1.073
42 2HH1 ARG 5 2HH1 ARG 5 -9.281 -6.615 0.881
43 1HH2 ARG 5 1HH2 ARG 5 -10.964 -5.552 3.754
44 2HH2 ARG 5 2HH2 ARG 5 -10.990 -6.634 2.403
45 H ALA 6 H ALA 6 -6.004 -4.042 0.842
46 HA ALA 6 HA ALA 6 -4.185 -6.217 1.336
47 1HB ALA 6 1HB ALA 6 -5.559 -7.378 -0.420
48 2HB ALA 6 2HB ALA 6 -6.535 -5.912 -0.512
49 3HB ALA 6 3HB ALA 6 -6.447 -6.818 0.998
50 H LEU 7 H LEU 7 -4.650 -3.841 -1.218
51 HA LEU 7 HA LEU 7 -2.784 -5.172 -2.990
52 1HB LEU 7 2HB LEU 7 -4.526 -4.121 -4.141
53 2HB LEU 7 1HB LEU 7 -4.441 -2.679 -3.149
54 HG LEU 7 HG LEU 7 -2.139 -3.360 -4.939
55 1HD1 LEU 7 1HD1 LEU 7 -4.842 -2.451 -5.773
56 2HD1 LEU 7 2HD1 LEU 7 -3.681 -3.475 -6.618
57 3HD1 LEU 7 3HD1 LEU 7 -3.437 -1.729 -6.555
58 1HD2 LEU 7 1HD2 LEU 7 -1.529 -1.503 -3.786
59 2HD2 LEU 7 2HD2 LEU 7 -3.194 -1.001 -3.493
60 3HD2 LEU 7 3HD2 LEU 7 -2.446 -0.703 -5.062
61 H ILE 8 H ILE 8 -2.803 -2.424 -0.816
62 HA ILE 8 HA ILE 8 -0.240 -1.477 -1.673
63 HB ILE 8 HB ILE 8 -0.407 0.135 0.148
64 1HG1 ILE 8 2HG1 ILE 8 -2.831 -0.002 1.286
65 2HG1 ILE 8 1HG1 ILE 8 -2.568 -1.721 1.014
66 1HG2 ILE 8 1HG2 ILE 8 -1.900 0.057 -2.107
67 2HG2 ILE 8 2HG2 ILE 8 -1.868 1.419 -0.992
68 3HG2 ILE 8 3HG2 ILE 8 -3.159 0.223 -0.885
69 1HD1 ILE 8 1HD1 ILE 8 -0.210 -0.609 2.153
70 2HD1 ILE 8 2HD1 ILE 8 -1.299 -1.828 2.815
71 3HD1 ILE 8 3HD1 ILE 8 -1.603 -0.116 3.115
72 H LYS 9 H LYS 9 -1.473 -3.501 0.854
73 HA LYS 9 HA LYS 9 1.017 -3.588 2.273
74 1HB LYS 9 2HB LYS 9 -0.975 -3.942 3.533
75 2HB LYS 9 1HB LYS 9 -1.466 -5.232 2.448
76 1HG LYS 9 2HG LYS 9 -0.643 -6.156 4.524
77 2HG LYS 9 1HG LYS 9 0.416 -6.593 3.189
78 1HD LYS 9 2HD LYS 9 1.532 -5.841 5.352
79 2HD LYS 9 1HD LYS 9 2.075 -5.074 3.861
80 1HE LYS 9 2HE LYS 9 1.099 -3.059 4.381
81 2HE LYS 9 1HE LYS 9 -0.122 -3.795 5.414
82 1HZ LYS 9 1HZ LYS 9 2.024 -2.502 6.331
83 2HZ LYS 9 2HZ LYS 9 2.613 -4.088 6.328
84 3HZ LYS 9 3HZ LYS 9 1.214 -3.708 7.202
85 H ARG 10 H ARG 10 -0.725 -5.523 -0.017
86 HA ARG 10 HA ARG 10 0.933 -7.772 -0.013
87 1HB ARG 10 2HB ARG 10 -1.144 -8.038 -1.092
88 2HB ARG 10 1HB ARG 10 -0.974 -6.535 -1.983
89 1HG ARG 10 2HG ARG 10 -0.737 -8.177 -3.595
90 2HG ARG 10 1HG ARG 10 0.924 -7.711 -3.235
91 1HD ARG 10 2HD ARG 10 -0.455 -10.029 -1.906
92 2HD ARG 10 1HD ARG 10 0.467 -10.196 -3.397
93 HE ARG 10 HE ARG 10 1.546 -9.489 -0.758
94 1HH1 ARG 10 1HH1 ARG 10 2.088 -10.401 -4.093
95 2HH1 ARG 10 2HH1 ARG 10 3.765 -10.750 -3.850
96 1HH2 ARG 10 1HH2 ARG 10 3.751 -9.946 -0.449
97 2HH2 ARG 10 2HH2 ARG 10 4.709 -10.497 -1.782
98 H ILE 11 H ILE 11 1.041 -4.643 -1.473
99 HA ILE 11 HA ILE 11 3.359 -5.249 -3.081
100 HB ILE 11 HB ILE 11 1.363 -3.185 -3.055
101 1HG1 ILE 11 2HG1 ILE 11 3.585 -3.650 -5.046
102 2HG1 ILE 11 1HG1 ILE 11 2.134 -4.645 -4.964
103 1HG2 ILE 11 1HG2 ILE 11 3.003 -1.824 -1.897
104 2HG2 ILE 11 2HG2 ILE 11 2.779 -1.246 -3.551
105 3HG2 ILE 11 3HG2 ILE 11 4.206 -2.196 -3.131
106 1HD1 ILE 11 1HD1 ILE 11 1.547 -3.169 -6.596
107 2HD1 ILE 11 2HD1 ILE 11 2.466 -1.843 -5.883
108 3HD1 ILE 11 3HD1 ILE 11 0.926 -2.329 -5.176
109 H GLN 12 H GLN 12 2.532 -3.458 -0.128
110 HA GLN 12 HA GLN 12 5.207 -2.432 0.108
111 1HB GLN 12 2HB GLN 12 4.497 -1.263 1.963
112 2HB GLN 12 1HB GLN 12 2.999 -1.429 1.067
113 1HG GLN 12 2HG GLN 12 2.084 -2.275 2.884
114 2HG GLN 12 1HG GLN 12 3.123 -3.685 2.705
115 1HE2 GLN 12 1HE2 GLN 12 5.559 -2.849 3.363
116 2HE2 GLN 12 2HE2 GLN 12 5.605 -2.259 4.987
117 H ALA 13 H ALA 13 3.748 -5.388 0.720
118 HA ALA 13 HA ALA 13 5.546 -6.117 2.855
119 1HB ALA 13 1HB ALA 13 4.437 -8.397 2.539
120 2HB ALA 13 2HB ALA 13 3.340 -7.569 1.435
121 3HB ALA 13 3HB ALA 13 3.422 -7.080 3.128
122 H MET 14 H MET 14 5.021 -6.693 -0.536
123 HA MET 14 HA MET 14 6.935 -8.682 -0.992
124 1HB MET 14 2HB MET 14 5.134 -7.353 -2.529
125 2HB MET 14 1HB MET 14 6.635 -6.624 -3.087
126 1HG MET 14 2HG MET 14 5.945 -9.541 -3.071
127 2HG MET 14 1HG MET 14 6.072 -8.484 -4.474
128 1HE MET 14 1HE MET 14 7.982 -11.427 -3.225
129 2HE MET 14 2HE MET 14 7.685 -10.478 -1.769
130 3HE MET 14 3HE MET 14 9.337 -10.740 -2.328
131 H ILE 15 H ILE 15 7.204 -5.198 -0.794
132 HA ILE 15 HA ILE 15 9.602 -4.575 -1.859
133 HB ILE 15 HB ILE 15 9.843 -2.778 -0.332
134 1HG1 ILE 15 2HG1 ILE 15 8.138 -4.417 1.552
135 2HG1 ILE 15 1HG1 ILE 15 9.812 -3.925 1.779
136 1HG2 ILE 15 1HG2 ILE 15 7.667 -1.774 -0.345
137 2HG2 ILE 15 2HG2 ILE 15 6.886 -3.349 -0.463
138 3HG2 ILE 15 3HG2 ILE 15 7.847 -2.738 -1.810
139 1HD1 ILE 15 1HD1 ILE 15 9.144 -1.623 2.027
140 2HD1 ILE 15 2HD1 ILE 15 8.239 -2.637 3.151
141 3HD1 ILE 15 3HD1 ILE 15 7.466 -2.044 1.680
142 HA PRO 16 HA PRO 16 12.620 -7.110 0.204
143 1HB PRO 16 2HB PRO 16 14.868 -5.824 -0.651
144 2HB PRO 16 1HB PRO 16 13.939 -6.942 -1.654
145 1HG PRO 16 2HG PRO 16 13.977 -3.964 -1.668
146 2HG PRO 16 1HG PRO 16 13.813 -5.095 -3.019
147 1HD PRO 16 2HD PRO 16 11.721 -3.720 -1.891
148 2HD PRO 16 1HD PRO 16 11.551 -5.254 -2.765
149 H LYS 17 H LYS 17 13.969 -3.810 0.170
150 HA LYS 17 HA LYS 17 13.758 -3.671 3.076
151 1HB LYS 17 2HB LYS 17 16.075 -4.610 1.987
152 2HB LYS 17 1HB LYS 17 16.411 -2.886 2.058
153 1HG LYS 17 2HG LYS 17 16.170 -2.825 4.395
154 2HG LYS 17 1HG LYS 17 15.400 -4.412 4.437
155 1HD LYS 17 2HD LYS 17 17.379 -5.527 4.250
156 2HD LYS 17 1HD LYS 17 18.136 -4.248 3.299
157 1HE LYS 17 2HE LYS 17 18.739 -3.037 5.159
158 2HE LYS 17 1HE LYS 17 17.446 -3.714 6.149
159 1HZ LYS 17 1HZ LYS 17 18.691 -5.486 6.723
160 2HZ LYS 17 2HZ LYS 17 19.980 -4.446 6.375
161 3HZ LYS 17 3HZ LYS 17 19.477 -5.581 5.226
162 H GLY 18 H GLY 18 12.214 -2.180 1.509
163 1HA GLY 18 2HA GLY 18 13.548 0.399 1.091
164 2HA GLY 18 1HA GLY 18 11.956 -0.046 0.496
165 H GLY 19 H GLY 19 12.286 2.378 1.690
166 1HA GLY 19 2HA GLY 19 10.327 2.325 3.720
167 2HA GLY 19 1HA GLY 19 11.911 2.500 4.460
168 H ARG 20 H ARG 20 9.414 4.033 2.639
169 HA ARG 20 HA ARG 20 10.488 6.629 3.256
170 1HB ARG 20 2HB ARG 20 10.288 5.705 0.387
171 2HB ARG 20 1HB ARG 20 10.403 7.395 0.855
172 1HG ARG 20 2HG ARG 20 12.564 6.868 1.973
173 2HG ARG 20 1HG ARG 20 12.454 5.239 1.304
174 1HD ARG 20 2HD ARG 20 12.652 6.015 -0.903
175 2HD ARG 20 1HD ARG 20 12.299 7.679 -0.439
176 HE ARG 20 HE ARG 20 14.579 7.167 0.901
177 1HH1 ARG 20 1HH1 ARG 20 13.668 6.746 -2.442
178 2HH1 ARG 20 2HH1 ARG 20 15.275 6.977 -3.040
179 1HH2 ARG 20 1HH2 ARG 20 16.696 7.472 0.115
180 2HH2 ARG 20 2HH2 ARG 20 16.996 7.390 -1.589
181 H MET 21 H MET 21 8.329 5.582 0.642
182 HA MET 21 HA MET 21 5.972 6.367 2.149
183 1HB MET 21 2HB MET 21 5.753 8.394 1.219
184 2HB MET 21 1HB MET 21 7.210 8.143 0.271
185 1HG MET 21 2HG MET 21 5.784 6.919 -1.413
186 2HG MET 21 1HG MET 21 4.379 7.456 -0.503
187 1HE MET 21 1HE MET 21 7.731 8.822 -1.965
188 2HE MET 21 2HE MET 21 7.446 9.929 -0.623
189 3HE MET 21 3HE MET 21 7.341 10.513 -2.283
190 H LEU 22 H LEU 22 3.979 6.109 0.649
191 HA LEU 22 HA LEU 22 4.351 4.214 -1.474
192 1HB LEU 22 2HB LEU 22 2.423 3.231 0.513
193 2HB LEU 22 1HB LEU 22 3.494 2.390 -0.579
194 HG LEU 22 HG LEU 22 5.395 2.995 0.986
195 1HD1 LEU 22 1HD1 LEU 22 5.043 4.125 2.881
196 2HD1 LEU 22 2HD1 LEU 22 3.567 3.230 3.245
197 3HD1 LEU 22 3HD1 LEU 22 3.512 4.614 2.153
198 1HD2 LEU 22 1HD2 LEU 22 3.221 1.051 1.438
199 2HD2 LEU 22 2HD2 LEU 22 4.338 1.304 2.780
200 3HD2 LEU 22 3HD2 LEU 22 4.950 0.793 1.207
201 HA PRO 23 HA PRO 23 0.370 5.685 -2.721
202 1HB PRO 23 2HB PRO 23 -0.914 3.548 -3.707
203 2HB PRO 23 1HB PRO 23 0.578 4.152 -4.423
204 1HG PRO 23 2HG PRO 23 0.124 1.740 -2.807
205 2HG PRO 23 1HG PRO 23 1.377 2.071 -4.013
206 1HD PRO 23 2HD PRO 23 1.591 2.239 -1.175
207 2HD PRO 23 1HD PRO 23 2.808 2.652 -2.367
208 H GLN 24 H GLN 24 0.163 3.037 -0.483
209 HA GLN 24 HA GLN 24 -2.459 2.789 0.089
210 1HB GLN 24 2HB GLN 24 -1.822 1.720 1.988
211 2HB GLN 24 1HB GLN 24 -0.238 1.839 1.240
212 1HG GLN 24 2HG GLN 24 -1.352 3.717 3.315
213 2HG GLN 24 1HG GLN 24 -0.180 2.434 3.602
214 1HE2 GLN 24 1HE2 GLN 24 1.108 4.189 4.478
215 2HE2 GLN 24 2HE2 GLN 24 2.064 5.148 3.406
216 H LEU 25 H LEU 25 -0.532 5.582 0.574
217 HA LEU 25 HA LEU 25 -2.348 6.735 2.500
218 1HB LEU 25 2HB LEU 25 -1.046 8.824 2.162
219 2HB LEU 25 1HB LEU 25 -0.079 7.439 2.630
220 HG LEU 25 HG LEU 25 0.069 7.340 -0.111
221 1HD1 LEU 25 1HD1 LEU 25 -1.065 9.495 -0.319
222 2HD1 LEU 25 2HD1 LEU 25 0.609 9.590 -0.866
223 3HD1 LEU 25 3HD1 LEU 25 0.157 10.239 0.711
224 1HD2 LEU 25 1HD2 LEU 25 1.922 8.760 1.799
225 2HD2 LEU 25 2HD2 LEU 25 2.348 8.173 0.192
226 3HD2 LEU 25 3HD2 LEU 25 1.908 7.030 1.460
227 H VAL 26 H VAL 26 -1.792 7.142 -0.935
228 HA VAL 26 HA VAL 26 -3.978 9.043 -1.165
229 HB VAL 26 HB VAL 26 -3.530 8.316 -3.730
230 1HG1 VAL 26 1HG1 VAL 26 -1.712 10.273 -2.358
231 2HG1 VAL 26 2HG1 VAL 26 -3.431 10.582 -2.593
232 3HG1 VAL 26 3HG1 VAL 26 -2.377 10.351 -3.989
233 1HG2 VAL 26 1HG2 VAL 26 -1.156 8.002 -4.126
234 2HG2 VAL 26 2HG2 VAL 26 -1.776 6.706 -3.104
235 3HG2 VAL 26 3HG2 VAL 26 -0.841 8.020 -2.391
236 H CYS 27 H CYS 27 -3.260 5.729 -1.533
237 HA CYS 27 HA CYS 27 -5.495 4.829 -2.938
238 1HB CYS 27 2HB CYS 27 -4.242 2.996 -2.809
239 2HB CYS 27 1HB CYS 27 -3.189 3.762 -1.656
240 H ARG 28 H ARG 28 -4.743 5.134 0.472
241 HA ARG 28 HA ARG 28 -7.157 4.038 1.357
242 1HB ARG 28 2HB ARG 28 -5.001 5.669 2.616
243 2HB ARG 28 1HB ARG 28 -6.526 5.515 3.476
244 1HG ARG 28 2HG ARG 28 -6.286 3.043 3.335
245 2HG ARG 28 1HG ARG 28 -4.687 3.282 2.635
246 1HD ARG 28 2HD ARG 28 -4.720 4.886 4.915
247 2HD ARG 28 1HD ARG 28 -5.531 3.397 5.399
248 HE ARG 28 HE ARG 28 -2.744 3.730 4.727
249 1HH1 ARG 28 1HH1 ARG 28 -5.387 1.466 5.040
250 2HH1 ARG 28 2HH1 ARG 28 -4.352 0.099 5.279
251 1HH2 ARG 28 1HH2 ARG 28 -1.383 1.929 5.047
252 2HH2 ARG 28 2HH2 ARG 28 -2.079 0.361 5.280
253 H LEU 29 H LEU 29 -6.178 7.252 0.449
254 HA LEU 29 HA LEU 29 -8.546 8.532 1.452
255 1HB LEU 29 2HB LEU 29 -6.382 9.439 -0.427
256 2HB LEU 29 1HB LEU 29 -7.734 10.459 0.028
257 HG LEU 29 HG LEU 29 -5.951 9.253 2.119
258 1HD1 LEU 29 1HD1 LEU 29 -4.835 10.721 0.192
259 2HD1 LEU 29 2HD1 LEU 29 -4.332 10.818 1.880
260 3HD1 LEU 29 3HD1 LEU 29 -5.437 12.022 1.219
261 1HD2 LEU 29 1HD2 LEU 29 -7.658 10.194 3.271
262 2HD2 LEU 29 2HD2 LEU 29 -8.065 11.312 1.970
263 3HD2 LEU 29 3HD2 LEU 29 -6.700 11.656 3.033
264 H VAL 30 H VAL 30 -7.596 7.147 -1.595
265 HA VAL 30 HA VAL 30 -9.947 8.193 -2.946
266 HB VAL 30 HB VAL 30 -7.862 6.328 -4.060
267 1HG1 VAL 30 1HG1 VAL 30 -9.678 6.260 -5.511
268 2HG1 VAL 30 2HG1 VAL 30 -8.653 7.514 -6.209
269 3HG1 VAL 30 3HG1 VAL 30 -10.069 7.961 -5.258
270 1HG2 VAL 30 1HG2 VAL 30 -7.335 8.838 -3.142
271 2HG2 VAL 30 2HG2 VAL 30 -7.752 9.157 -4.825
272 3HG2 VAL 30 3HG2 VAL 30 -6.448 8.034 -4.436
273 H LEU 31 H LEU 31 -8.658 5.021 -2.085
274 HA LEU 31 HA LEU 31 -10.931 3.691 -3.151
275 1HB LEU 31 2HB LEU 31 -8.480 2.819 -2.578
276 2HB LEU 31 1HB LEU 31 -9.305 2.288 -1.122
277 HG LEU 31 HG LEU 31 -10.842 0.945 -2.408
278 1HD1 LEU 31 1HD1 LEU 31 -9.590 2.324 -4.754
279 2HD1 LEU 31 2HD1 LEU 31 -11.297 2.140 -4.350
280 3HD1 LEU 31 3HD1 LEU 31 -10.374 0.754 -4.930
281 1HD2 LEU 31 1HD2 LEU 31 -8.554 0.071 -1.880
282 2HD2 LEU 31 2HD2 LEU 31 -8.097 0.459 -3.536
283 3HD2 LEU 31 3HD2 LEU 31 -9.368 -0.723 -3.223
284 H ARG 32 H ARG 32 -10.259 5.150 -0.084
285 HA ARG 32 HA ARG 32 -12.134 3.732 1.475
286 1HB ARG 32 2HB ARG 32 -10.595 5.286 2.547
287 2HB ARG 32 1HB ARG 32 -11.279 6.631 1.644
288 1HG ARG 32 2HG ARG 32 -13.015 5.003 3.450
289 2HG ARG 32 1HG ARG 32 -11.962 6.252 4.115
290 1HD ARG 32 2HD ARG 32 -13.343 7.302 1.843
291 2HD ARG 32 1HD ARG 32 -14.509 6.551 2.930
292 HE ARG 32 HE ARG 32 -12.604 8.321 4.197
293 1HH1 ARG 32 1HH1 ARG 32 -15.763 8.015 2.735
294 2HH1 ARG 32 2HH1 ARG 32 -16.398 9.420 3.521
295 1HH2 ARG 32 1HH2 ARG 32 -13.445 10.167 5.231
296 2HH2 ARG 32 2HH2 ARG 32 -15.085 10.639 4.937
297 H CYS 33 H CYS 33 -12.346 6.627 -0.452
298 HA CYS 33 HA CYS 33 -14.146 7.884 -1.152
299 1HB CYS 33 2HB CYS 33 -14.880 6.885 -3.085
300 2HB CYS 33 1HB CYS 33 -13.516 5.855 -2.700
301 H SER 34 H SER 34 -16.753 7.041 -1.852
302 HA SER 34 HA SER 34 -18.860 6.880 -1.012
303 1HB SER 34 2HB SER 34 -17.504 4.788 0.148
304 2HB SER 34 1HB SER 34 -18.157 5.632 1.552
305 HG SER 34 HG SER 34 -20.212 5.409 0.698
Start of MODEL 4
1 1H CYS 1 1HT CYS 1 -11.819 -0.108 -3.917
2 2H CYS 1 2HT CYS 1 -12.540 1.034 -4.975
3 3H CYS 1 3HT CYS 1 -13.459 -0.288 -4.382
4 HA CYS 1 HA CYS 1 -12.345 1.926 -2.792
5 1HB CYS 1 2HB CYS 1 -14.349 2.263 -4.412
6 2HB CYS 1 1HB CYS 1 -15.248 1.280 -3.262
7 H TRP 2 H TRP 2 -11.539 -0.524 -1.998
8 HA TRP 2 HA TRP 2 -12.434 -0.778 0.599
9 1HB TRP 2 2HB TRP 2 -14.314 -1.887 -1.222
10 2HB TRP 2 1HB TRP 2 -13.561 -3.227 -0.364
11 HD1 TRP 2 HD TRP 2 -13.311 -2.231 2.517
12 HE1 TRP 2 1HE TRP 2 -15.375 -1.649 3.937
13 HE3 TRP 2 3HE TRP 2 -16.677 -1.400 -1.242
14 HZ2 TRP 2 2HZ TRP 2 -18.073 -0.934 3.522
15 HZ3 TRP 2 3HZ TRP 2 -18.980 -0.771 -0.643
16 HH2 TRP 2 HH TRP 2 -19.662 -0.543 1.690
17 H LEU 3 H LEU 3 -11.057 -2.329 -2.205
18 HA LEU 3 HA LEU 3 -9.818 -4.467 -0.742
19 1HB LEU 3 2HB LEU 3 -9.073 -3.580 -3.510
20 2HB LEU 3 1HB LEU 3 -8.928 -5.179 -2.804
21 HG LEU 3 HG LEU 3 -11.510 -3.800 -3.549
22 1HD1 LEU 3 1HD1 LEU 3 -9.732 -5.733 -4.906
23 2HD1 LEU 3 2HD1 LEU 3 -10.799 -4.501 -5.580
24 3HD1 LEU 3 3HD1 LEU 3 -11.467 -6.031 -5.012
25 1HD2 LEU 3 1HD2 LEU 3 -12.247 -6.315 -3.141
26 2HD2 LEU 3 2HD2 LEU 3 -12.240 -5.119 -1.844
27 3HD2 LEU 3 3HD2 LEU 3 -10.902 -6.257 -2.000
28 H CYS 4 H CYS 4 -9.057 -1.271 -0.732
29 HA CYS 4 HA CYS 4 -6.443 -0.909 -1.350
30 1HB CYS 4 2HB CYS 4 -8.287 0.291 0.523
31 2HB CYS 4 1HB CYS 4 -6.645 0.313 1.158
32 H ARG 5 H ARG 5 -7.097 -1.418 2.080
33 HA ARG 5 HA ARG 5 -4.774 -2.083 3.106
34 1HB ARG 5 2HB ARG 5 -6.030 -3.968 4.433
35 2HB ARG 5 1HB ARG 5 -6.437 -2.274 4.658
36 1HG ARG 5 2HG ARG 5 -8.536 -2.698 4.117
37 2HG ARG 5 1HG ARG 5 -8.026 -3.274 2.529
38 1HD ARG 5 2HD ARG 5 -7.395 -5.394 4.134
39 2HD ARG 5 1HD ARG 5 -8.854 -4.773 4.904
40 HE ARG 5 HE ARG 5 -9.041 -5.099 2.041
41 1HH1 ARG 5 1HH1 ARG 5 -9.507 -6.604 5.158
42 2HH1 ARG 5 2HH1 ARG 5 -10.662 -7.751 4.569
43 1HH2 ARG 5 1HH2 ARG 5 -10.558 -6.607 1.268
44 2HH2 ARG 5 2HH2 ARG 5 -11.257 -7.753 2.359
45 H ALA 6 H ALA 6 -6.553 -4.311 1.031
46 HA ALA 6 HA ALA 6 -4.929 -6.571 1.450
47 1HB ALA 6 1HB ALA 6 -5.934 -6.958 -1.052
48 2HB ALA 6 2HB ALA 6 -7.073 -5.795 -0.371
49 3HB ALA 6 3HB ALA 6 -6.775 -7.324 0.455
50 H LEU 7 H LEU 7 -4.928 -4.364 -1.391
51 HA LEU 7 HA LEU 7 -2.520 -5.586 -2.361
52 1HB LEU 7 2HB LEU 7 -2.795 -4.389 -4.317
53 2HB LEU 7 1HB LEU 7 -4.434 -4.663 -3.771
54 HG LEU 7 HG LEU 7 -4.264 -2.437 -4.651
55 1HD1 LEU 7 1HD1 LEU 7 -5.538 -2.936 -2.470
56 2HD1 LEU 7 2HD1 LEU 7 -5.278 -1.260 -2.951
57 3HD1 LEU 7 3HD1 LEU 7 -4.263 -1.986 -1.707
58 1HD2 LEU 7 1HD2 LEU 7 -1.691 -2.426 -3.857
59 2HD2 LEU 7 2HD2 LEU 7 -2.419 -1.429 -2.595
60 3HD2 LEU 7 3HD2 LEU 7 -2.594 -0.974 -4.291
61 H ILE 8 H ILE 8 -3.131 -3.021 -0.215
62 HA ILE 8 HA ILE 8 -0.750 -1.562 -0.845
63 HB ILE 8 HB ILE 8 -1.177 -0.313 1.255
64 1HG1 ILE 8 2HG1 ILE 8 -3.887 -1.360 1.569
65 2HG1 ILE 8 1HG1 ILE 8 -2.648 -2.542 1.973
66 1HG2 ILE 8 1HG2 ILE 8 -2.367 -0.077 -1.143
67 2HG2 ILE 8 2HG2 ILE 8 -2.636 1.032 0.197
68 3HG2 ILE 8 3HG2 ILE 8 -3.786 -0.266 -0.112
69 1HD1 ILE 8 1HD1 ILE 8 -3.618 -0.402 3.535
70 2HD1 ILE 8 2HD1 ILE 8 -1.929 -0.065 3.155
71 3HD1 ILE 8 3HD1 ILE 8 -2.371 -1.581 3.940
72 H LYS 9 H LYS 9 -1.697 -4.057 1.370
73 HA LYS 9 HA LYS 9 0.756 -3.979 2.854
74 1HB LYS 9 2HB LYS 9 -1.289 -4.861 3.856
75 2HB LYS 9 1HB LYS 9 -1.333 -6.137 2.654
76 1HG LYS 9 2HG LYS 9 -0.429 -7.187 4.510
77 2HG LYS 9 1HG LYS 9 0.980 -6.788 3.527
78 1HD LYS 9 2HD LYS 9 0.975 -6.300 6.107
79 2HD LYS 9 1HD LYS 9 1.702 -5.154 4.985
80 1HE LYS 9 2HE LYS 9 -0.163 -3.703 5.105
81 2HE LYS 9 1HE LYS 9 -1.147 -4.923 5.913
82 1HZ LYS 9 1HZ LYS 9 1.294 -3.730 7.106
83 2HZ LYS 9 2HZ LYS 9 0.157 -4.720 7.874
84 3HZ LYS 9 3HZ LYS 9 -0.270 -3.154 7.399
85 H ARG 10 H ARG 10 -0.622 -5.747 0.199
86 HA ARG 10 HA ARG 10 1.384 -7.653 -0.170
87 1HB ARG 10 2HB ARG 10 -0.671 -7.893 -1.385
88 2HB ARG 10 1HB ARG 10 -0.522 -6.286 -2.079
89 1HG ARG 10 2HG ARG 10 -0.068 -8.207 -3.622
90 2HG ARG 10 1HG ARG 10 1.184 -6.967 -3.544
91 1HD ARG 10 2HD ARG 10 1.873 -9.464 -3.493
92 2HD ARG 10 1HD ARG 10 2.651 -8.338 -2.385
93 HE ARG 10 HE ARG 10 0.691 -9.249 -0.848
94 1HH1 ARG 10 1HH1 ARG 10 2.865 -10.987 -2.959
95 2HH1 ARG 10 2HH1 ARG 10 2.819 -12.434 -2.011
96 1HH2 ARG 10 1HH2 ARG 10 0.644 -11.140 0.398
97 2HH2 ARG 10 2HH2 ARG 10 1.558 -12.523 -0.106
98 H ILE 11 H ILE 11 1.086 -4.287 -0.820
99 HA ILE 11 HA ILE 11 3.295 -3.986 -2.548
100 HB ILE 11 HB ILE 11 1.427 -2.236 -1.181
101 1HG1 ILE 11 2HG1 ILE 11 1.598 -2.506 -3.622
102 2HG1 ILE 11 1HG1 ILE 11 1.795 -0.826 -3.138
103 1HG2 ILE 11 1HG2 ILE 11 3.334 -1.564 0.150
104 2HG2 ILE 11 2HG2 ILE 11 2.896 -0.275 -0.972
105 3HG2 ILE 11 3HG2 ILE 11 4.290 -1.304 -1.309
106 1HD1 ILE 11 1HD1 ILE 11 3.349 -1.645 -4.926
107 2HD1 ILE 11 2HD1 ILE 11 4.113 -2.650 -3.695
108 3HD1 ILE 11 3HD1 ILE 11 4.123 -0.894 -3.531
109 H GLN 12 H GLN 12 2.835 -3.891 0.966
110 HA GLN 12 HA GLN 12 5.414 -3.057 1.673
111 1HB GLN 12 2HB GLN 12 4.865 -3.612 3.844
112 2HB GLN 12 1HB GLN 12 3.264 -3.494 3.138
113 1HG GLN 12 2HG GLN 12 2.808 -5.591 3.667
114 2HG GLN 12 1HG GLN 12 4.262 -6.180 2.879
115 1HE2 GLN 12 1HE2 GLN 12 6.283 -5.969 4.142
116 2HE2 GLN 12 2HE2 GLN 12 6.199 -6.230 5.848
117 H ALA 13 H ALA 13 4.155 -6.043 0.500
118 HA ALA 13 HA ALA 13 6.383 -7.657 1.224
119 1HB ALA 13 1HB ALA 13 4.753 -8.495 -1.082
120 2HB ALA 13 2HB ALA 13 3.874 -8.243 0.425
121 3HB ALA 13 3HB ALA 13 5.211 -9.391 0.366
122 H MET 14 H MET 14 5.513 -5.623 -1.447
123 HA MET 14 HA MET 14 7.348 -6.527 -3.354
124 1HB MET 14 2HB MET 14 6.856 -4.632 -4.569
125 2HB MET 14 1HB MET 14 5.455 -4.713 -3.519
126 1HG MET 14 2HG MET 14 5.855 -2.658 -2.826
127 2HG MET 14 1HG MET 14 7.410 -3.167 -2.185
128 1HE MET 14 1HE MET 14 6.646 0.011 -3.918
129 2HE MET 14 2HE MET 14 8.408 0.083 -3.853
130 3HE MET 14 3HE MET 14 7.503 -0.586 -2.496
131 H ILE 15 H ILE 15 7.745 -4.623 -0.461
132 HA ILE 15 HA ILE 15 10.618 -4.937 -0.688
133 HB ILE 15 HB ILE 15 11.159 -2.571 -0.272
134 1HG1 ILE 15 2HG1 ILE 15 8.252 -2.066 -0.948
135 2HG1 ILE 15 1HG1 ILE 15 8.987 -1.842 0.633
136 1HG2 ILE 15 1HG2 ILE 15 10.864 -1.808 -2.564
137 2HG2 ILE 15 2HG2 ILE 15 9.642 -3.050 -2.829
138 3HG2 ILE 15 3HG2 ILE 15 11.314 -3.512 -2.515
139 1HD1 ILE 15 1HD1 ILE 15 10.562 -0.209 -0.560
140 2HD1 ILE 15 2HD1 ILE 15 8.901 0.295 -0.249
141 3HD1 ILE 15 3HD1 ILE 15 9.372 -0.243 -1.861
142 HA PRO 16 HA PRO 16 9.546 -5.310 3.665
143 1HB PRO 16 2HB PRO 16 11.532 -6.954 4.361
144 2HB PRO 16 1HB PRO 16 10.173 -7.523 3.384
145 1HG PRO 16 2HG PRO 16 12.943 -6.793 2.537
146 2HG PRO 16 1HG PRO 16 11.908 -8.116 1.970
147 1HD PRO 16 2HD PRO 16 12.265 -5.687 0.667
148 2HD PRO 16 1HD PRO 16 10.908 -6.800 0.406
149 H LYS 17 H LYS 17 12.898 -4.799 2.573
150 HA LYS 17 HA LYS 17 13.324 -3.067 4.916
151 1HB LYS 17 2HB LYS 17 14.808 -5.211 4.152
152 2HB LYS 17 1HB LYS 17 15.663 -3.915 3.327
153 1HG LYS 17 2HG LYS 17 16.106 -2.789 5.366
154 2HG LYS 17 1HG LYS 17 15.008 -3.843 6.259
155 1HD LYS 17 2HD LYS 17 16.478 -5.751 5.804
156 2HD LYS 17 1HD LYS 17 17.575 -4.691 4.917
157 1HE LYS 17 2HE LYS 17 17.904 -3.369 6.979
158 2HE LYS 17 1HE LYS 17 16.879 -4.512 7.847
159 1HZ LYS 17 1HZ LYS 17 18.444 -6.210 7.591
160 2HZ LYS 17 2HZ LYS 17 19.372 -4.854 7.990
161 3HZ LYS 17 3HZ LYS 17 19.298 -5.385 6.385
162 H GLY 18 H GLY 18 11.923 -1.969 2.829
163 1HA GLY 18 2HA GLY 18 13.808 -0.495 1.162
164 2HA GLY 18 1HA GLY 18 12.056 -0.460 1.033
165 H GLY 19 H GLY 19 12.169 1.839 0.888
166 1HA GLY 19 2HA GLY 19 11.612 3.203 3.240
167 2HA GLY 19 1HA GLY 19 13.325 3.440 2.932
168 H ARG 20 H ARG 20 10.266 4.640 2.374
169 HA ARG 20 HA ARG 20 11.105 6.859 0.930
170 1HB ARG 20 2HB ARG 20 10.943 4.613 -0.734
171 2HB ARG 20 1HB ARG 20 9.487 5.536 -1.077
172 1HG ARG 20 2HG ARG 20 10.664 6.884 -2.370
173 2HG ARG 20 1HG ARG 20 11.618 7.378 -0.971
174 1HD ARG 20 2HD ARG 20 12.626 4.877 -1.708
175 2HD ARG 20 1HD ARG 20 12.367 5.738 -3.224
176 HE ARG 20 HE ARG 20 13.706 7.325 -1.252
177 1HH1 ARG 20 1HH1 ARG 20 14.156 4.904 -3.723
178 2HH1 ARG 20 2HH1 ARG 20 15.814 5.316 -4.003
179 1HH2 ARG 20 1HH2 ARG 20 15.886 7.873 -1.621
180 2HH2 ARG 20 2HH2 ARG 20 16.797 7.002 -2.809
181 H MET 21 H MET 21 8.254 4.856 0.263
182 HA MET 21 HA MET 21 6.481 6.002 2.073
183 1HB MET 21 2HB MET 21 6.785 8.118 0.973
184 2HB MET 21 1HB MET 21 6.575 7.386 -0.611
185 1HG MET 21 2HG MET 21 4.272 7.110 -0.309
186 2HG MET 21 1HG MET 21 4.382 7.352 1.433
187 1HE MET 21 1HE MET 21 5.600 9.377 2.323
188 2HE MET 21 2HE MET 21 4.888 10.960 2.009
189 3HE MET 21 3HE MET 21 6.359 10.471 1.167
190 H LEU 22 H LEU 22 4.162 5.511 1.471
191 HA LEU 22 HA LEU 22 4.102 3.227 -0.369
192 1HB LEU 22 2HB LEU 22 3.071 3.615 2.345
193 2HB LEU 22 1HB LEU 22 1.916 2.930 1.214
194 HG LEU 22 HG LEU 22 4.109 1.390 0.715
195 1HD1 LEU 22 1HD1 LEU 22 5.589 1.918 2.349
196 2HD1 LEU 22 2HD1 LEU 22 4.624 0.746 3.247
197 3HD1 LEU 22 3HD1 LEU 22 4.336 2.472 3.460
198 1HD2 LEU 22 1HD2 LEU 22 2.093 0.297 0.962
199 2HD2 LEU 22 2HD2 LEU 22 1.739 1.075 2.505
200 3HD2 LEU 22 3HD2 LEU 22 2.951 -0.204 2.419
201 HA PRO 23 HA PRO 23 0.593 5.028 -2.352
202 1HB PRO 23 2HB PRO 23 -0.721 2.754 -3.079
203 2HB PRO 23 1HB PRO 23 0.768 3.321 -3.820
204 1HG PRO 23 2HG PRO 23 0.350 0.996 -2.157
205 2HG PRO 23 1HG PRO 23 1.788 1.454 -3.081
206 1HD PRO 23 2HD PRO 23 1.240 1.791 -0.236
207 2HD PRO 23 1HD PRO 23 2.757 1.952 -1.096
208 H GLN 24 H GLN 24 -0.008 2.888 0.291
209 HA GLN 24 HA GLN 24 -2.720 2.800 0.517
210 1HB GLN 24 2HB GLN 24 -2.343 2.724 2.999
211 2HB GLN 24 1HB GLN 24 -1.356 1.598 2.077
212 1HG GLN 24 2HG GLN 24 0.286 2.407 3.374
213 2HG GLN 24 1HG GLN 24 0.320 3.690 2.167
214 1HE2 GLN 24 1HE2 GLN 24 1.028 3.678 5.037
215 2HE2 GLN 24 2HE2 GLN 24 0.087 4.943 5.746
216 H LEU 25 H LEU 25 -0.641 5.513 0.850
217 HA LEU 25 HA LEU 25 -2.508 7.092 2.341
218 1HB LEU 25 2HB LEU 25 -1.060 8.987 1.854
219 2HB LEU 25 1HB LEU 25 -0.129 7.604 2.398
220 HG LEU 25 HG LEU 25 -0.014 7.243 -0.286
221 1HD1 LEU 25 1HD1 LEU 25 0.291 9.300 -1.419
222 2HD1 LEU 25 2HD1 LEU 25 0.170 10.224 0.078
223 3HD1 LEU 25 3HD1 LEU 25 -1.254 9.415 -0.576
224 1HD2 LEU 25 1HD2 LEU 25 2.236 7.937 -0.135
225 2HD2 LEU 25 2HD2 LEU 25 1.809 7.320 1.462
226 3HD2 LEU 25 3HD2 LEU 25 1.881 9.059 1.178
227 H VAL 26 H VAL 26 -1.764 6.822 -1.075
228 HA VAL 26 HA VAL 26 -3.788 8.797 -1.747
229 HB VAL 26 HB VAL 26 -3.305 7.702 -4.130
230 1HG1 VAL 26 1HG1 VAL 26 -2.055 9.574 -4.608
231 2HG1 VAL 26 2HG1 VAL 26 -1.167 9.501 -3.086
232 3HG1 VAL 26 3HG1 VAL 26 -2.840 10.061 -3.105
233 1HG2 VAL 26 1HG2 VAL 26 -1.808 5.967 -3.232
234 2HG2 VAL 26 2HG2 VAL 26 -0.716 7.228 -2.658
235 3HG2 VAL 26 3HG2 VAL 26 -0.995 7.023 -4.386
236 H CYS 27 H CYS 27 -3.257 5.423 -1.584
237 HA CYS 27 HA CYS 27 -5.529 4.476 -2.898
238 1HB CYS 27 2HB CYS 27 -4.416 2.604 -2.493
239 2HB CYS 27 1HB CYS 27 -3.327 3.442 -1.431
240 H ARG 28 H ARG 28 -4.852 5.185 0.483
241 HA ARG 28 HA ARG 28 -7.426 4.389 1.305
242 1HB ARG 28 2HB ARG 28 -5.253 5.979 2.635
243 2HB ARG 28 1HB ARG 28 -6.821 5.775 3.405
244 1HG ARG 28 2HG ARG 28 -6.499 3.542 3.791
245 2HG ARG 28 1HG ARG 28 -5.400 3.342 2.432
246 1HD ARG 28 2HD ARG 28 -4.516 3.304 4.908
247 2HD ARG 28 1HD ARG 28 -3.582 4.068 3.629
248 HE ARG 28 HE ARG 28 -4.045 6.148 4.542
249 1HH1 ARG 28 1HH1 ARG 28 -5.795 3.653 6.253
250 2HH1 ARG 28 2HH1 ARG 28 -6.231 4.692 7.567
251 1HH2 ARG 28 1HH2 ARG 28 -4.630 7.510 6.265
252 2HH2 ARG 28 2HH2 ARG 28 -5.574 6.880 7.572
253 H LEU 29 H LEU 29 -6.099 7.337 0.063
254 HA LEU 29 HA LEU 29 -8.329 8.961 0.873
255 1HB LEU 29 2HB LEU 29 -5.973 9.413 -0.923
256 2HB LEU 29 1HB LEU 29 -7.261 10.596 -0.794
257 HG LEU 29 HG LEU 29 -5.789 9.612 1.635
258 1HD1 LEU 29 1HD1 LEU 29 -4.207 10.536 -0.085
259 2HD1 LEU 29 2HD1 LEU 29 -4.236 11.394 1.455
260 3HD1 LEU 29 3HD1 LEU 29 -5.068 12.068 0.054
261 1HD2 LEU 29 1HD2 LEU 29 -7.533 10.781 2.474
262 2HD2 LEU 29 2HD2 LEU 29 -7.761 11.715 0.996
263 3HD2 LEU 29 3HD2 LEU 29 -6.481 12.153 2.126
264 H VAL 30 H VAL 30 -7.389 7.227 -2.008
265 HA VAL 30 HA VAL 30 -9.646 8.276 -3.522
266 HB VAL 30 HB VAL 30 -7.614 6.211 -4.377
267 1HG1 VAL 30 1HG1 VAL 30 -9.276 5.996 -5.933
268 2HG1 VAL 30 2HG1 VAL 30 -8.365 7.321 -6.657
269 3HG1 VAL 30 3HG1 VAL 30 -9.831 7.658 -5.737
270 1HG2 VAL 30 1HG2 VAL 30 -6.867 8.649 -3.695
271 2HG2 VAL 30 2HG2 VAL 30 -7.498 9.043 -5.293
272 3HG2 VAL 30 3HG2 VAL 30 -6.206 7.854 -5.124
273 H LEU 31 H LEU 31 -8.638 5.269 -2.052
274 HA LEU 31 HA LEU 31 -10.928 3.890 -3.127
275 1HB LEU 31 2HB LEU 31 -8.440 3.063 -2.391
276 2HB LEU 31 1HB LEU 31 -9.411 2.520 -1.035
277 HG LEU 31 HG LEU 31 -10.711 1.106 -2.390
278 1HD1 LEU 31 1HD1 LEU 31 -11.274 2.402 -4.268
279 2HD1 LEU 31 2HD1 LEU 31 -10.336 1.056 -4.911
280 3HD1 LEU 31 3HD1 LEU 31 -9.584 2.638 -4.713
281 1HD2 LEU 31 1HD2 LEU 31 -7.837 1.023 -3.259
282 2HD2 LEU 31 2HD2 LEU 31 -9.005 -0.241 -3.648
283 3HD2 LEU 31 3HD2 LEU 31 -8.606 0.106 -1.966
284 H ARG 32 H ARG 32 -10.272 5.715 -0.325
285 HA ARG 32 HA ARG 32 -12.119 4.440 1.438
286 1HB ARG 32 2HB ARG 32 -10.564 5.891 2.477
287 2HB ARG 32 1HB ARG 32 -10.901 7.196 1.349
288 1HG ARG 32 2HG ARG 32 -13.150 6.285 3.039
289 2HG ARG 32 1HG ARG 32 -11.837 7.144 3.844
290 1HD ARG 32 2HD ARG 32 -12.542 9.095 3.041
291 2HD ARG 32 1HD ARG 32 -12.543 8.471 1.393
292 HE ARG 32 HE ARG 32 -14.809 8.083 1.557
293 1HH1 ARG 32 1HH1 ARG 32 -13.534 8.942 4.693
294 2HH1 ARG 32 2HH1 ARG 32 -15.097 9.156 5.405
295 1HH2 ARG 32 1HH2 ARG 32 -16.862 8.363 2.495
296 2HH2 ARG 32 2HH2 ARG 32 -16.985 8.827 4.160
297 H CYS 33 H CYS 33 -12.497 6.033 -1.432
298 HA CYS 33 HA CYS 33 -14.503 7.753 -1.493
299 1HB CYS 33 2HB CYS 33 -14.641 7.212 -3.694
300 2HB CYS 33 1HB CYS 33 -13.266 6.201 -3.309
301 H SER 34 H SER 34 -16.847 7.533 -1.983
302 HA SER 34 HA SER 34 -18.963 6.932 -1.399
303 1HB SER 34 2HB SER 34 -18.124 4.718 -2.404
304 2HB SER 34 1HB SER 34 -17.934 4.176 -0.737
305 HG SER 34 HG SER 34 -20.080 4.244 -0.449
Start of MODEL 5
1 1H CYS 1 1HT CYS 1 -12.828 -1.801 -4.114
2 2H CYS 1 2HT CYS 1 -14.148 -1.492 -5.167
3 3H CYS 1 3HT CYS 1 -14.418 -2.245 -3.648
4 HA CYS 1 HA CYS 1 -13.544 0.514 -4.169
5 1HB CYS 1 2HB CYS 1 -15.917 0.120 -4.493
6 2HB CYS 1 1HB CYS 1 -16.025 -0.727 -2.954
7 H TRP 2 H TRP 2 -13.084 -2.148 -2.162
8 HA TRP 2 HA TRP 2 -11.957 -0.434 -0.092
9 1HB TRP 2 2HB TRP 2 -12.979 -2.263 1.561
10 2HB TRP 2 1HB TRP 2 -13.850 -0.795 1.136
11 HD1 TRP 2 HD TRP 2 -13.654 -4.475 -0.093
12 HE1 TRP 2 1HE TRP 2 -16.008 -5.174 -0.862
13 HE3 TRP 2 3HE TRP 2 -16.088 -0.035 0.605
14 HZ2 TRP 2 2HZ TRP 2 -18.561 -4.000 -1.134
15 HZ3 TRP 2 3HZ TRP 2 -18.486 0.094 0.067
16 HH2 TRP 2 HH TRP 2 -19.696 -1.848 -0.783
17 H LEU 3 H LEU 3 -11.021 -2.320 -2.244
18 HA LEU 3 HA LEU 3 -9.768 -4.455 -0.712
19 1HB LEU 3 2HB LEU 3 -9.161 -3.902 -3.587
20 2HB LEU 3 1HB LEU 3 -9.188 -5.434 -2.736
21 HG LEU 3 HG LEU 3 -11.728 -3.904 -3.191
22 1HD1 LEU 3 1HD1 LEU 3 -10.109 -5.390 -5.174
23 2HD1 LEU 3 2HD1 LEU 3 -11.227 -4.045 -5.397
24 3HD1 LEU 3 3HD1 LEU 3 -11.848 -5.679 -5.169
25 1HD2 LEU 3 1HD2 LEU 3 -12.343 -6.504 -3.373
26 2HD2 LEU 3 2HD2 LEU 3 -12.310 -5.625 -1.845
27 3HD2 LEU 3 3HD2 LEU 3 -10.928 -6.612 -2.324
28 H CYS 4 H CYS 4 -9.136 -1.284 -1.140
29 HA CYS 4 HA CYS 4 -6.566 -0.955 -1.986
30 1HB CYS 4 2HB CYS 4 -8.445 0.586 -0.633
31 2HB CYS 4 1HB CYS 4 -7.032 0.599 0.417
32 H ARG 5 H ARG 5 -7.234 -1.047 1.512
33 HA ARG 5 HA ARG 5 -4.844 -1.346 2.601
34 1HB ARG 5 2HB ARG 5 -5.904 -3.093 4.198
35 2HB ARG 5 1HB ARG 5 -6.590 -1.477 4.120
36 1HG ARG 5 2HG ARG 5 -8.567 -2.345 3.646
37 2HG ARG 5 1HG ARG 5 -7.905 -3.045 2.168
38 1HD ARG 5 2HD ARG 5 -6.994 -4.859 3.862
39 2HD ARG 5 1HD ARG 5 -8.350 -4.290 4.834
40 HE ARG 5 HE ARG 5 -8.475 -5.914 2.487
41 1HH1 ARG 5 1HH1 ARG 5 -10.204 -3.511 4.336
42 2HH1 ARG 5 2HH1 ARG 5 -11.759 -4.013 3.764
43 1HH2 ARG 5 1HH2 ARG 5 -10.520 -6.569 1.735
44 2HH2 ARG 5 2HH2 ARG 5 -11.939 -5.746 2.291
45 H ALA 6 H ALA 6 -6.506 -4.054 1.013
46 HA ALA 6 HA ALA 6 -4.571 -6.019 1.588
47 1HB ALA 6 1HB ALA 6 -7.035 -6.074 0.513
48 2HB ALA 6 2HB ALA 6 -5.891 -7.414 0.406
49 3HB ALA 6 3HB ALA 6 -6.059 -6.289 -0.941
50 H LEU 7 H LEU 7 -4.854 -3.713 -1.054
51 HA LEU 7 HA LEU 7 -2.775 -4.839 -2.642
52 1HB LEU 7 2HB LEU 7 -4.501 -3.497 -3.666
53 2HB LEU 7 1HB LEU 7 -4.083 -2.125 -2.659
54 HG LEU 7 HG LEU 7 -1.708 -2.715 -3.961
55 1HD1 LEU 7 1HD1 LEU 7 -2.363 -4.057 -5.659
56 2HD1 LEU 7 2HD1 LEU 7 -2.778 -2.508 -6.396
57 3HD1 LEU 7 3HD1 LEU 7 -4.029 -3.481 -5.622
58 1HD2 LEU 7 1HD2 LEU 7 -2.008 -0.495 -3.899
59 2HD2 LEU 7 2HD2 LEU 7 -3.764 -0.630 -3.995
60 3HD2 LEU 7 3HD2 LEU 7 -2.792 -0.713 -5.465
61 H ILE 8 H ILE 8 -2.979 -2.289 -0.223
62 HA ILE 8 HA ILE 8 -0.391 -1.283 -0.617
63 HB ILE 8 HB ILE 8 -0.627 -0.054 1.366
64 1HG1 ILE 8 2HG1 ILE 8 -2.961 -1.084 2.640
65 2HG1 ILE 8 1HG1 ILE 8 -1.848 -2.421 2.394
66 1HG2 ILE 8 1HG2 ILE 8 -2.203 0.626 -0.342
67 2HG2 ILE 8 2HG2 ILE 8 -2.892 0.873 1.263
68 3HG2 ILE 8 3HG2 ILE 8 -3.404 -0.502 0.287
69 1HD1 ILE 8 1HD1 ILE 8 -1.488 -1.421 4.551
70 2HD1 ILE 8 2HD1 ILE 8 -1.247 0.162 3.808
71 3HD1 ILE 8 3HD1 ILE 8 -0.087 -1.136 3.518
72 H LYS 9 H LYS 9 -1.649 -4.054 0.946
73 HA LYS 9 HA LYS 9 0.650 -4.563 2.550
74 1HB LYS 9 2HB LYS 9 -1.793 -5.352 2.875
75 2HB LYS 9 1HB LYS 9 -1.329 -6.670 1.814
76 1HG LYS 9 2HG LYS 9 -0.528 -7.731 3.581
77 2HG LYS 9 1HG LYS 9 0.706 -6.483 3.720
78 1HD LYS 9 2HD LYS 9 -2.010 -6.486 5.037
79 2HD LYS 9 1HD LYS 9 -0.452 -6.718 5.832
80 1HE LYS 9 2HE LYS 9 0.205 -4.439 5.156
81 2HE LYS 9 1HE LYS 9 -1.384 -4.213 4.426
82 1HZ LYS 9 1HZ LYS 9 -2.420 -4.249 6.497
83 2HZ LYS 9 2HZ LYS 9 -1.031 -3.322 6.763
84 3HZ LYS 9 3HZ LYS 9 -1.083 -4.932 7.278
85 H ARG 10 H ARG 10 -0.505 -5.466 -0.602
86 HA ARG 10 HA ARG 10 1.439 -7.503 -1.039
87 1HB ARG 10 2HB ARG 10 0.259 -5.880 -3.273
88 2HB ARG 10 1HB ARG 10 0.696 -7.582 -3.257
89 1HG ARG 10 2HG ARG 10 -1.714 -6.261 -2.078
90 2HG ARG 10 1HG ARG 10 -1.641 -7.549 -3.276
91 1HD ARG 10 2HD ARG 10 -1.306 -7.672 -0.317
92 2HD ARG 10 1HD ARG 10 -2.237 -8.720 -1.385
93 HE ARG 10 HE ARG 10 0.437 -9.110 -0.542
94 1HH1 ARG 10 1HH1 ARG 10 -1.660 -9.528 -3.304
95 2HH1 ARG 10 2HH1 ARG 10 -0.725 -10.822 -3.972
96 1HH2 ARG 10 1HH2 ARG 10 1.660 -10.817 -1.420
97 2HH2 ARG 10 2HH2 ARG 10 1.156 -11.555 -2.904
98 H ILE 11 H ILE 11 1.446 -4.106 -0.895
99 HA ILE 11 HA ILE 11 3.845 -3.730 -2.489
100 HB ILE 11 HB ILE 11 1.835 -2.024 -1.433
101 1HG1 ILE 11 2HG1 ILE 11 3.634 -0.306 -2.547
102 2HG1 ILE 11 1HG1 ILE 11 4.153 -1.836 -3.247
103 1HG2 ILE 11 1HG2 ILE 11 3.143 -1.842 0.608
104 2HG2 ILE 11 2HG2 ILE 11 3.126 -0.307 -0.265
105 3HG2 ILE 11 3HG2 ILE 11 4.554 -1.343 -0.326
106 1HD1 ILE 11 1HD1 ILE 11 2.642 -0.999 -4.788
107 2HD1 ILE 11 2HD1 ILE 11 1.537 -0.422 -3.539
108 3HD1 ILE 11 3HD1 ILE 11 1.682 -2.151 -3.860
109 H GLN 12 H GLN 12 2.718 -4.161 0.734
110 HA GLN 12 HA GLN 12 4.881 -3.526 2.299
111 1HB GLN 12 2HB GLN 12 2.449 -4.936 2.514
112 2HB GLN 12 1HB GLN 12 3.686 -5.993 3.160
113 1HG GLN 12 2HG GLN 12 2.410 -3.715 4.273
114 2HG GLN 12 1HG GLN 12 3.418 -4.960 5.037
115 1HE2 GLN 12 1HE2 GLN 12 5.831 -4.659 4.484
116 2HE2 GLN 12 2HE2 GLN 12 6.445 -3.055 4.679
117 H ALA 13 H ALA 13 3.996 -6.695 1.015
118 HA ALA 13 HA ALA 13 6.347 -7.905 1.838
119 1HB ALA 13 1HB ALA 13 4.157 -9.038 1.203
120 2HB ALA 13 2HB ALA 13 5.640 -9.843 0.690
121 3HB ALA 13 3HB ALA 13 4.700 -8.904 -0.470
122 H MET 14 H MET 14 5.493 -6.142 -1.029
123 HA MET 14 HA MET 14 7.506 -6.946 -2.773
124 1HB MET 14 2HB MET 14 6.844 -5.226 -4.102
125 2HB MET 14 1HB MET 14 5.502 -5.173 -2.975
126 1HG MET 14 2HG MET 14 5.962 -3.025 -2.700
127 2HG MET 14 1HG MET 14 7.402 -3.516 -1.818
128 1HE MET 14 1HE MET 14 7.369 -0.479 -4.085
129 2HE MET 14 2HE MET 14 8.994 -0.749 -3.453
130 3HE MET 14 3HE MET 14 7.589 -1.061 -2.436
131 H ILE 15 H ILE 15 7.644 -4.936 0.050
132 HA ILE 15 HA ILE 15 10.555 -4.937 -0.113
133 HB ILE 15 HB ILE 15 10.644 -2.520 0.559
134 1HG1 ILE 15 2HG1 ILE 15 8.260 -1.637 -0.711
135 2HG1 ILE 15 1HG1 ILE 15 7.799 -2.839 0.492
136 1HG2 ILE 15 1HG2 ILE 15 11.369 -2.915 -1.600
137 2HG2 ILE 15 2HG2 ILE 15 10.093 -1.719 -1.844
138 3HG2 ILE 15 3HG2 ILE 15 9.774 -3.427 -2.155
139 1HD1 ILE 15 1HD1 ILE 15 9.030 -0.168 0.846
140 2HD1 ILE 15 2HD1 ILE 15 9.438 -1.437 2.003
141 3HD1 ILE 15 3HD1 ILE 15 7.754 -0.965 1.769
142 HA PRO 16 HA PRO 16 9.237 -5.868 4.166
143 1HB PRO 16 2HB PRO 16 11.340 -7.450 4.761
144 2HB PRO 16 1HB PRO 16 9.960 -8.033 3.821
145 1HG PRO 16 2HG PRO 16 12.646 -7.114 2.873
146 2HG PRO 16 1HG PRO 16 11.689 -8.508 2.342
147 1HD PRO 16 2HD PRO 16 11.785 -6.157 0.968
148 2HD PRO 16 1HD PRO 16 10.380 -7.241 0.949
149 H LYS 17 H LYS 17 12.623 -5.236 3.224
150 HA LYS 17 HA LYS 17 12.921 -3.602 5.648
151 1HB LYS 17 2HB LYS 17 14.478 -5.602 5.150
152 2HB LYS 17 1HB LYS 17 15.204 -4.557 3.936
153 1HG LYS 17 2HG LYS 17 15.430 -2.867 5.887
154 2HG LYS 17 1HG LYS 17 15.207 -4.287 6.910
155 1HD LYS 17 2HD LYS 17 17.137 -5.345 5.994
156 2HD LYS 17 1HD LYS 17 17.280 -4.121 4.729
157 1HE LYS 17 2HE LYS 17 18.380 -2.708 6.071
158 2HE LYS 17 1HE LYS 17 17.280 -2.996 7.418
159 1HZ LYS 17 1HZ LYS 17 18.639 -4.523 8.306
160 2HZ LYS 17 2HZ LYS 17 19.835 -3.778 7.370
161 3HZ LYS 17 3HZ LYS 17 19.078 -5.183 6.811
162 H GLY 18 H GLY 18 11.519 -2.355 3.733
163 1HA GLY 18 2HA GLY 18 13.416 -0.661 2.253
164 2HA GLY 18 1HA GLY 18 11.697 -0.806 1.917
165 H GLY 19 H GLY 19 12.525 1.687 1.987
166 1HA GLY 19 2HA GLY 19 11.108 2.801 4.200
167 2HA GLY 19 1HA GLY 19 12.840 3.040 4.371
168 H ARG 20 H ARG 20 10.027 4.347 3.196
169 HA ARG 20 HA ARG 20 11.222 6.666 2.196
170 1HB ARG 20 2HB ARG 20 10.777 4.522 0.214
171 2HB ARG 20 1HB ARG 20 10.172 6.106 -0.248
172 1HG ARG 20 2HG ARG 20 12.634 6.766 0.635
173 2HG ARG 20 1HG ARG 20 12.932 5.138 0.021
174 1HD ARG 20 2HD ARG 20 11.370 6.304 -1.940
175 2HD ARG 20 1HD ARG 20 12.429 7.613 -1.418
176 HE ARG 20 HE ARG 20 13.163 5.404 -3.004
177 1HH1 ARG 20 1HH1 ARG 20 14.350 7.354 -0.366
178 2HH1 ARG 20 2HH1 ARG 20 16.017 7.073 -0.743
179 1HH2 ARG 20 1HH2 ARG 20 15.353 5.032 -3.503
180 2HH2 ARG 20 2HH2 ARG 20 16.587 5.755 -2.524
181 H MET 21 H MET 21 8.492 4.963 0.716
182 HA MET 21 HA MET 21 6.502 6.192 2.344
183 1HB MET 21 2HB MET 21 6.703 8.205 1.208
184 2HB MET 21 1HB MET 21 7.188 7.430 -0.293
185 1HG MET 21 2HG MET 21 4.894 6.679 -0.663
186 2HG MET 21 1HG MET 21 4.396 7.417 0.855
187 1HE MET 21 1HE MET 21 6.516 10.321 0.188
188 2HE MET 21 2HE MET 21 5.251 9.891 1.339
189 3HE MET 21 3HE MET 21 4.983 11.193 0.181
190 H LEU 22 H LEU 22 4.285 5.707 1.496
191 HA LEU 22 HA LEU 22 4.318 3.305 -0.187
192 1HB LEU 22 2HB LEU 22 2.885 3.913 2.361
193 2HB LEU 22 1HB LEU 22 2.186 2.819 1.195
194 HG LEU 22 HG LEU 22 4.652 2.471 2.863
195 1HD1 LEU 22 1HD1 LEU 22 3.596 0.633 3.727
196 2HD1 LEU 22 2HD1 LEU 22 2.624 0.371 2.278
197 3HD1 LEU 22 3HD1 LEU 22 2.215 1.679 3.389
198 1HD2 LEU 22 1HD2 LEU 22 5.672 1.735 0.963
199 2HD2 LEU 22 2HD2 LEU 22 4.153 1.342 0.165
200 3HD2 LEU 22 3HD2 LEU 22 4.803 0.264 1.395
201 HA PRO 23 HA PRO 23 0.919 5.119 -2.370
202 1HB PRO 23 2HB PRO 23 -0.359 2.854 -3.171
203 2HB PRO 23 1HB PRO 23 1.175 3.406 -3.830
204 1HG PRO 23 2HG PRO 23 0.636 1.099 -2.167
205 2HG PRO 23 1HG PRO 23 2.116 1.519 -3.044
206 1HD PRO 23 2HD PRO 23 1.493 1.876 -0.225
207 2HD PRO 23 1HD PRO 23 3.028 2.050 -1.050
208 H GLN 24 H GLN 24 0.207 2.978 0.243
209 HA GLN 24 HA GLN 24 -2.525 2.894 0.365
210 1HB GLN 24 2HB GLN 24 -2.226 2.858 2.873
211 2HB GLN 24 1HB GLN 24 -1.260 1.685 1.989
212 1HG GLN 24 2HG GLN 24 0.362 2.454 3.341
213 2HG GLN 24 1HG GLN 24 0.503 3.686 2.088
214 1HE2 GLN 24 1HE2 GLN 24 1.190 5.356 3.318
215 2HE2 GLN 24 2HE2 GLN 24 0.264 6.071 4.589
216 H LEU 25 H LEU 25 -0.455 5.616 0.711
217 HA LEU 25 HA LEU 25 -2.365 7.184 2.165
218 1HB LEU 25 2HB LEU 25 -0.850 9.110 1.029
219 2HB LEU 25 1HB LEU 25 -0.442 8.281 2.515
220 HG LEU 25 HG LEU 25 0.893 6.655 1.058
221 1HD1 LEU 25 1HD1 LEU 25 0.481 6.921 -1.134
222 2HD1 LEU 25 2HD1 LEU 25 1.677 8.210 -1.011
223 3HD1 LEU 25 3HD1 LEU 25 -0.043 8.594 -0.940
224 1HD2 LEU 25 1HD2 LEU 25 1.540 9.041 2.302
225 2HD2 LEU 25 2HD2 LEU 25 2.289 9.168 0.711
226 3HD2 LEU 25 3HD2 LEU 25 2.666 7.799 1.755
227 H VAL 26 H VAL 26 -1.515 7.023 -1.246
228 HA VAL 26 HA VAL 26 -3.640 8.867 -1.943
229 HB VAL 26 HB VAL 26 -3.055 7.633 -4.305
230 1HG1 VAL 26 1HG1 VAL 26 -3.091 9.938 -4.305
231 2HG1 VAL 26 2HG1 VAL 26 -1.378 9.604 -4.565
232 3HG1 VAL 26 3HG1 VAL 26 -1.954 10.061 -2.962
233 1HG2 VAL 26 1HG2 VAL 26 -1.291 6.273 -3.205
234 2HG2 VAL 26 2HG2 VAL 26 -0.430 7.764 -2.831
235 3HG2 VAL 26 3HG2 VAL 26 -0.686 7.294 -4.510
236 H CYS 27 H CYS 27 -2.960 5.498 -1.837
237 HA CYS 27 HA CYS 27 -5.187 4.478 -3.153
238 1HB CYS 27 2HB CYS 27 -3.853 2.735 -2.764
239 2HB CYS 27 1HB CYS 27 -3.063 3.510 -1.421
240 H ARG 28 H ARG 28 -4.585 5.210 0.241
241 HA ARG 28 HA ARG 28 -7.073 4.309 1.069
242 1HB ARG 28 2HB ARG 28 -5.054 6.127 2.310
243 2HB ARG 28 1HB ARG 28 -6.635 5.957 3.058
244 1HG ARG 28 2HG ARG 28 -6.283 3.770 3.644
245 2HG ARG 28 1HG ARG 28 -5.126 3.487 2.351
246 1HD ARG 28 2HD ARG 28 -4.372 3.706 4.877
247 2HD ARG 28 1HD ARG 28 -3.373 4.316 3.560
248 HE ARG 28 HE ARG 28 -3.732 6.444 4.324
249 1HH1 ARG 28 1HH1 ARG 28 -6.080 4.311 5.780
250 2HH1 ARG 28 2HH1 ARG 28 -6.691 5.518 6.861
251 1HH2 ARG 28 1HH2 ARG 28 -4.535 8.033 5.741
252 2HH2 ARG 28 2HH2 ARG 28 -5.816 7.633 6.837
253 H LEU 29 H LEU 29 -6.001 7.367 -0.201
254 HA LEU 29 HA LEU 29 -8.234 8.942 0.414
255 1HB LEU 29 2HB LEU 29 -6.397 8.979 -1.975
256 2HB LEU 29 1HB LEU 29 -7.656 10.171 -1.729
257 HG LEU 29 HG LEU 29 -5.510 9.697 0.324
258 1HD1 LEU 29 1HD1 LEU 29 -4.858 10.437 -2.174
259 2HD1 LEU 29 2HD1 LEU 29 -4.022 11.022 -0.735
260 3HD1 LEU 29 3HD1 LEU 29 -5.272 12.009 -1.492
261 1HD2 LEU 29 1HD2 LEU 29 -7.001 11.010 1.399
262 2HD2 LEU 29 2HD2 LEU 29 -7.717 11.610 -0.097
263 3HD2 LEU 29 3HD2 LEU 29 -6.197 12.288 0.489
264 H VAL 30 H VAL 30 -7.681 6.482 -1.963
265 HA VAL 30 HA VAL 30 -10.211 6.918 -3.309
266 HB VAL 30 HB VAL 30 -7.886 5.098 -3.720
267 1HG1 VAL 30 1HG1 VAL 30 -9.555 3.432 -3.789
268 2HG1 VAL 30 2HG1 VAL 30 -9.256 3.869 -5.472
269 3HG1 VAL 30 3HG1 VAL 30 -10.684 4.487 -4.641
270 1HG2 VAL 30 1HG2 VAL 30 -7.660 6.197 -5.676
271 2HG2 VAL 30 2HG2 VAL 30 -8.651 7.412 -4.868
272 3HG2 VAL 30 3HG2 VAL 30 -9.398 6.253 -5.967
273 H LEU 31 H LEU 31 -8.897 4.950 -0.783
274 HA LEU 31 HA LEU 31 -10.673 2.829 -0.707
275 1HB LEU 31 2HB LEU 31 -9.210 2.392 0.930
276 2HB LEU 31 1HB LEU 31 -8.819 4.085 1.128
277 HG LEU 31 HG LEU 31 -11.354 3.041 2.320
278 1HD1 LEU 31 1HD1 LEU 31 -10.172 1.492 3.436
279 2HD1 LEU 31 2HD1 LEU 31 -9.633 2.867 4.400
280 3HD1 LEU 31 3HD1 LEU 31 -8.626 2.265 3.083
281 1HD2 LEU 31 1HD2 LEU 31 -11.273 4.919 3.605
282 2HD2 LEU 31 2HD2 LEU 31 -10.372 5.508 2.208
283 3HD2 LEU 31 3HD2 LEU 31 -9.510 4.951 3.641
284 H ARG 32 H ARG 32 -11.093 6.139 0.234
285 HA ARG 32 HA ARG 32 -13.382 5.977 1.805
286 1HB ARG 32 2HB ARG 32 -12.351 8.104 1.628
287 2HB ARG 32 1HB ARG 32 -12.406 8.072 -0.128
288 1HG ARG 32 2HG ARG 32 -14.926 8.126 1.490
289 2HG ARG 32 1HG ARG 32 -14.034 9.606 1.128
290 1HD ARG 32 2HD ARG 32 -14.147 8.410 -1.319
291 2HD ARG 32 1HD ARG 32 -15.683 7.917 -0.613
292 HE ARG 32 HE ARG 32 -14.915 10.563 -1.438
293 1HH1 ARG 32 1HH1 ARG 32 -17.060 8.691 0.581
294 2HH1 ARG 32 2HH1 ARG 32 -18.268 9.930 0.661
295 1HH2 ARG 32 1HH2 ARG 32 -16.503 12.195 -1.331
296 2HH2 ARG 32 2HH2 ARG 32 -17.953 11.918 -0.423
297 H CYS 33 H CYS 33 -12.949 5.934 -1.637
298 HA CYS 33 HA CYS 33 -14.802 6.157 -3.208
299 1HB CYS 33 2HB CYS 33 -13.515 4.393 -3.924
300 2HB CYS 33 1HB CYS 33 -13.753 3.474 -2.445
301 H SER 34 H SER 34 -16.849 6.758 -2.954
302 HA SER 34 HA SER 34 -18.906 4.961 -2.365
303 1HB SER 34 2HB SER 34 -18.347 4.963 -0.073
304 2HB SER 34 1HB SER 34 -18.023 6.696 -0.063
305 HG SER 34 HG SER 34 -20.173 7.106 -0.118
Start of MODEL 6
1 1H CYS 1 1HT CYS 1 -14.713 -3.147 -2.750
2 2H CYS 1 2HT CYS 1 -15.932 -2.409 -3.707
3 3H CYS 1 3HT CYS 1 -15.910 -2.169 -2.009
4 HA CYS 1 HA CYS 1 -13.768 -1.322 -3.837
5 1HB CYS 1 2HB CYS 1 -16.317 -0.314 -3.762
6 2HB CYS 1 1HB CYS 1 -15.499 0.701 -2.578
7 H TRP 2 H TRP 2 -13.081 -2.704 -1.613
8 HA TRP 2 HA TRP 2 -11.913 -0.606 0.031
9 1HB TRP 2 2HB TRP 2 -12.538 -2.294 2.047
10 2HB TRP 2 1HB TRP 2 -13.513 -0.897 1.611
11 HD1 TRP 2 HD TRP 2 -13.402 -4.504 0.143
12 HE1 TRP 2 1HE TRP 2 -15.816 -5.394 0.079
13 HE3 TRP 2 3HE TRP 2 -15.803 -0.491 2.216
14 HZ2 TRP 2 2HZ TRP 2 -18.395 -4.512 0.810
15 HZ3 TRP 2 3HZ TRP 2 -18.244 -0.594 2.498
16 HH2 TRP 2 HH TRP 2 -19.514 -2.562 1.809
17 H LEU 3 H LEU 3 -10.651 -2.194 -1.853
18 HA LEU 3 HA LEU 3 -9.273 -4.317 -0.408
19 1HB LEU 3 2HB LEU 3 -8.161 -3.664 -3.015
20 2HB LEU 3 1HB LEU 3 -8.768 -5.190 -2.408
21 HG LEU 3 HG LEU 3 -10.579 -3.018 -3.449
22 1HD1 LEU 3 1HD1 LEU 3 -8.930 -4.988 -4.884
23 2HD1 LEU 3 2HD1 LEU 3 -9.594 -3.447 -5.426
24 3HD1 LEU 3 3HD1 LEU 3 -10.618 -4.883 -5.385
25 1HD2 LEU 3 1HD2 LEU 3 -11.898 -5.284 -3.844
26 2HD2 LEU 3 2HD2 LEU 3 -11.973 -4.408 -2.316
27 3HD2 LEU 3 3HD2 LEU 3 -10.903 -5.800 -2.482
28 H CYS 4 H CYS 4 -9.037 -1.084 -0.488
29 HA CYS 4 HA CYS 4 -6.619 -0.142 -1.077
30 1HB CYS 4 2HB CYS 4 -8.712 0.605 0.572
31 2HB CYS 4 1HB CYS 4 -7.322 0.628 1.647
32 H ARG 5 H ARG 5 -6.916 -0.879 2.378
33 HA ARG 5 HA ARG 5 -4.297 -1.171 2.995
34 1HB ARG 5 2HB ARG 5 -5.125 -2.946 4.724
35 2HB ARG 5 1HB ARG 5 -5.675 -1.282 4.837
36 1HG ARG 5 2HG ARG 5 -7.621 -2.460 5.151
37 2HG ARG 5 1HG ARG 5 -7.689 -2.107 3.427
38 1HD ARG 5 2HD ARG 5 -6.415 -4.443 3.301
39 2HD ARG 5 1HD ARG 5 -7.255 -4.687 4.832
40 HE ARG 5 HE ARG 5 -8.933 -3.733 2.690
41 1HH1 ARG 5 1HH1 ARG 5 -7.633 -6.562 4.280
42 2HH1 ARG 5 2HH1 ARG 5 -8.906 -7.600 3.731
43 1HH2 ARG 5 1HH2 ARG 5 -10.601 -5.105 1.976
44 2HH2 ARG 5 2HH2 ARG 5 -10.588 -6.777 2.427
45 H ALA 6 H ALA 6 -6.206 -3.468 1.207
46 HA ALA 6 HA ALA 6 -4.496 -5.707 1.533
47 1HB ALA 6 1HB ALA 6 -6.188 -5.421 -0.897
48 2HB ALA 6 2HB ALA 6 -6.971 -5.527 0.680
49 3HB ALA 6 3HB ALA 6 -5.911 -6.826 0.132
50 H LEU 7 H LEU 7 -4.583 -3.078 -0.836
51 HA LEU 7 HA LEU 7 -2.677 -4.312 -2.573
52 1HB LEU 7 2HB LEU 7 -3.260 -2.693 -3.987
53 2HB LEU 7 1HB LEU 7 -4.434 -2.188 -2.788
54 HG LEU 7 HG LEU 7 -1.655 -1.079 -2.632
55 1HD1 LEU 7 1HD1 LEU 7 -3.731 0.201 -4.371
56 2HD1 LEU 7 2HD1 LEU 7 -2.555 -0.939 -5.029
57 3HD1 LEU 7 3HD1 LEU 7 -2.006 0.547 -4.254
58 1HD2 LEU 7 1HD2 LEU 7 -2.906 0.881 -1.810
59 2HD2 LEU 7 2HD2 LEU 7 -3.198 -0.572 -0.853
60 3HD2 LEU 7 3HD2 LEU 7 -4.407 -0.023 -2.009
61 H ILE 8 H ILE 8 -2.538 -2.056 0.112
62 HA ILE 8 HA ILE 8 0.145 -1.293 -0.291
63 HB ILE 8 HB ILE 8 0.098 -0.458 2.009
64 1HG1 ILE 8 2HG1 ILE 8 -2.689 -1.601 2.171
65 2HG1 ILE 8 1HG1 ILE 8 -1.290 -2.370 2.904
66 1HG2 ILE 8 1HG2 ILE 8 -1.602 0.308 -0.129
67 2HG2 ILE 8 2HG2 ILE 8 -0.901 1.304 1.136
68 3HG2 ILE 8 3HG2 ILE 8 -2.479 0.565 1.380
69 1HD1 ILE 8 1HD1 ILE 8 -2.023 -1.226 4.702
70 2HD1 ILE 8 2HD1 ILE 8 -2.794 0.026 3.728
71 3HD1 ILE 8 3HD1 ILE 8 -1.050 0.056 3.980
72 H LYS 9 H LYS 9 -1.399 -4.007 1.111
73 HA LYS 9 HA LYS 9 0.801 -4.922 2.639
74 1HB LYS 9 2HB LYS 9 -1.732 -5.546 2.638
75 2HB LYS 9 1HB LYS 9 -1.205 -6.806 1.543
76 1HG LYS 9 2HG LYS 9 -0.743 -8.007 3.342
77 2HG LYS 9 1HG LYS 9 0.615 -6.917 3.603
78 1HD LYS 9 2HD LYS 9 -2.142 -6.756 4.818
79 2HD LYS 9 1HD LYS 9 -0.604 -6.991 5.650
80 1HE LYS 9 2HE LYS 9 -0.235 -4.613 4.287
81 2HE LYS 9 1HE LYS 9 -1.918 -4.523 4.803
82 1HZ LYS 9 1HZ LYS 9 0.111 -3.794 6.339
83 2HZ LYS 9 2HZ LYS 9 0.001 -5.419 6.801
84 3HZ LYS 9 3HZ LYS 9 -1.339 -4.401 6.963
85 H ARG 10 H ARG 10 -0.432 -5.626 -0.570
86 HA ARG 10 HA ARG 10 1.392 -7.628 -1.250
87 1HB ARG 10 2HB ARG 10 0.281 -5.507 -3.105
88 2HB ARG 10 1HB ARG 10 0.909 -7.078 -3.576
89 1HG ARG 10 2HG ARG 10 -1.572 -6.554 -1.963
90 2HG ARG 10 1HG ARG 10 -1.493 -7.101 -3.639
91 1HD ARG 10 2HD ARG 10 -1.891 -9.043 -2.391
92 2HD ARG 10 1HD ARG 10 -0.171 -9.080 -2.759
93 HE ARG 10 HE ARG 10 -0.915 -7.935 -0.202
94 1HH1 ARG 10 1HH1 ARG 10 0.211 -10.735 -1.960
95 2HH1 ARG 10 2HH1 ARG 10 0.837 -11.520 -0.550
96 1HH2 ARG 10 1HH2 ARG 10 -0.094 -8.964 1.648
97 2HH2 ARG 10 2HH2 ARG 10 0.662 -10.517 1.502
98 H ILE 11 H ILE 11 1.560 -4.212 -0.964
99 HA ILE 11 HA ILE 11 3.966 -3.714 -2.304
100 HB ILE 11 HB ILE 11 2.162 -2.232 -0.648
101 1HG1 ILE 11 2HG1 ILE 11 3.375 -0.296 -1.786
102 2HG1 ILE 11 1HG1 ILE 11 4.379 -1.518 -2.559
103 1HG2 ILE 11 1HG2 ILE 11 3.767 -2.389 1.135
104 2HG2 ILE 11 2HG2 ILE 11 3.770 -0.745 0.495
105 3HG2 ILE 11 3HG2 ILE 11 5.065 -1.864 0.062
106 1HD1 ILE 11 1HD1 ILE 11 2.478 -0.705 -3.938
107 2HD1 ILE 11 2HD1 ILE 11 1.381 -1.440 -2.769
108 3HD1 ILE 11 3HD1 ILE 11 2.499 -2.450 -3.687
109 H GLN 12 H GLN 12 3.200 -4.595 1.084
110 HA GLN 12 HA GLN 12 5.871 -4.445 1.992
111 1HB GLN 12 2HB GLN 12 5.174 -5.575 3.933
112 2HB GLN 12 1HB GLN 12 3.739 -4.711 3.405
113 1HG GLN 12 2HG GLN 12 2.589 -6.593 3.319
114 2HG GLN 12 1HG GLN 12 3.760 -7.306 2.213
115 1HE2 GLN 12 1HE2 GLN 12 5.861 -7.965 3.371
116 2HE2 GLN 12 2HE2 GLN 12 5.652 -8.854 4.839
117 H ALA 13 H ALA 13 4.250 -6.670 -0.029
118 HA ALA 13 HA ALA 13 6.012 -8.870 0.349
119 1HB ALA 13 1HB ALA 13 4.864 -9.928 -1.370
120 2HB ALA 13 2HB ALA 13 4.498 -8.408 -2.189
121 3HB ALA 13 3HB ALA 13 3.641 -8.843 -0.710
122 H MET 14 H MET 14 5.922 -6.012 -1.606
123 HA MET 14 HA MET 14 7.939 -6.714 -3.439
124 1HB MET 14 2HB MET 14 7.850 -4.539 -4.215
125 2HB MET 14 1HB MET 14 6.266 -4.710 -3.481
126 1HG MET 14 2HG MET 14 6.639 -3.001 -2.130
127 2HG MET 14 1HG MET 14 8.145 -3.696 -1.555
128 1HE MET 14 1HE MET 14 7.539 -0.047 -2.740
129 2HE MET 14 2HE MET 14 9.165 -0.221 -2.079
130 3HE MET 14 3HE MET 14 7.812 -1.058 -1.319
131 H ILE 15 H ILE 15 8.036 -5.231 -0.229
132 HA ILE 15 HA ILE 15 10.446 -6.273 0.541
133 HB ILE 15 HB ILE 15 11.851 -4.067 0.457
134 1HG1 ILE 15 2HG1 ILE 15 11.616 -3.034 -1.849
135 2HG1 ILE 15 1HG1 ILE 15 10.038 -3.800 -1.945
136 1HG2 ILE 15 1HG2 ILE 15 11.812 -6.488 -0.937
137 2HG2 ILE 15 2HG2 ILE 15 13.180 -5.410 -0.662
138 3HG2 ILE 15 3HG2 ILE 15 12.203 -5.240 -2.119
139 1HD1 ILE 15 1HD1 ILE 15 9.095 -2.311 -0.563
140 2HD1 ILE 15 2HD1 ILE 15 10.475 -1.310 -1.013
141 3HD1 ILE 15 3HD1 ILE 15 10.508 -2.236 0.488
142 HA PRO 16 HA PRO 16 9.087 -4.069 4.172
143 1HB PRO 16 2HB PRO 16 10.551 -5.386 5.959
144 2HB PRO 16 1HB PRO 16 9.259 -6.207 5.075
145 1HG PRO 16 2HG PRO 16 12.211 -6.344 4.681
146 2HG PRO 16 1HG PRO 16 10.990 -7.614 4.489
147 1HD PRO 16 2HD PRO 16 12.130 -6.059 2.435
148 2HD PRO 16 1HD PRO 16 10.704 -7.105 2.297
149 H LYS 17 H LYS 17 12.579 -4.632 3.693
150 HA LYS 17 HA LYS 17 13.438 -2.552 5.406
151 1HB LYS 17 2HB LYS 17 14.691 -4.645 4.328
152 2HB LYS 17 1HB LYS 17 15.154 -3.432 3.142
153 1HG LYS 17 2HG LYS 17 16.154 -2.071 4.872
154 2HG LYS 17 1HG LYS 17 15.624 -3.216 6.107
155 1HD LYS 17 2HD LYS 17 17.025 -4.946 5.134
156 2HD LYS 17 1HD LYS 17 17.513 -3.849 3.841
157 1HE LYS 17 2HE LYS 17 19.266 -3.414 5.171
158 2HE LYS 17 1HE LYS 17 18.130 -2.382 6.039
159 1HZ LYS 17 1HZ LYS 17 18.088 -5.156 6.848
160 2HZ LYS 17 2HZ LYS 17 18.109 -3.752 7.791
161 3HZ LYS 17 3HZ LYS 17 19.553 -4.365 7.158
162 H GLY 18 H GLY 18 12.552 -2.707 2.055
163 1HA GLY 18 2HA GLY 18 13.727 -0.335 1.127
164 2HA GLY 18 1HA GLY 18 12.278 -1.078 0.461
165 H GLY 19 H GLY 19 13.100 1.799 1.134
166 1HA GLY 19 2HA GLY 19 10.524 2.477 2.340
167 2HA GLY 19 1HA GLY 19 11.966 3.061 3.151
168 H ARG 20 H ARG 20 9.770 4.551 1.945
169 HA ARG 20 HA ARG 20 11.107 6.699 0.858
170 1HB ARG 20 2HB ARG 20 10.506 4.604 -1.119
171 2HB ARG 20 1HB ARG 20 9.937 6.202 -1.577
172 1HG ARG 20 2HG ARG 20 12.467 6.752 -0.742
173 2HG ARG 20 1HG ARG 20 12.660 5.138 -1.431
174 1HD ARG 20 2HD ARG 20 11.779 5.848 -3.530
175 2HD ARG 20 1HD ARG 20 11.291 7.405 -2.862
176 HE ARG 20 HE ARG 20 13.414 8.164 -3.210
177 1HH1 ARG 20 1HH1 ARG 20 13.473 4.674 -3.257
178 2HH1 ARG 20 2HH1 ARG 20 15.132 4.586 -3.745
179 1HH2 ARG 20 1HH2 ARG 20 15.598 8.047 -3.850
180 2HH2 ARG 20 2HH2 ARG 20 16.337 6.498 -4.080
181 H MET 21 H MET 21 8.201 4.763 0.802
182 HA MET 21 HA MET 21 6.433 6.404 1.999
183 1HB MET 21 2HB MET 21 6.508 8.218 0.541
184 2HB MET 21 1HB MET 21 6.797 7.208 -0.868
185 1HG MET 21 2HG MET 21 4.475 6.476 -0.845
186 2HG MET 21 1HG MET 21 4.165 7.445 0.592
187 1HE MET 21 1HE MET 21 5.933 10.482 -0.820
188 2HE MET 21 2HE MET 21 5.174 9.807 0.621
189 3HE MET 21 3HE MET 21 4.293 10.957 -0.384
190 H LEU 22 H LEU 22 4.083 5.816 1.459
191 HA LEU 22 HA LEU 22 4.014 3.175 0.205
192 1HB LEU 22 2HB LEU 22 2.883 4.161 2.764
193 2HB LEU 22 1HB LEU 22 1.939 3.029 1.814
194 HG LEU 22 HG LEU 22 4.649 2.082 2.065
195 1HD1 LEU 22 1HD1 LEU 22 4.065 3.554 4.250
196 2HD1 LEU 22 2HD1 LEU 22 5.097 2.124 4.269
197 3HD1 LEU 22 3HD1 LEU 22 3.399 1.991 4.726
198 1HD2 LEU 22 1HD2 LEU 22 2.782 0.665 1.477
199 2HD2 LEU 22 2HD2 LEU 22 1.986 1.027 3.009
200 3HD2 LEU 22 3HD2 LEU 22 3.493 0.109 2.994
201 HA PRO 23 HA PRO 23 0.470 4.569 -2.007
202 1HB PRO 23 2HB PRO 23 -0.741 2.143 -2.351
203 2HB PRO 23 1HB PRO 23 0.697 2.677 -3.211
204 1HG PRO 23 2HG PRO 23 0.459 0.583 -1.260
205 2HG PRO 23 1HG PRO 23 1.877 1.047 -2.211
206 1HD PRO 23 2HD PRO 23 1.190 1.736 0.558
207 2HD PRO 23 1HD PRO 23 2.736 1.813 -0.257
208 H GLN 24 H GLN 24 -0.055 2.909 0.969
209 HA GLN 24 HA GLN 24 -2.828 2.802 1.063
210 1HB GLN 24 2HB GLN 24 -2.281 3.274 3.671
211 2HB GLN 24 1HB GLN 24 -2.169 1.700 2.910
212 1HG GLN 24 2HG GLN 24 -0.232 2.163 4.291
213 2HG GLN 24 1HG GLN 24 0.224 2.006 2.594
214 1HE2 GLN 24 1HE2 GLN 24 0.605 3.791 5.337
215 2HE2 GLN 24 2HE2 GLN 24 1.206 5.253 4.641
216 H LEU 25 H LEU 25 -0.842 5.542 0.968
217 HA LEU 25 HA LEU 25 -2.834 7.163 2.345
218 1HB LEU 25 2HB LEU 25 -0.455 8.153 0.786
219 2HB LEU 25 1HB LEU 25 -1.448 9.075 1.891
220 HG LEU 25 HG LEU 25 0.233 8.708 3.313
221 1HD1 LEU 25 1HD1 LEU 25 -0.032 6.744 4.726
222 2HD1 LEU 25 2HD1 LEU 25 -1.036 5.984 3.493
223 3HD1 LEU 25 3HD1 LEU 25 -1.595 7.444 4.307
224 1HD2 LEU 25 1HD2 LEU 25 0.962 6.553 1.428
225 2HD2 LEU 25 2HD2 LEU 25 1.591 6.438 3.071
226 3HD2 LEU 25 3HD2 LEU 25 1.939 7.861 2.092
227 H VAL 26 H VAL 26 -1.695 6.715 -0.935
228 HA VAL 26 HA VAL 26 -3.668 8.532 -2.031
229 HB VAL 26 HB VAL 26 -2.988 6.999 -4.170
230 1HG1 VAL 26 1HG1 VAL 26 -2.717 9.176 -4.632
231 2HG1 VAL 26 2HG1 VAL 26 -1.020 8.844 -4.283
232 3HG1 VAL 26 3HG1 VAL 26 -2.056 9.542 -3.038
233 1HG2 VAL 26 1HG2 VAL 26 -1.436 5.612 -2.898
234 2HG2 VAL 26 2HG2 VAL 26 -0.530 7.049 -2.420
235 3HG2 VAL 26 3HG2 VAL 26 -0.585 6.564 -4.115
236 H CYS 27 H CYS 27 -3.211 5.228 -1.336
237 HA CYS 27 HA CYS 27 -5.280 4.015 -2.706
238 1HB CYS 27 2HB CYS 27 -4.304 2.285 -1.718
239 2HB CYS 27 1HB CYS 27 -3.369 3.357 -0.726
240 H ARG 28 H ARG 28 -5.145 5.129 0.627
241 HA ARG 28 HA ARG 28 -7.783 4.657 1.220
242 1HB ARG 28 2HB ARG 28 -5.885 6.711 2.317
243 2HB ARG 28 1HB ARG 28 -7.486 6.442 2.991
244 1HG ARG 28 2HG ARG 28 -6.930 4.309 3.767
245 2HG ARG 28 1HG ARG 28 -5.524 4.164 2.724
246 1HD ARG 28 2HD ARG 28 -4.943 6.421 4.164
247 2HD ARG 28 1HD ARG 28 -5.835 5.474 5.349
248 HE ARG 28 HE ARG 28 -3.199 4.953 4.308
249 1HH1 ARG 28 1HH1 ARG 28 -6.013 3.544 5.832
250 2HH1 ARG 28 2HH1 ARG 28 -5.115 2.304 6.641
251 1HH2 ARG 28 1HH2 ARG 28 -2.009 3.332 5.423
252 2HH2 ARG 28 2HH2 ARG 28 -2.852 2.181 6.402
253 H LEU 29 H LEU 29 -6.308 7.393 -0.397
254 HA LEU 29 HA LEU 29 -8.519 9.134 -0.376
255 1HB LEU 29 2HB LEU 29 -6.406 8.751 -2.501
256 2HB LEU 29 1HB LEU 29 -7.564 10.065 -2.490
257 HG LEU 29 HG LEU 29 -5.647 9.616 -0.213
258 1HD1 LEU 29 1HD1 LEU 29 -4.746 10.088 -2.704
259 2HD1 LEU 29 2HD1 LEU 29 -3.972 10.717 -1.248
260 3HD1 LEU 29 3HD1 LEU 29 -5.071 11.739 -2.176
261 1HD2 LEU 29 1HD2 LEU 29 -7.086 11.135 0.628
262 2HD2 LEU 29 2HD2 LEU 29 -7.668 11.626 -0.962
263 3HD2 LEU 29 3HD2 LEU 29 -6.144 12.265 -0.345
264 H VAL 30 H VAL 30 -7.777 6.272 -2.153
265 HA VAL 30 HA VAL 30 -9.964 6.540 -4.022
266 HB VAL 30 HB VAL 30 -7.674 4.760 -3.692
267 1HG1 VAL 30 1HG1 VAL 30 -8.736 2.801 -4.798
268 2HG1 VAL 30 2HG1 VAL 30 -10.310 3.536 -4.491
269 3HG1 VAL 30 3HG1 VAL 30 -9.279 3.063 -3.141
270 1HG2 VAL 30 1HG2 VAL 30 -7.535 5.899 -5.646
271 2HG2 VAL 30 2HG2 VAL 30 -9.285 5.956 -5.864
272 3HG2 VAL 30 3HG2 VAL 30 -8.398 4.481 -6.244
273 H LEU 31 H LEU 31 -9.321 5.052 -0.949
274 HA LEU 31 HA LEU 31 -11.325 3.151 -0.788
275 1HB LEU 31 2HB LEU 31 -10.188 2.960 1.132
276 2HB LEU 31 1HB LEU 31 -9.673 4.632 1.086
277 HG LEU 31 HG LEU 31 -12.441 3.905 1.985
278 1HD1 LEU 31 1HD1 LEU 31 -11.488 2.708 3.627
279 2HD1 LEU 31 2HD1 LEU 31 -11.127 4.292 4.311
280 3HD1 LEU 31 3HD1 LEU 31 -9.900 3.433 3.380
281 1HD2 LEU 31 1HD2 LEU 31 -11.081 6.095 3.302
282 2HD2 LEU 31 2HD2 LEU 31 -12.628 6.072 2.456
283 3HD2 LEU 31 3HD2 LEU 31 -11.134 6.315 1.554
284 H ARG 32 H ARG 32 -11.491 6.608 -0.539
285 HA ARG 32 HA ARG 32 -14.051 6.916 0.549
286 1HB ARG 32 2HB ARG 32 -12.813 8.894 0.367
287 2HB ARG 32 1HB ARG 32 -12.380 8.580 -1.306
288 1HG ARG 32 2HG ARG 32 -13.960 10.446 -1.050
289 2HG ARG 32 1HG ARG 32 -14.606 9.138 -2.040
290 1HD ARG 32 2HD ARG 32 -15.426 8.457 0.497
291 2HD ARG 32 1HD ARG 32 -15.544 10.215 0.507
292 HE ARG 32 HE ARG 32 -16.737 8.961 -1.798
293 1HH1 ARG 32 1HH1 ARG 32 -17.238 10.017 1.491
294 2HH1 ARG 32 2HH1 ARG 32 -18.952 10.177 1.314
295 1HH2 ARG 32 1HH2 ARG 32 -19.005 9.177 -2.032
296 2HH2 ARG 32 2HH2 ARG 32 -19.956 9.699 -0.681
297 H CYS 33 H CYS 33 -13.044 5.716 -2.483
298 HA CYS 33 HA CYS 33 -14.539 6.058 -4.499
299 1HB CYS 33 2HB CYS 33 -13.574 4.036 -4.766
300 2HB CYS 33 1HB CYS 33 -13.886 3.551 -3.106
301 H SER 34 H SER 34 -16.149 4.140 -1.945
302 HA SER 34 HA SER 34 -18.723 4.361 -3.003
303 1HB SER 34 2HB SER 34 -18.309 2.703 -1.331
304 2HB SER 34 1HB SER 34 -17.780 3.916 -0.166
305 HG SER 34 HG SER 34 -20.401 3.805 -1.250
Start of MODEL 7
1 1H CYS 1 1HT CYS 1 -14.057 -0.469 -2.963
2 2H CYS 1 2HT CYS 1 -15.533 0.318 -3.348
3 3H CYS 1 3HT CYS 1 -15.405 -0.616 -1.914
4 HA CYS 1 HA CYS 1 -13.718 1.722 -2.436
5 1HB CYS 1 2HB CYS 1 -16.055 2.418 -2.598
6 2HB CYS 1 1HB CYS 1 -16.432 1.584 -1.095
7 H TRP 2 H TRP 2 -12.792 -0.652 -1.367
8 HA TRP 2 HA TRP 2 -11.711 0.170 1.073
9 1HB TRP 2 2HB TRP 2 -12.825 -1.562 2.568
10 2HB TRP 2 1HB TRP 2 -13.784 -0.144 2.155
11 HD1 TRP 2 HD TRP 2 -13.311 -3.481 0.213
12 HE1 TRP 2 1HE TRP 2 -15.650 -4.436 -0.282
13 HE3 TRP 2 3HE TRP 2 -16.151 0.048 2.585
14 HZ2 TRP 2 2HZ TRP 2 -18.341 -3.781 0.263
15 HZ3 TRP 2 3HZ TRP 2 -18.599 -0.189 2.551
16 HH2 TRP 2 HH TRP 2 -19.670 -2.065 1.412
17 H LEU 3 H LEU 3 -11.403 -1.526 -1.538
18 HA LEU 3 HA LEU 3 -10.239 -3.955 -0.438
19 1HB LEU 3 2HB LEU 3 -10.177 -3.108 -3.320
20 2HB LEU 3 1HB LEU 3 -10.062 -4.728 -2.660
21 HG LEU 3 HG LEU 3 -12.542 -3.007 -2.629
22 1HD1 LEU 3 1HD1 LEU 3 -11.543 -5.125 -4.470
23 2HD1 LEU 3 2HD1 LEU 3 -12.411 -3.633 -4.831
24 3HD1 LEU 3 3HD1 LEU 3 -13.274 -5.012 -4.149
25 1HD2 LEU 3 1HD2 LEU 3 -12.599 -5.920 -2.099
26 2HD2 LEU 3 2HD2 LEU 3 -13.616 -4.629 -1.461
27 3HD2 LEU 3 3HD2 LEU 3 -11.993 -4.873 -0.816
28 H CYS 4 H CYS 4 -9.199 -0.832 -0.835
29 HA CYS 4 HA CYS 4 -6.655 -1.184 -1.985
30 1HB CYS 4 2HB CYS 4 -8.134 0.965 -0.933
31 2HB CYS 4 1HB CYS 4 -6.614 0.932 -0.044
32 H ARG 5 H ARG 5 -7.690 -1.119 1.422
33 HA ARG 5 HA ARG 5 -5.406 -1.289 2.823
34 1HB ARG 5 2HB ARG 5 -6.579 -3.111 4.234
35 2HB ARG 5 1HB ARG 5 -7.355 -1.541 4.091
36 1HG ARG 5 2HG ARG 5 -9.178 -2.468 3.248
37 2HG ARG 5 1HG ARG 5 -8.242 -3.237 1.965
38 1HD ARG 5 2HD ARG 5 -7.787 -5.137 3.347
39 2HD ARG 5 1HD ARG 5 -8.489 -4.344 4.757
40 HE ARG 5 HE ARG 5 -10.545 -4.402 3.008
41 1HH1 ARG 5 1HH1 ARG 5 -8.361 -6.853 4.192
42 2HH1 ARG 5 2HH1 ARG 5 -9.511 -8.137 4.025
43 1HH2 ARG 5 1HH2 ARG 5 -12.060 -6.087 2.790
44 2HH2 ARG 5 2HH2 ARG 5 -11.613 -7.703 3.229
45 H ALA 6 H ALA 6 -6.755 -3.801 0.786
46 HA ALA 6 HA ALA 6 -4.782 -5.757 1.418
47 1HB ALA 6 1HB ALA 6 -7.188 -5.885 0.201
48 2HB ALA 6 2HB ALA 6 -5.952 -7.135 0.065
49 3HB ALA 6 3HB ALA 6 -6.121 -5.921 -1.202
50 H LEU 7 H LEU 7 -5.342 -3.814 -1.540
51 HA LEU 7 HA LEU 7 -3.077 -4.432 -2.934
52 1HB LEU 7 2HB LEU 7 -4.816 -3.036 -3.878
53 2HB LEU 7 1HB LEU 7 -4.470 -1.762 -2.725
54 HG LEU 7 HG LEU 7 -2.160 -2.533 -4.366
55 1HD1 LEU 7 1HD1 LEU 7 -4.444 -2.581 -5.783
56 2HD1 LEU 7 2HD1 LEU 7 -2.897 -2.045 -6.437
57 3HD1 LEU 7 3HD1 LEU 7 -4.068 -0.860 -5.860
58 1HD2 LEU 7 1HD2 LEU 7 -3.499 0.040 -3.562
59 2HD2 LEU 7 2HD2 LEU 7 -2.102 -0.018 -4.637
60 3HD2 LEU 7 3HD2 LEU 7 -1.971 -0.620 -2.983
61 H ILE 8 H ILE 8 -3.416 -2.352 -0.138
62 HA ILE 8 HA ILE 8 -0.875 -1.237 -0.490
63 HB ILE 8 HB ILE 8 -1.042 -0.206 1.646
64 1HG1 ILE 8 2HG1 ILE 8 -3.577 -1.418 2.484
65 2HG1 ILE 8 1HG1 ILE 8 -2.200 -2.511 2.533
66 1HG2 ILE 8 1HG2 ILE 8 -2.530 0.602 -0.204
67 2HG2 ILE 8 2HG2 ILE 8 -3.047 1.035 1.422
68 3HG2 ILE 8 3HG2 ILE 8 -3.848 -0.279 0.568
69 1HD1 ILE 8 1HD1 ILE 8 -2.947 -0.593 4.427
70 2HD1 ILE 8 2HD1 ILE 8 -1.467 0.002 3.672
71 3HD1 ILE 8 3HD1 ILE 8 -1.498 -1.597 4.415
72 H LYS 9 H LYS 9 -2.093 -4.053 1.055
73 HA LYS 9 HA LYS 9 0.129 -4.737 2.591
74 1HB LYS 9 2HB LYS 9 -1.147 -6.509 3.064
75 2HB LYS 9 1HB LYS 9 -2.285 -5.854 1.910
76 1HG LYS 9 2HG LYS 9 -0.209 -7.430 0.622
77 2HG LYS 9 1HG LYS 9 -1.128 -8.348 1.807
78 1HD LYS 9 2HD LYS 9 -2.512 -8.669 0.054
79 2HD LYS 9 1HD LYS 9 -3.144 -7.101 0.555
80 1HE LYS 9 2HE LYS 9 -1.990 -5.960 -1.154
81 2HE LYS 9 1HE LYS 9 -0.901 -7.319 -1.421
82 1HZ LYS 9 1HZ LYS 9 -2.873 -6.868 -3.041
83 2HZ LYS 9 2HZ LYS 9 -3.771 -7.711 -1.883
84 3HZ LYS 9 3HZ LYS 9 -2.453 -8.456 -2.634
85 H ARG 10 H ARG 10 -0.566 -5.078 -0.791
86 HA ARG 10 HA ARG 10 1.641 -6.718 -1.473
87 1HB ARG 10 2HB ARG 10 -0.304 -5.033 -2.939
88 2HB ARG 10 1HB ARG 10 1.251 -5.229 -3.728
89 1HG ARG 10 2HG ARG 10 -0.944 -7.121 -3.382
90 2HG ARG 10 1HG ARG 10 0.265 -7.003 -4.650
91 1HD ARG 10 2HD ARG 10 1.888 -8.142 -3.257
92 2HD ARG 10 1HD ARG 10 0.758 -8.162 -1.906
93 HE ARG 10 HE ARG 10 -0.441 -9.860 -2.938
94 1HH1 ARG 10 1HH1 ARG 10 2.200 -8.792 -4.969
95 2HH1 ARG 10 2HH1 ARG 10 2.119 -10.173 -6.008
96 1HH2 ARG 10 1HH2 ARG 10 -0.540 -11.672 -4.308
97 2HH2 ARG 10 2HH2 ARG 10 0.566 -11.806 -5.635
98 H ILE 11 H ILE 11 1.093 -3.373 -0.913
99 HA ILE 11 HA ILE 11 3.669 -2.553 -1.895
100 HB ILE 11 HB ILE 11 1.318 -1.206 -0.768
101 1HG1 ILE 11 2HG1 ILE 11 2.292 0.628 -2.291
102 2HG1 ILE 11 1HG1 ILE 11 3.480 -0.577 -2.771
103 1HG2 ILE 11 1HG2 ILE 11 2.759 -0.622 1.028
104 2HG2 ILE 11 2HG2 ILE 11 2.696 0.782 -0.042
105 3HG2 ILE 11 3HG2 ILE 11 4.100 -0.288 -0.068
106 1HD1 ILE 11 1HD1 ILE 11 2.060 -1.447 -4.218
107 2HD1 ILE 11 2HD1 ILE 11 0.915 -0.167 -3.815
108 3HD1 ILE 11 3HD1 ILE 11 0.862 -1.703 -2.948
109 H GLN 12 H GLN 12 2.191 -3.475 1.165
110 HA GLN 12 HA GLN 12 4.408 -2.516 2.723
111 1HB GLN 12 2HB GLN 12 3.299 -3.334 4.590
112 2HB GLN 12 1HB GLN 12 1.977 -2.983 3.487
113 1HG GLN 12 2HG GLN 12 1.271 -5.037 3.915
114 2HG GLN 12 1HG GLN 12 2.591 -5.593 2.901
115 1HE2 GLN 12 1HE2 GLN 12 4.585 -6.195 3.913
116 2HE2 GLN 12 2HE2 GLN 12 4.583 -6.767 5.544
117 H ALA 13 H ALA 13 3.570 -5.536 1.170
118 HA ALA 13 HA ALA 13 5.804 -6.860 2.424
119 1HB ALA 13 1HB ALA 13 4.792 -8.810 1.967
120 2HB ALA 13 2HB ALA 13 4.374 -8.321 0.325
121 3HB ALA 13 3HB ALA 13 3.380 -7.794 1.683
122 H MET 14 H MET 14 5.126 -5.281 -0.543
123 HA MET 14 HA MET 14 7.175 -6.609 -2.054
124 1HB MET 14 2HB MET 14 5.420 -4.228 -2.525
125 2HB MET 14 1HB MET 14 6.805 -4.514 -3.568
126 1HG MET 14 2HG MET 14 5.133 -6.868 -3.152
127 2HG MET 14 1HG MET 14 4.307 -5.522 -3.931
128 1HE MET 14 1HE MET 14 6.701 -8.652 -5.678
129 2HE MET 14 2HE MET 14 6.401 -8.337 -3.967
130 3HE MET 14 3HE MET 14 7.897 -7.779 -4.718
131 H ILE 15 H ILE 15 6.967 -3.863 0.047
132 HA ILE 15 HA ILE 15 9.202 -2.405 -0.764
133 HB ILE 15 HB ILE 15 7.664 -1.506 0.859
134 1HG1 ILE 15 2HG1 ILE 15 10.124 -0.832 0.861
135 2HG1 ILE 15 1HG1 ILE 15 9.197 -0.428 2.300
136 1HG2 ILE 15 1HG2 ILE 15 8.437 -2.771 3.276
137 2HG2 ILE 15 2HG2 ILE 15 7.976 -4.023 2.122
138 3HG2 ILE 15 3HG2 ILE 15 6.850 -2.723 2.509
139 1HD1 ILE 15 1HD1 ILE 15 10.998 -1.277 3.339
140 2HD1 ILE 15 2HD1 ILE 15 11.464 -2.268 1.957
141 3HD1 ILE 15 3HD1 ILE 15 10.186 -2.813 3.042
142 HA PRO 16 HA PRO 16 12.198 -5.554 0.482
143 1HB PRO 16 2HB PRO 16 14.043 -5.009 -1.380
144 2HB PRO 16 1HB PRO 16 12.555 -5.874 -1.779
145 1HG PRO 16 2HG PRO 16 13.315 -3.058 -2.334
146 2HG PRO 16 1HG PRO 16 12.289 -4.153 -3.273
147 1HD PRO 16 2HD PRO 16 11.428 -2.132 -1.493
148 2HD PRO 16 1HD PRO 16 10.427 -3.384 -2.242
149 H LYS 17 H LYS 17 13.268 -2.298 -0.518
150 HA LYS 17 HA LYS 17 14.426 -1.743 2.034
151 1HB LYS 17 2HB LYS 17 16.113 -2.756 -0.176
152 2HB LYS 17 1HB LYS 17 16.720 -1.328 0.650
153 1HG LYS 17 2HG LYS 17 16.417 -2.591 2.809
154 2HG LYS 17 1HG LYS 17 16.125 -4.027 1.825
155 1HD LYS 17 2HD LYS 17 18.298 -4.242 1.272
156 2HD LYS 17 1HD LYS 17 18.525 -2.501 1.093
157 1HE LYS 17 2HE LYS 17 19.603 -2.494 3.035
158 2HE LYS 17 1HE LYS 17 18.096 -2.948 3.829
159 1HZ LYS 17 1HZ LYS 17 18.674 -5.174 3.832
160 2HZ LYS 17 2HZ LYS 17 20.152 -4.419 4.156
161 3HZ LYS 17 3HZ LYS 17 19.823 -5.001 2.602
162 H GLY 18 H GLY 18 12.535 -0.596 0.105
163 1HA GLY 18 2HA GLY 18 13.779 1.665 -1.133
164 2HA GLY 18 1HA GLY 18 12.053 1.392 -0.959
165 H GLY 19 H GLY 19 11.920 3.680 -0.524
166 1HA GLY 19 2HA GLY 19 11.438 4.378 2.059
167 2HA GLY 19 1HA GLY 19 13.146 4.738 1.857
168 H ARG 20 H ARG 20 9.995 5.322 0.309
169 HA ARG 20 HA ARG 20 10.388 8.132 0.242
170 1HB ARG 20 2HB ARG 20 10.319 8.238 -2.327
171 2HB ARG 20 1HB ARG 20 11.859 7.882 -1.557
172 1HG ARG 20 2HG ARG 20 10.541 5.418 -2.023
173 2HG ARG 20 1HG ARG 20 10.446 6.372 -3.504
174 1HD ARG 20 2HD ARG 20 12.929 5.635 -1.962
175 2HD ARG 20 1HD ARG 20 12.454 5.054 -3.558
176 HE ARG 20 HE ARG 20 12.590 7.732 -3.894
177 1HH1 ARG 20 1HH1 ARG 20 14.813 5.378 -2.595
178 2HH1 ARG 20 2HH1 ARG 20 16.223 6.257 -3.079
179 1HH2 ARG 20 1HH2 ARG 20 14.444 8.890 -4.534
180 2HH2 ARG 20 2HH2 ARG 20 16.015 8.252 -4.180
181 H MET 21 H MET 21 8.368 6.459 1.173
182 HA MET 21 HA MET 21 6.109 6.202 1.184
183 1HB MET 21 2HB MET 21 5.696 8.465 1.204
184 2HB MET 21 1HB MET 21 6.523 8.740 -0.322
185 1HG MET 21 2HG MET 21 4.614 7.735 -1.518
186 2HG MET 21 1HG MET 21 3.785 7.514 0.018
187 1HE MET 21 1HE MET 21 5.697 9.944 -2.098
188 2HE MET 21 2HE MET 21 5.827 11.081 -0.755
189 3HE MET 21 3HE MET 21 4.751 11.433 -2.108
190 H LEU 22 H LEU 22 4.177 5.747 -0.170
191 HA LEU 22 HA LEU 22 4.767 4.852 -2.871
192 1HB LEU 22 2HB LEU 22 4.131 3.198 -0.513
193 2HB LEU 22 1HB LEU 22 3.239 2.840 -1.972
194 HG LEU 22 HG LEU 22 6.094 3.098 -2.480
195 1HD1 LEU 22 1HD1 LEU 22 6.754 2.172 -0.526
196 2HD1 LEU 22 2HD1 LEU 22 6.324 0.682 -1.366
197 3HD1 LEU 22 3HD1 LEU 22 5.190 1.411 -0.229
198 1HD2 LEU 22 1HD2 LEU 22 3.832 1.426 -3.254
199 2HD2 LEU 22 2HD2 LEU 22 5.348 0.540 -3.114
200 3HD2 LEU 22 3HD2 LEU 22 5.239 1.935 -4.185
201 HA PRO 23 HA PRO 23 0.496 5.898 -3.574
202 1HB PRO 23 2HB PRO 23 -0.318 3.455 -4.846
203 2HB PRO 23 1HB PRO 23 0.220 4.943 -5.598
204 1HG PRO 23 2HG PRO 23 1.625 2.602 -5.703
205 2HG PRO 23 1HG PRO 23 2.367 4.209 -5.848
206 1HD PRO 23 2HD PRO 23 2.141 2.447 -3.433
207 2HD PRO 23 1HD PRO 23 3.533 3.369 -4.008
208 H GLN 24 H GLN 24 0.836 2.666 -2.298
209 HA GLN 24 HA GLN 24 -1.698 1.959 -1.620
210 1HB GLN 24 2HB GLN 24 -0.721 0.302 -0.435
211 2HB GLN 24 1HB GLN 24 0.756 0.922 -1.138
212 1HG GLN 24 2HG GLN 24 -0.335 1.599 1.584
213 2HG GLN 24 1HG GLN 24 1.039 0.553 1.235
214 1HE2 GLN 24 1HE2 GLN 24 1.272 2.685 2.938
215 2HE2 GLN 24 2HE2 GLN 24 2.268 3.900 2.219
216 H LEU 25 H LEU 25 0.112 4.574 -0.282
217 HA LEU 25 HA LEU 25 -1.616 4.704 2.038
218 1HB LEU 25 2HB LEU 25 -0.419 7.055 2.230
219 2HB LEU 25 1HB LEU 25 0.325 5.564 2.768
220 HG LEU 25 HG LEU 25 1.305 5.562 0.308
221 1HD1 LEU 25 1HD1 LEU 25 0.593 7.378 -0.805
222 2HD1 LEU 25 2HD1 LEU 25 1.867 8.197 0.097
223 3HD1 LEU 25 3HD1 LEU 25 0.202 8.260 0.670
224 1HD2 LEU 25 1HD2 LEU 25 2.225 6.287 2.859
225 2HD2 LEU 25 2HD2 LEU 25 2.834 7.511 1.745
226 3HD2 LEU 25 3HD2 LEU 25 3.182 5.806 1.459
227 H VAL 26 H VAL 26 -1.236 6.527 -0.933
228 HA VAL 26 HA VAL 26 -3.469 8.260 -0.300
229 HB VAL 26 HB VAL 26 -2.520 7.891 -3.105
230 1HG1 VAL 26 1HG1 VAL 26 -3.279 10.346 -1.530
231 2HG1 VAL 26 2HG1 VAL 26 -4.368 9.421 -2.565
232 3HG1 VAL 26 3HG1 VAL 26 -2.986 10.263 -3.267
233 1HG2 VAL 26 1HG2 VAL 26 -0.381 8.106 -2.346
234 2HG2 VAL 26 2HG2 VAL 26 -0.870 8.948 -0.876
235 3HG2 VAL 26 3HG2 VAL 26 -0.823 9.811 -2.412
236 H CYS 27 H CYS 27 -2.815 5.215 -1.589
237 HA CYS 27 HA CYS 27 -4.997 4.789 -3.253
238 1HB CYS 27 2HB CYS 27 -3.856 2.939 -3.598
239 2HB CYS 27 1HB CYS 27 -2.769 3.330 -2.291
240 H ARG 28 H ARG 28 -4.484 4.080 0.155
241 HA ARG 28 HA ARG 28 -7.116 3.076 0.440
242 1HB ARG 28 2HB ARG 28 -5.887 4.183 2.887
243 2HB ARG 28 1HB ARG 28 -6.628 2.618 2.618
244 1HG ARG 28 2HG ARG 28 -4.599 1.727 2.622
245 2HG ARG 28 1HG ARG 28 -4.276 2.581 1.131
246 1HD ARG 28 2HD ARG 28 -2.547 3.099 2.723
247 2HD ARG 28 1HD ARG 28 -3.525 4.535 2.445
248 HE ARG 28 HE ARG 28 -3.430 2.921 4.877
249 1HH1 ARG 28 1HH1 ARG 28 -4.684 5.718 3.191
250 2HH1 ARG 28 2HH1 ARG 28 -5.268 6.474 4.634
251 1HH2 ARG 28 1HH2 ARG 28 -4.200 3.925 6.767
252 2HH2 ARG 28 2HH2 ARG 28 -4.995 5.460 6.658
253 H LEU 29 H LEU 29 -5.650 6.205 0.536
254 HA LEU 29 HA LEU 29 -7.723 7.577 1.892
255 1HB LEU 29 2HB LEU 29 -5.413 8.319 0.203
256 2HB LEU 29 1HB LEU 29 -6.707 9.499 0.300
257 HG LEU 29 HG LEU 29 -5.180 8.360 2.645
258 1HD1 LEU 29 1HD1 LEU 29 -3.737 9.845 1.551
259 2HD1 LEU 29 2HD1 LEU 29 -4.480 10.800 2.835
260 3HD1 LEU 29 3HD1 LEU 29 -5.042 10.970 1.171
261 1HD2 LEU 29 1HD2 LEU 29 -7.121 8.867 3.689
262 2HD2 LEU 29 2HD2 LEU 29 -7.637 9.985 2.426
263 3HD2 LEU 29 3HD2 LEU 29 -6.453 10.499 3.627
264 H VAL 30 H VAL 30 -7.302 6.534 -1.392
265 HA VAL 30 HA VAL 30 -9.602 8.054 -2.323
266 HB VAL 30 HB VAL 30 -7.914 6.099 -3.875
267 1HG1 VAL 30 1HG1 VAL 30 -9.815 6.363 -5.144
268 2HG1 VAL 30 2HG1 VAL 30 -8.818 7.683 -5.754
269 3HG1 VAL 30 3HG1 VAL 30 -10.092 8.010 -4.581
270 1HG2 VAL 30 1HG2 VAL 30 -6.964 8.394 -2.798
271 2HG2 VAL 30 2HG2 VAL 30 -7.577 8.983 -4.343
272 3HG2 VAL 30 3HG2 VAL 30 -6.379 7.690 -4.306
273 H LEU 31 H LEU 31 -8.661 4.658 -2.070
274 HA LEU 31 HA LEU 31 -11.171 3.703 -2.960
275 1HB LEU 31 2HB LEU 31 -8.714 2.531 -2.409
276 2HB LEU 31 1HB LEU 31 -9.809 1.817 -1.237
277 HG LEU 31 HG LEU 31 -11.324 1.162 -3.086
278 1HD1 LEU 31 1HD1 LEU 31 -10.987 2.603 -4.842
279 2HD1 LEU 31 2HD1 LEU 31 -10.111 1.174 -5.390
280 3HD1 LEU 31 3HD1 LEU 31 -9.230 2.539 -4.702
281 1HD2 LEU 31 1HD2 LEU 31 -8.539 0.166 -2.862
282 2HD2 LEU 31 2HD2 LEU 31 -9.527 -0.429 -4.189
283 3HD2 LEU 31 3HD2 LEU 31 -10.062 -0.647 -2.527
284 H ARG 32 H ARG 32 -10.021 4.747 0.130
285 HA ARG 32 HA ARG 32 -11.818 3.450 1.828
286 1HB ARG 32 2HB ARG 32 -10.052 4.785 2.779
287 2HB ARG 32 1HB ARG 32 -10.639 6.233 1.973
288 1HG ARG 32 2HG ARG 32 -12.287 4.773 4.011
289 2HG ARG 32 1HG ARG 32 -11.097 5.994 4.463
290 1HD ARG 32 2HD ARG 32 -12.647 7.091 2.375
291 2HD ARG 32 1HD ARG 32 -13.770 6.340 3.505
292 HE ARG 32 HE ARG 32 -11.733 8.098 4.615
293 1HH1 ARG 32 1HH1 ARG 32 -15.062 7.660 3.641
294 2HH1 ARG 32 2HH1 ARG 32 -15.635 9.009 4.560
295 1HH2 ARG 32 1HH2 ARG 32 -12.494 9.873 5.820
296 2HH2 ARG 32 2HH2 ARG 32 -14.181 10.264 5.793
297 H CYS 33 H CYS 33 -12.080 6.333 -0.076
298 HA CYS 33 HA CYS 33 -13.847 7.850 -0.277
299 1HB CYS 33 2HB CYS 33 -14.621 7.253 -2.308
300 2HB CYS 33 1HB CYS 33 -13.481 5.940 -2.116
301 H SER 34 H SER 34 -16.521 7.413 -0.865
302 HA SER 34 HA SER 34 -18.558 7.418 0.138
303 1HB SER 34 2HB SER 34 -17.497 4.893 0.540
304 2HB SER 34 1HB SER 34 -18.007 5.375 2.158
305 HG SER 34 HG SER 34 -20.023 5.237 1.558
Start of MODEL 8
1 1H CYS 1 1HT CYS 1 -15.377 -1.927 -3.801
2 2H CYS 1 2HT CYS 1 -15.750 -0.804 -5.042
3 3H CYS 1 3HT CYS 1 -15.905 -0.349 -3.394
4 HA CYS 1 HA CYS 1 -13.381 -1.135 -4.679
5 1HB CYS 1 2HB CYS 1 -13.249 1.569 -4.081
6 2HB CYS 1 1HB CYS 1 -13.452 0.874 -5.681
7 H TRP 2 H TRP 2 -11.900 -1.651 -3.222
8 HA TRP 2 HA TRP 2 -11.350 -0.208 -0.896
9 1HB TRP 2 2HB TRP 2 -12.016 -2.225 0.683
10 2HB TRP 2 1HB TRP 2 -13.158 -0.940 0.311
11 HD1 TRP 2 HD TRP 2 -12.300 -4.510 -0.946
12 HE1 TRP 2 1HE TRP 2 -14.487 -5.615 -1.737
13 HE3 TRP 2 3HE TRP 2 -15.492 -0.564 -0.290
14 HZ2 TRP 2 2HZ TRP 2 -17.205 -4.910 -2.040
15 HZ3 TRP 2 3HZ TRP 2 -17.868 -0.866 -0.855
16 HH2 TRP 2 HH TRP 2 -18.704 -2.993 -1.712
17 H LEU 3 H LEU 3 -9.921 -1.351 -3.031
18 HA LEU 3 HA LEU 3 -8.474 -3.632 -1.937
19 1HB LEU 3 2HB LEU 3 -7.588 -2.263 -4.425
20 2HB LEU 3 1HB LEU 3 -7.603 -3.972 -4.035
21 HG LEU 3 HG LEU 3 -10.094 -2.388 -4.651
22 1HD1 LEU 3 1HD1 LEU 3 -8.116 -3.707 -6.418
23 2HD1 LEU 3 2HD1 LEU 3 -9.140 -2.301 -6.708
24 3HD1 LEU 3 3HD1 LEU 3 -9.825 -3.923 -6.799
25 1HD2 LEU 3 1HD2 LEU 3 -9.515 -5.333 -4.388
26 2HD2 LEU 3 2HD2 LEU 3 -11.008 -4.675 -5.058
27 3HD2 LEU 3 3HD2 LEU 3 -10.578 -4.352 -3.378
28 H CYS 4 H CYS 4 -8.399 -0.427 -1.431
29 HA CYS 4 HA CYS 4 -5.823 0.455 -1.774
30 1HB CYS 4 2HB CYS 4 -6.949 2.213 -1.054
31 2HB CYS 4 1HB CYS 4 -8.181 1.218 -0.322
32 H ARG 5 H ARG 5 -6.836 -0.342 1.573
33 HA ARG 5 HA ARG 5 -4.300 -0.750 2.549
34 1HB ARG 5 2HB ARG 5 -5.401 -2.236 4.273
35 2HB ARG 5 1HB ARG 5 -6.094 -0.630 4.096
36 1HG ARG 5 2HG ARG 5 -8.008 -1.834 4.135
37 2HG ARG 5 1HG ARG 5 -7.682 -1.912 2.402
38 1HD ARG 5 2HD ARG 5 -6.315 -4.056 3.116
39 2HD ARG 5 1HD ARG 5 -7.421 -4.017 4.489
40 HE ARG 5 HE ARG 5 -9.018 -3.753 2.278
41 1HH1 ARG 5 1HH1 ARG 5 -6.710 -6.113 3.412
42 2HH1 ARG 5 2HH1 ARG 5 -7.491 -7.440 2.620
43 1HH2 ARG 5 1HH2 ARG 5 -10.046 -5.492 1.239
44 2HH2 ARG 5 2HH2 ARG 5 -9.387 -7.087 1.386
45 H ALA 6 H ALA 6 -6.358 -3.012 0.825
46 HA ALA 6 HA ALA 6 -4.904 -5.361 1.285
47 1HB ALA 6 1HB ALA 6 -7.234 -4.880 0.132
48 2HB ALA 6 2HB ALA 6 -6.315 -6.349 -0.199
49 3HB ALA 6 3HB ALA 6 -6.255 -4.997 -1.330
50 H LEU 7 H LEU 7 -4.651 -3.017 -1.392
51 HA LEU 7 HA LEU 7 -2.561 -4.470 -2.681
52 1HB LEU 7 2HB LEU 7 -2.564 -2.802 -4.304
53 2HB LEU 7 1HB LEU 7 -4.225 -2.859 -3.753
54 HG LEU 7 HG LEU 7 -3.241 -0.911 -2.139
55 1HD1 LEU 7 1HD1 LEU 7 -1.146 -1.259 -3.836
56 2HD1 LEU 7 2HD1 LEU 7 -1.517 0.243 -2.989
57 3HD1 LEU 7 3HD1 LEU 7 -2.055 0.013 -4.652
58 1HD2 LEU 7 1HD2 LEU 7 -4.194 0.666 -3.911
59 2HD2 LEU 7 2HD2 LEU 7 -5.262 -0.586 -3.276
60 3HD2 LEU 7 3HD2 LEU 7 -4.508 -0.791 -4.857
61 H ILE 8 H ILE 8 -2.653 -2.134 -0.132
62 HA ILE 8 HA ILE 8 0.000 -1.235 -0.536
63 HB ILE 8 HB ILE 8 -0.161 0.030 1.405
64 1HG1 ILE 8 2HG1 ILE 8 -2.369 -0.729 2.900
65 2HG1 ILE 8 1HG1 ILE 8 -1.647 -2.259 2.423
66 1HG2 ILE 8 1HG2 ILE 8 -2.417 -0.072 -0.311
67 2HG2 ILE 8 2HG2 ILE 8 -1.770 1.303 0.579
68 3HG2 ILE 8 3HG2 ILE 8 -2.986 0.266 1.323
69 1HD1 ILE 8 1HD1 ILE 8 -0.853 -0.508 4.487
70 2HD1 ILE 8 2HD1 ILE 8 0.431 -0.533 3.279
71 3HD1 ILE 8 3HD1 ILE 8 -0.124 -2.040 4.006
72 H LYS 9 H LYS 9 -1.465 -3.905 1.085
73 HA LYS 9 HA LYS 9 0.946 -4.605 2.483
74 1HB LYS 9 2HB LYS 9 -0.538 -6.962 2.293
75 2HB LYS 9 1HB LYS 9 -0.414 -5.878 3.658
76 1HG LYS 9 2HG LYS 9 -2.353 -5.011 1.699
77 2HG LYS 9 1HG LYS 9 -2.709 -6.596 2.372
78 1HD LYS 9 2HD LYS 9 -3.734 -4.714 3.642
79 2HD LYS 9 1HD LYS 9 -2.673 -5.742 4.601
80 1HE LYS 9 2HE LYS 9 -1.037 -3.719 3.570
81 2HE LYS 9 1HE LYS 9 -2.515 -2.913 4.094
82 1HZ LYS 9 1HZ LYS 9 -2.045 -3.287 6.234
83 2HZ LYS 9 2HZ LYS 9 -0.460 -3.551 5.706
84 3HZ LYS 9 3HZ LYS 9 -1.494 -4.864 5.962
85 H ARG 10 H ARG 10 -0.566 -5.193 -0.547
86 HA ARG 10 HA ARG 10 0.976 -7.383 -1.378
87 1HB ARG 10 2HB ARG 10 -0.476 -5.165 -2.771
88 2HB ARG 10 1HB ARG 10 0.609 -6.185 -3.700
89 1HG ARG 10 2HG ARG 10 -1.955 -6.699 -3.465
90 2HG ARG 10 1HG ARG 10 -0.749 -7.978 -3.581
91 1HD ARG 10 2HD ARG 10 -1.529 -6.961 -0.892
92 2HD ARG 10 1HD ARG 10 -2.626 -8.043 -1.745
93 HE ARG 10 HE ARG 10 -0.259 -8.780 -0.404
94 1HH1 ARG 10 1HH1 ARG 10 -2.050 -9.464 -3.319
95 2HH1 ARG 10 2HH1 ARG 10 -1.450 -11.082 -3.458
96 1HH2 ARG 10 1HH2 ARG 10 0.534 -10.909 -0.585
97 2HH2 ARG 10 2HH2 ARG 10 0.017 -11.903 -1.906
98 H ILE 11 H ILE 11 1.505 -4.056 -0.823
99 HA ILE 11 HA ILE 11 4.007 -3.905 -2.284
100 HB ILE 11 HB ILE 11 2.251 -2.011 -0.980
101 1HG1 ILE 11 2HG1 ILE 11 3.416 -0.417 -2.432
102 2HG1 ILE 11 1HG1 ILE 11 4.671 -1.610 -2.752
103 1HG2 ILE 11 1HG2 ILE 11 3.815 -2.030 0.861
104 2HG2 ILE 11 2HG2 ILE 11 3.982 -0.519 -0.035
105 3HG2 ILE 11 3HG2 ILE 11 5.169 -1.807 -0.245
106 1HD1 ILE 11 1HD1 ILE 11 3.411 -2.722 -4.244
107 2HD1 ILE 11 2HD1 ILE 11 2.582 -1.171 -4.367
108 3HD1 ILE 11 3HD1 ILE 11 1.916 -2.450 -3.351
109 H GLN 12 H GLN 12 2.751 -4.356 0.917
110 HA GLN 12 HA GLN 12 4.918 -4.186 2.571
111 1HB GLN 12 2HB GLN 12 2.414 -5.643 2.493
112 2HB GLN 12 1HB GLN 12 3.649 -6.541 3.331
113 1HG GLN 12 2HG GLN 12 1.984 -4.572 4.299
114 2HG GLN 12 1HG GLN 12 3.343 -5.390 5.101
115 1HE2 GLN 12 1HE2 GLN 12 3.224 -2.920 2.533
116 2HE2 GLN 12 2HE2 GLN 12 4.183 -1.756 3.374
117 H ALA 13 H ALA 13 3.789 -7.161 1.024
118 HA ALA 13 HA ALA 13 6.057 -8.548 1.776
119 1HB ALA 13 1HB ALA 13 5.199 -10.374 0.638
120 2HB ALA 13 2HB ALA 13 4.543 -9.381 -0.664
121 3HB ALA 13 3HB ALA 13 3.747 -9.411 0.910
122 H MET 14 H MET 14 5.307 -6.568 -0.972
123 HA MET 14 HA MET 14 7.470 -7.344 -2.639
124 1HB MET 14 2HB MET 14 5.546 -5.078 -2.546
125 2HB MET 14 1HB MET 14 7.005 -4.865 -3.503
126 1HG MET 14 2HG MET 14 5.322 -7.303 -3.856
127 2HG MET 14 1HG MET 14 4.860 -5.781 -4.613
128 1HE MET 14 1HE MET 14 7.961 -8.764 -5.842
129 2HE MET 14 2HE MET 14 6.928 -8.754 -4.413
130 3HE MET 14 3HE MET 14 8.482 -7.920 -4.384
131 H ILE 15 H ILE 15 7.082 -4.737 -0.237
132 HA ILE 15 HA ILE 15 9.620 -3.572 -0.720
133 HB ILE 15 HB ILE 15 7.954 -2.249 0.372
134 1HG1 ILE 15 2HG1 ILE 15 10.457 -2.083 1.033
135 2HG1 ILE 15 1HG1 ILE 15 9.269 -1.214 1.996
136 1HG2 ILE 15 1HG2 ILE 15 7.247 -2.770 2.725
137 2HG2 ILE 15 2HG2 ILE 15 7.954 -4.368 2.502
138 3HG2 ILE 15 3HG2 ILE 15 6.614 -3.849 1.483
139 1HD1 ILE 15 1HD1 ILE 15 10.039 -2.217 3.807
140 2HD1 ILE 15 2HD1 ILE 15 11.179 -3.140 2.831
141 3HD1 ILE 15 3HD1 ILE 15 9.570 -3.781 3.143
142 HA PRO 16 HA PRO 16 11.910 -6.795 1.399
143 1HB PRO 16 2HB PRO 16 14.352 -6.095 0.526
144 2HB PRO 16 1HB PRO 16 13.176 -6.891 -0.525
145 1HG PRO 16 2HG PRO 16 13.966 -4.021 -0.397
146 2HG PRO 16 1HG PRO 16 13.558 -5.012 -1.806
147 1HD PRO 16 2HD PRO 16 11.841 -3.224 -0.552
148 2HD PRO 16 1HD PRO 16 11.339 -4.552 -1.614
149 H LYS 17 H LYS 17 13.278 -3.485 1.332
150 HA LYS 17 HA LYS 17 13.411 -3.479 4.228
151 1HB LYS 17 2HB LYS 17 15.595 -4.445 2.966
152 2HB LYS 17 1HB LYS 17 15.980 -2.730 2.971
153 1HG LYS 17 2HG LYS 17 15.790 -2.648 5.372
154 2HG LYS 17 1HG LYS 17 15.259 -4.330 5.417
155 1HD LYS 17 2HD LYS 17 17.382 -5.114 4.710
156 2HD LYS 17 1HD LYS 17 17.914 -3.488 4.275
157 1HE LYS 17 2HE LYS 17 18.900 -3.483 6.287
158 2HE LYS 17 1HE LYS 17 17.279 -3.183 6.911
159 1HZ LYS 17 1HZ LYS 17 18.905 -5.586 7.045
160 2HZ LYS 17 2HZ LYS 17 17.260 -5.836 6.740
161 3HZ LYS 17 3HZ LYS 17 17.743 -5.000 8.128
162 H GLY 18 H GLY 18 12.250 -1.927 1.844
163 1HA GLY 18 2HA GLY 18 13.473 0.630 1.819
164 2HA GLY 18 1HA GLY 18 11.839 0.264 1.286
165 H GLY 19 H GLY 19 10.114 0.414 2.771
166 1HA GLY 19 2HA GLY 19 9.054 1.030 4.746
167 2HA GLY 19 1HA GLY 19 10.629 1.284 5.481
168 H ARG 20 H ARG 20 7.906 2.755 4.090
169 HA ARG 20 HA ARG 20 8.634 5.330 4.901
170 1HB ARG 20 2HB ARG 20 9.646 4.588 2.301
171 2HB ARG 20 1HB ARG 20 8.505 5.917 2.153
172 1HG ARG 20 2HG ARG 20 9.790 7.176 3.833
173 2HG ARG 20 1HG ARG 20 10.959 5.856 3.894
174 1HD ARG 20 2HD ARG 20 10.280 7.082 1.261
175 2HD ARG 20 1HD ARG 20 11.363 7.944 2.353
176 HE ARG 20 HE ARG 20 12.139 5.223 2.008
177 1HH1 ARG 20 1HH1 ARG 20 12.257 8.374 0.516
178 2HH1 ARG 20 2HH1 ARG 20 13.694 8.030 -0.388
179 1HH2 ARG 20 1HH2 ARG 20 14.026 4.768 0.821
180 2HH2 ARG 20 2HH2 ARG 20 14.698 5.982 -0.216
181 H MET 21 H MET 21 7.077 4.706 1.794
182 HA MET 21 HA MET 21 4.487 4.234 2.339
183 1HB MET 21 2HB MET 21 4.006 5.933 3.819
184 2HB MET 21 1HB MET 21 5.193 7.024 3.121
185 1HG MET 21 2HG MET 21 3.709 7.469 1.249
186 2HG MET 21 1HG MET 21 2.528 6.334 1.899
187 1HE MET 21 1HE MET 21 4.384 9.518 2.096
188 2HE MET 21 2HE MET 21 4.569 9.457 3.848
189 3HE MET 21 3HE MET 21 3.432 10.593 3.120
190 H LEU 22 H LEU 22 2.991 4.917 0.580
191 HA LEU 22 HA LEU 22 3.773 6.498 -1.573
192 1HB LEU 22 2HB LEU 22 5.541 5.023 -2.058
193 2HB LEU 22 1HB LEU 22 4.540 3.610 -1.815
194 HG LEU 22 HG LEU 22 3.741 5.435 -4.010
195 1HD1 LEU 22 1HD1 LEU 22 5.932 5.518 -4.663
196 2HD1 LEU 22 2HD1 LEU 22 5.429 4.012 -5.432
197 3HD1 LEU 22 3HD1 LEU 22 6.330 3.969 -3.916
198 1HD2 LEU 22 1HD2 LEU 22 3.472 3.141 -5.102
199 2HD2 LEU 22 2HD2 LEU 22 2.400 3.530 -3.757
200 3HD2 LEU 22 3HD2 LEU 22 3.791 2.476 -3.501
201 HA PRO 23 HA PRO 23 -0.014 4.008 -2.892
202 1HB PRO 23 2HB PRO 23 -0.458 1.615 -1.452
203 2HB PRO 23 1HB PRO 23 0.227 1.768 -3.070
204 1HG PRO 23 2HG PRO 23 1.601 0.858 -0.824
205 2HG PRO 23 1HG PRO 23 2.351 1.453 -2.317
206 1HD PRO 23 2HD PRO 23 1.831 2.905 0.254
207 2HD PRO 23 1HD PRO 23 3.260 2.964 -0.792
208 H GLN 24 H GLN 24 0.084 2.905 0.443
209 HA GLN 24 HA GLN 24 -2.388 3.012 1.326
210 1HB GLN 24 2HB GLN 24 -0.593 4.574 3.078
211 2HB GLN 24 1HB GLN 24 -1.631 3.210 3.460
212 1HG GLN 24 2HG GLN 24 0.012 1.738 2.291
213 2HG GLN 24 1HG GLN 24 1.081 3.135 2.171
214 1HE2 GLN 24 1HE2 GLN 24 0.649 4.330 4.606
215 2HE2 GLN 24 2HE2 GLN 24 1.240 3.304 5.864
216 H LEU 25 H LEU 25 -0.635 5.905 0.504
217 HA LEU 25 HA LEU 25 -2.618 7.649 1.600
218 1HB LEU 25 2HB LEU 25 -1.348 9.398 0.187
219 2HB LEU 25 1HB LEU 25 -0.548 8.665 1.563
220 HG LEU 25 HG LEU 25 0.462 7.019 -0.144
221 1HD1 LEU 25 1HD1 LEU 25 -0.356 7.219 -2.199
222 2HD1 LEU 25 2HD1 LEU 25 0.666 8.649 -2.333
223 3HD1 LEU 25 3HD1 LEU 25 -1.030 8.816 -1.877
224 1HD2 LEU 25 1HD2 LEU 25 1.351 9.368 0.936
225 2HD2 LEU 25 2HD2 LEU 25 1.617 9.612 -0.791
226 3HD2 LEU 25 3HD2 LEU 25 2.329 8.220 0.023
227 H VAL 26 H VAL 26 -1.994 6.327 -1.570
228 HA VAL 26 HA VAL 26 -4.160 7.885 -2.766
229 HB VAL 26 HB VAL 26 -2.632 5.595 -3.994
230 1HG1 VAL 26 1HG1 VAL 26 -3.413 6.506 -6.120
231 2HG1 VAL 26 2HG1 VAL 26 -4.274 7.782 -5.258
232 3HG1 VAL 26 3HG1 VAL 26 -4.765 6.099 -5.063
233 1HG2 VAL 26 1HG2 VAL 26 -1.824 8.366 -3.566
234 2HG2 VAL 26 2HG2 VAL 26 -1.706 7.849 -5.246
235 3HG2 VAL 26 3HG2 VAL 26 -0.852 6.956 -3.989
236 H CYS 27 H CYS 27 -3.354 4.865 -1.393
237 HA CYS 27 HA CYS 27 -5.524 3.331 -2.247
238 1HB CYS 27 2HB CYS 27 -4.409 1.755 -1.129
239 2HB CYS 27 1HB CYS 27 -3.210 2.954 -0.712
240 H ARG 28 H ARG 28 -4.879 5.128 0.712
241 HA ARG 28 HA ARG 28 -7.427 4.711 1.768
242 1HB ARG 28 2HB ARG 28 -5.410 6.882 2.312
243 2HB ARG 28 1HB ARG 28 -6.890 6.674 3.243
244 1HG ARG 28 2HG ARG 28 -6.148 4.765 4.259
245 2HG ARG 28 1HG ARG 28 -5.084 4.321 2.925
246 1HD ARG 28 2HD ARG 28 -3.811 6.505 3.641
247 2HD ARG 28 1HD ARG 28 -4.649 6.259 5.169
248 HE ARG 28 HE ARG 28 -2.398 4.830 4.223
249 1HH1 ARG 28 1HH1 ARG 28 -5.362 4.410 6.015
250 2HH1 ARG 28 2HH1 ARG 28 -4.760 3.077 6.942
251 1HH2 ARG 28 1HH2 ARG 28 -1.601 3.081 5.445
252 2HH2 ARG 28 2HH2 ARG 28 -2.621 2.324 6.621
253 H LEU 29 H LEU 29 -6.144 6.985 -0.526
254 HA LEU 29 HA LEU 29 -8.262 8.854 -0.526
255 1HB LEU 29 2HB LEU 29 -6.218 7.985 -2.528
256 2HB LEU 29 1HB LEU 29 -7.558 8.971 -3.076
257 HG LEU 29 HG LEU 29 -5.711 9.779 -0.835
258 1HD1 LEU 29 1HD1 LEU 29 -5.013 9.550 -3.503
259 2HD1 LEU 29 2HD1 LEU 29 -4.200 10.530 -2.284
260 3HD1 LEU 29 3HD1 LEU 29 -5.436 11.250 -3.315
261 1HD2 LEU 29 1HD2 LEU 29 -7.489 11.149 -0.531
262 2HD2 LEU 29 2HD2 LEU 29 -8.045 10.981 -2.196
263 3HD2 LEU 29 3HD2 LEU 29 -6.699 12.058 -1.820
264 H VAL 30 H VAL 30 -7.864 5.660 -1.745
265 HA VAL 30 HA VAL 30 -10.368 5.676 -3.222
266 HB VAL 30 HB VAL 30 -8.248 3.560 -2.842
267 1HG1 VAL 30 1HG1 VAL 30 -10.226 2.298 -2.942
268 2HG1 VAL 30 2HG1 VAL 30 -9.605 2.299 -4.594
269 3HG1 VAL 30 3HG1 VAL 30 -10.944 3.360 -4.152
270 1HG2 VAL 30 1HG2 VAL 30 -7.512 5.150 -4.406
271 2HG2 VAL 30 2HG2 VAL 30 -9.107 5.285 -5.145
272 3HG2 VAL 30 3HG2 VAL 30 -8.152 3.820 -5.373
273 H LEU 31 H LEU 31 -9.027 4.676 -0.185
274 HA LEU 31 HA LEU 31 -10.723 2.707 0.684
275 1HB LEU 31 2HB LEU 31 -9.196 3.140 2.319
276 2HB LEU 31 1HB LEU 31 -9.214 4.863 2.017
277 HG LEU 31 HG LEU 31 -11.594 3.646 3.334
278 1HD1 LEU 31 1HD1 LEU 31 -10.377 2.795 4.993
279 2HD1 LEU 31 2HD1 LEU 31 -10.011 4.461 5.437
280 3HD1 LEU 31 3HD1 LEU 31 -8.897 3.557 4.410
281 1HD2 LEU 31 1HD2 LEU 31 -12.061 5.768 3.913
282 2HD2 LEU 31 2HD2 LEU 31 -10.951 6.171 2.603
283 3HD2 LEU 31 3HD2 LEU 31 -10.377 6.153 4.271
284 H ARG 32 H ARG 32 -11.303 6.120 0.363
285 HA ARG 32 HA ARG 32 -13.763 6.299 1.695
286 1HB ARG 32 2HB ARG 32 -12.439 8.244 0.844
287 2HB ARG 32 1HB ARG 32 -12.938 7.812 -0.787
288 1HG ARG 32 2HG ARG 32 -15.014 8.286 1.299
289 2HG ARG 32 1HG ARG 32 -14.204 9.661 0.542
290 1HD ARG 32 2HD ARG 32 -15.410 9.439 -1.315
291 2HD ARG 32 1HD ARG 32 -15.020 7.723 -1.435
292 HE ARG 32 HE ARG 32 -17.045 7.224 -0.480
293 1HH1 ARG 32 1HH1 ARG 32 -16.389 10.625 -0.052
294 2HH1 ARG 32 2HH1 ARG 32 -17.981 10.987 0.525
295 1HH2 ARG 32 1HH2 ARG 32 -19.139 7.698 0.280
296 2HH2 ARG 32 2HH2 ARG 32 -19.542 9.326 0.714
297 H CYS 33 H CYS 33 -13.184 6.064 -1.757
298 HA CYS 33 HA CYS 33 -14.440 5.294 -3.492
299 1HB CYS 33 2HB CYS 33 -13.726 3.172 -3.065
300 2HB CYS 33 1HB CYS 33 -14.336 3.177 -1.420
301 H SER 34 H SER 34 -16.603 4.688 -4.312
302 HA SER 34 HA SER 34 -18.832 5.102 -4.520
303 1HB SER 34 2HB SER 34 -18.613 3.600 -2.305
304 2HB SER 34 1HB SER 34 -19.290 5.059 -1.581
305 HG SER 34 HG SER 34 -20.939 3.653 -2.253
Start of MODEL 9
1 1H CYS 1 1HT CYS 1 -13.043 -1.954 -4.305
2 2H CYS 1 2HT CYS 1 -14.535 -1.516 -5.029
3 3H CYS 1 3HT CYS 1 -14.517 -2.343 -3.525
4 HA CYS 1 HA CYS 1 -13.300 0.296 -3.934
5 1HB CYS 1 2HB CYS 1 -15.713 0.325 -4.494
6 2HB CYS 1 1HB CYS 1 -16.072 -0.381 -2.923
7 H TRP 2 H TRP 2 -12.968 -2.418 -2.299
8 HA TRP 2 HA TRP 2 -12.232 -1.023 0.144
9 1HB TRP 2 2HB TRP 2 -13.280 -3.288 1.254
10 2HB TRP 2 1HB TRP 2 -14.085 -1.726 1.208
11 HD1 TRP 2 HD TRP 2 -13.945 -4.975 -0.913
12 HE1 TRP 2 1HE TRP 2 -16.268 -5.330 -1.964
13 HE3 TRP 2 3HE TRP 2 -16.238 -0.704 0.720
14 HZ2 TRP 2 2HZ TRP 2 -18.746 -3.980 -2.082
15 HZ3 TRP 2 3HZ TRP 2 -18.585 -0.315 0.096
16 HH2 TRP 2 HH TRP 2 -19.811 -1.918 -1.278
17 H LEU 3 H LEU 3 -10.994 -2.552 -2.192
18 HA LEU 3 HA LEU 3 -9.637 -4.729 -0.808
19 1HB LEU 3 2HB LEU 3 -8.784 -3.929 -3.527
20 2HB LEU 3 1HB LEU 3 -9.022 -5.528 -2.850
21 HG LEU 3 HG LEU 3 -11.228 -3.680 -3.768
22 1HD1 LEU 3 1HD1 LEU 3 -9.672 -5.815 -5.102
23 2HD1 LEU 3 2HD1 LEU 3 -10.422 -4.365 -5.772
24 3HD1 LEU 3 3HD1 LEU 3 -11.412 -5.776 -5.394
25 1HD2 LEU 3 1HD2 LEU 3 -12.369 -6.090 -3.623
26 2HD2 LEU 3 2HD2 LEU 3 -12.364 -4.951 -2.275
27 3HD2 LEU 3 3HD2 LEU 3 -11.186 -6.263 -2.327
28 H CYS 4 H CYS 4 -9.278 -1.489 -0.852
29 HA CYS 4 HA CYS 4 -6.747 -0.820 -1.538
30 1HB CYS 4 2HB CYS 4 -8.759 0.350 -0.048
31 2HB CYS 4 1HB CYS 4 -7.398 0.300 1.067
32 H ARG 5 H ARG 5 -7.260 -1.254 1.949
33 HA ARG 5 HA ARG 5 -4.815 -1.613 2.850
34 1HB ARG 5 2HB ARG 5 -5.607 -3.002 4.621
35 2HB ARG 5 1HB ARG 5 -6.909 -1.907 4.185
36 1HG ARG 5 2HG ARG 5 -7.141 -4.333 2.678
37 2HG ARG 5 1HG ARG 5 -6.997 -4.701 4.393
38 1HD ARG 5 2HD ARG 5 -8.960 -3.660 4.921
39 2HD ARG 5 1HD ARG 5 -8.841 -2.517 3.584
40 HE ARG 5 HE ARG 5 -9.243 -4.842 2.306
41 1HH1 ARG 5 1HH1 ARG 5 -10.898 -3.348 4.993
42 2HH1 ARG 5 2HH1 ARG 5 -12.426 -4.066 4.611
43 1HH2 ARG 5 1HH2 ARG 5 -11.253 -5.783 1.802
44 2HH2 ARG 5 2HH2 ARG 5 -12.628 -5.448 2.800
45 H ALA 6 H ALA 6 -6.492 -4.072 0.966
46 HA ALA 6 HA ALA 6 -4.690 -6.181 1.281
47 1HB ALA 6 1HB ALA 6 -6.001 -5.880 -1.352
48 2HB ALA 6 2HB ALA 6 -7.050 -5.945 0.064
49 3HB ALA 6 3HB ALA 6 -5.932 -7.268 -0.265
50 H LEU 7 H LEU 7 -4.733 -3.596 -1.205
51 HA LEU 7 HA LEU 7 -2.398 -4.668 -2.460
52 1HB LEU 7 2HB LEU 7 -2.673 -3.152 -4.121
53 2HB LEU 7 1HB LEU 7 -4.302 -3.206 -3.494
54 HG LEU 7 HG LEU 7 -3.592 -0.937 -4.083
55 1HD1 LEU 7 1HD1 LEU 7 -5.149 -1.535 -2.131
56 2HD1 LEU 7 2HD1 LEU 7 -4.566 0.120 -2.299
57 3HD1 LEU 7 3HD1 LEU 7 -3.826 -0.959 -1.117
58 1HD2 LEU 7 1HD2 LEU 7 -1.149 -1.518 -3.171
59 2HD2 LEU 7 2HD2 LEU 7 -1.798 -0.683 -1.757
60 3HD2 LEU 7 3HD2 LEU 7 -1.760 0.128 -3.322
61 H ILE 8 H ILE 8 -2.903 -2.480 0.174
62 HA ILE 8 HA ILE 8 -0.409 -1.175 -0.070
63 HB ILE 8 HB ILE 8 -0.704 -0.286 2.106
64 1HG1 ILE 8 2HG1 ILE 8 -3.117 -1.666 2.940
65 2HG1 ILE 8 1HG1 ILE 8 -1.768 -2.774 2.769
66 1HG2 ILE 8 1HG2 ILE 8 -2.179 0.659 0.455
67 2HG2 ILE 8 2HG2 ILE 8 -2.999 0.605 2.015
68 3HG2 ILE 8 3HG2 ILE 8 -3.387 -0.586 0.773
69 1HD1 ILE 8 1HD1 ILE 8 -2.229 -1.552 5.027
70 2HD1 ILE 8 2HD1 ILE 8 -1.363 -0.232 4.247
71 3HD1 ILE 8 3HD1 ILE 8 -0.578 -1.796 4.459
72 H LYS 9 H LYS 9 -1.461 -4.198 1.210
73 HA LYS 9 HA LYS 9 1.102 -4.676 2.455
74 1HB LYS 9 2HB LYS 9 -0.166 -7.161 2.256
75 2HB LYS 9 1HB LYS 9 -0.006 -6.147 3.672
76 1HG LYS 9 2HG LYS 9 -2.191 -5.382 1.930
77 2HG LYS 9 1HG LYS 9 -2.342 -7.007 2.582
78 1HD LYS 9 2HD LYS 9 -3.343 -5.055 3.934
79 2HD LYS 9 1HD LYS 9 -2.388 -6.266 4.781
80 1HE LYS 9 2HE LYS 9 -0.783 -4.047 3.792
81 2HE LYS 9 1HE LYS 9 -2.045 -3.536 4.908
82 1HZ LYS 9 1HZ LYS 9 -0.648 -5.878 5.799
83 2HZ LYS 9 2HZ LYS 9 -0.977 -4.437 6.623
84 3HZ LYS 9 3HZ LYS 9 0.374 -4.540 5.613
85 H ARG 10 H ARG 10 -0.496 -5.121 -0.534
86 HA ARG 10 HA ARG 10 1.091 -7.189 -1.568
87 1HB ARG 10 2HB ARG 10 -0.343 -4.884 -2.902
88 2HB ARG 10 1HB ARG 10 0.532 -6.108 -3.812
89 1HG ARG 10 2HG ARG 10 -1.633 -6.837 -1.876
90 2HG ARG 10 1HG ARG 10 -1.984 -6.400 -3.550
91 1HD ARG 10 2HD ARG 10 -1.808 -8.716 -3.628
92 2HD ARG 10 1HD ARG 10 -0.213 -8.172 -4.147
93 HE ARG 10 HE ARG 10 -0.438 -8.680 -1.319
94 1HH1 ARG 10 1HH1 ARG 10 0.287 -10.060 -4.445
95 2HH1 ARG 10 2HH1 ARG 10 1.246 -11.344 -3.791
96 1HH2 ARG 10 1HH2 ARG 10 0.823 -10.368 -0.464
97 2HH2 ARG 10 2HH2 ARG 10 1.549 -11.520 -1.533
98 H ILE 11 H ILE 11 1.563 -3.924 -0.710
99 HA ILE 11 HA ILE 11 4.007 -3.603 -2.259
100 HB ILE 11 HB ILE 11 2.744 -1.852 -0.138
101 1HG1 ILE 11 2HG1 ILE 11 1.480 -1.801 -2.190
102 2HG1 ILE 11 1HG1 ILE 11 2.396 -0.300 -2.073
103 1HG2 ILE 11 1HG2 ILE 11 5.367 -1.904 -0.523
104 2HG2 ILE 11 2HG2 ILE 11 4.494 -0.398 -0.232
105 3HG2 ILE 11 3HG2 ILE 11 4.935 -0.857 -1.876
106 1HD1 ILE 11 1HD1 ILE 11 4.141 -1.567 -3.517
107 2HD1 ILE 11 2HD1 ILE 11 2.700 -0.885 -4.272
108 3HD1 ILE 11 3HD1 ILE 11 2.776 -2.610 -3.915
109 H GLN 12 H GLN 12 2.841 -4.192 0.971
110 HA GLN 12 HA GLN 12 4.943 -4.067 2.625
111 1HB GLN 12 2HB GLN 12 2.587 -5.675 2.400
112 2HB GLN 12 1HB GLN 12 3.888 -6.675 2.984
113 1HG GLN 12 2HG GLN 12 2.250 -4.836 4.347
114 2HG GLN 12 1HG GLN 12 3.469 -5.977 4.961
115 1HE2 GLN 12 1HE2 GLN 12 5.802 -5.103 4.469
116 2HE2 GLN 12 2HE2 GLN 12 6.076 -3.478 4.990
117 H ALA 13 H ALA 13 4.165 -6.902 0.695
118 HA ALA 13 HA ALA 13 6.574 -8.154 1.279
119 1HB ALA 13 1HB ALA 13 4.871 -8.814 -1.104
120 2HB ALA 13 2HB ALA 13 4.412 -9.259 0.540
121 3HB ALA 13 3HB ALA 13 5.897 -9.899 -0.165
122 H MET 14 H MET 14 5.453 -6.234 -1.442
123 HA MET 14 HA MET 14 7.461 -6.593 -3.276
124 1HB MET 14 2HB MET 14 6.676 -4.729 -4.320
125 2HB MET 14 1HB MET 14 5.366 -4.933 -3.171
126 1HG MET 14 2HG MET 14 5.703 -2.840 -2.545
127 2HG MET 14 1HG MET 14 7.229 -3.348 -1.837
128 1HE MET 14 1HE MET 14 7.111 0.069 -3.669
129 2HE MET 14 2HE MET 14 8.594 -0.414 -2.847
130 3HE MET 14 3HE MET 14 7.026 -0.789 -2.130
131 H ILE 15 H ILE 15 7.641 -4.977 -0.205
132 HA ILE 15 HA ILE 15 10.534 -4.849 -0.425
133 HB ILE 15 HB ILE 15 10.581 -2.489 0.434
134 1HG1 ILE 15 2HG1 ILE 15 8.206 -1.485 -0.670
135 2HG1 ILE 15 1HG1 ILE 15 7.714 -2.881 0.285
136 1HG2 ILE 15 1HG2 ILE 15 9.511 -3.020 -2.328
137 2HG2 ILE 15 2HG2 ILE 15 11.199 -2.907 -1.833
138 3HG2 ILE 15 3HG2 ILE 15 10.173 -1.472 -1.810
139 1HD1 ILE 15 1HD1 ILE 15 8.933 -0.318 1.151
140 2HD1 ILE 15 2HD1 ILE 15 9.262 -1.773 2.092
141 3HD1 ILE 15 3HD1 ILE 15 7.599 -1.234 1.852
142 HA PRO 16 HA PRO 16 9.270 -6.150 3.756
143 1HB PRO 16 2HB PRO 16 11.481 -7.628 4.266
144 2HB PRO 16 1HB PRO 16 10.121 -8.233 3.314
145 1HG PRO 16 2HG PRO 16 12.751 -7.157 2.391
146 2HG PRO 16 1HG PRO 16 11.822 -8.532 1.773
147 1HD PRO 16 2HD PRO 16 11.854 -6.073 0.584
148 2HD PRO 16 1HD PRO 16 10.492 -7.203 0.463
149 H LYS 17 H LYS 17 12.692 -5.360 3.054
150 HA LYS 17 HA LYS 17 13.011 -4.169 5.660
151 1HB LYS 17 2HB LYS 17 14.777 -5.466 4.252
152 2HB LYS 17 1HB LYS 17 15.016 -3.921 3.446
153 1HG LYS 17 2HG LYS 17 15.758 -2.885 5.425
154 2HG LYS 17 1HG LYS 17 15.189 -4.221 6.428
155 1HD LYS 17 2HD LYS 17 16.854 -5.693 5.332
156 2HD LYS 17 1HD LYS 17 17.459 -4.296 4.440
157 1HE LYS 17 2HE LYS 17 18.884 -4.065 6.152
158 2HE LYS 17 1HE LYS 17 17.504 -3.385 7.013
159 1HZ LYS 17 1HZ LYS 17 17.135 -5.986 7.446
160 2HZ LYS 17 2HZ LYS 17 18.015 -4.985 8.487
161 3HZ LYS 17 3HZ LYS 17 18.824 -5.946 7.356
162 H GLY 18 H GLY 18 12.317 -3.116 2.449
163 1HA GLY 18 2HA GLY 18 13.069 -0.381 2.814
164 2HA GLY 18 1HA GLY 18 12.073 -1.020 1.515
165 H GLY 19 H GLY 19 10.871 0.997 1.834
166 1HA GLY 19 2HA GLY 19 8.415 0.975 2.618
167 2HA GLY 19 1HA GLY 19 9.145 0.964 4.216
168 H ARG 20 H ARG 20 7.388 2.959 3.346
169 HA ARG 20 HA ARG 20 8.727 5.278 4.097
170 1HB ARG 20 2HB ARG 20 8.915 4.646 1.245
171 2HB ARG 20 1HB ARG 20 8.240 6.239 1.552
172 1HG ARG 20 2HG ARG 20 10.194 7.071 2.296
173 2HG ARG 20 1HG ARG 20 10.663 5.562 3.083
174 1HD ARG 20 2HD ARG 20 11.439 4.630 1.066
175 2HD ARG 20 1HD ARG 20 10.623 5.852 0.094
176 HE ARG 20 HE ARG 20 12.558 7.030 1.808
177 1HH1 ARG 20 1HH1 ARG 20 12.222 5.214 -1.155
178 2HH1 ARG 20 2HH1 ARG 20 13.694 5.819 -1.840
179 1HH2 ARG 20 1HH2 ARG 20 14.495 7.825 0.907
180 2HH2 ARG 20 2HH2 ARG 20 14.983 7.300 -0.669
181 H MET 21 H MET 21 6.527 5.200 1.348
182 HA MET 21 HA MET 21 4.037 5.115 2.346
183 1HB MET 21 2HB MET 21 3.838 6.773 3.864
184 2HB MET 21 1HB MET 21 5.378 7.479 3.399
185 1HG MET 21 2HG MET 21 4.326 8.706 1.611
186 2HG MET 21 1HG MET 21 2.783 7.926 1.942
187 1HE MET 21 1HE MET 21 5.049 10.636 2.340
188 2HE MET 21 2HE MET 21 5.490 10.388 4.030
189 3HE MET 21 3HE MET 21 4.400 11.701 3.585
190 H LEU 22 H LEU 22 2.578 5.479 0.677
191 HA LEU 22 HA LEU 22 2.719 7.434 -1.259
192 1HB LEU 22 2HB LEU 22 4.750 6.753 -2.117
193 2HB LEU 22 1HB LEU 22 4.413 5.058 -1.852
194 HG LEU 22 HG LEU 22 2.744 6.454 -3.869
195 1HD1 LEU 22 1HD1 LEU 22 4.604 7.343 -4.803
196 2HD1 LEU 22 2HD1 LEU 22 4.740 5.717 -5.472
197 3HD1 LEU 22 3HD1 LEU 22 5.681 6.168 -4.051
198 1HD2 LEU 22 1HD2 LEU 22 3.432 4.185 -5.014
199 2HD2 LEU 22 2HD2 LEU 22 2.187 4.238 -3.766
200 3HD2 LEU 22 3HD2 LEU 22 3.825 3.730 -3.356
201 HA PRO 23 HA PRO 23 -0.165 4.055 -2.827
202 1HB PRO 23 2HB PRO 23 0.099 1.554 -1.533
203 2HB PRO 23 1HB PRO 23 0.657 1.995 -3.146
204 1HG PRO 23 2HG PRO 23 2.306 1.368 -0.999
205 2HG PRO 23 1HG PRO 23 2.809 2.266 -2.444
206 1HD PRO 23 2HD PRO 23 1.945 3.307 0.232
207 2HD PRO 23 1HD PRO 23 3.293 3.854 -0.799
208 H GLN 24 H GLN 24 0.294 3.683 0.647
209 HA GLN 24 HA GLN 24 -2.424 2.937 1.143
210 1HB GLN 24 2HB GLN 24 -0.943 4.135 3.389
211 2HB GLN 24 1HB GLN 24 -1.814 2.613 3.298
212 1HG GLN 24 2HG GLN 24 0.133 1.691 2.012
213 2HG GLN 24 1HG GLN 24 0.997 3.178 2.405
214 1HE2 GLN 24 1HE2 GLN 24 2.540 2.273 3.684
215 2HE2 GLN 24 2HE2 GLN 24 2.208 1.529 5.207
216 H LEU 25 H LEU 25 -0.669 5.926 1.009
217 HA LEU 25 HA LEU 25 -2.812 7.437 2.183
218 1HB LEU 25 2HB LEU 25 -0.362 8.377 0.686
219 2HB LEU 25 1HB LEU 25 -1.467 9.421 1.558
220 HG LEU 25 HG LEU 25 0.499 9.097 2.883
221 1HD1 LEU 25 1HD1 LEU 25 -1.460 7.284 4.213
222 2HD1 LEU 25 2HD1 LEU 25 -1.894 8.964 3.889
223 3HD1 LEU 25 3HD1 LEU 25 -0.494 8.592 4.897
224 1HD2 LEU 25 1HD2 LEU 25 0.044 6.163 3.119
225 2HD2 LEU 25 2HD2 LEU 25 1.521 7.098 3.353
226 3HD2 LEU 25 3HD2 LEU 25 0.922 6.790 1.724
227 H VAL 26 H VAL 26 -1.645 6.671 -0.992
228 HA VAL 26 HA VAL 26 -3.594 8.373 -2.305
229 HB VAL 26 HB VAL 26 -1.862 6.201 -3.465
230 1HG1 VAL 26 1HG1 VAL 26 -2.385 7.060 -5.611
231 2HG1 VAL 26 2HG1 VAL 26 -3.172 8.481 -4.922
232 3HG1 VAL 26 3HG1 VAL 26 -3.916 6.892 -4.752
233 1HG2 VAL 26 1HG2 VAL 26 -0.767 8.280 -2.341
234 2HG2 VAL 26 2HG2 VAL 26 -1.298 9.114 -3.802
235 3HG2 VAL 26 3HG2 VAL 26 -0.201 7.739 -3.921
236 H CYS 27 H CYS 27 -3.003 5.079 -1.437
237 HA CYS 27 HA CYS 27 -5.142 3.821 -2.717
238 1HB CYS 27 2HB CYS 27 -3.892 2.170 -1.827
239 2HB CYS 27 1HB CYS 27 -3.247 3.179 -0.553
240 H ARG 28 H ARG 28 -4.801 4.944 0.602
241 HA ARG 28 HA ARG 28 -7.462 4.443 1.207
242 1HB ARG 28 2HB ARG 28 -5.407 6.213 2.510
243 2HB ARG 28 1HB ARG 28 -7.030 6.023 3.165
244 1HG ARG 28 2HG ARG 28 -6.659 3.878 3.842
245 2HG ARG 28 1HG ARG 28 -5.499 3.537 2.567
246 1HD ARG 28 2HD ARG 28 -4.841 3.915 5.157
247 2HD ARG 28 1HD ARG 28 -3.750 4.252 3.815
248 HE ARG 28 HE ARG 28 -3.866 6.465 4.359
249 1HH1 ARG 28 1HH1 ARG 28 -6.641 4.851 5.724
250 2HH1 ARG 28 2HH1 ARG 28 -7.194 6.252 6.578
251 1HH2 ARG 28 1HH2 ARG 28 -4.595 8.313 5.481
252 2HH2 ARG 28 2HH2 ARG 28 -6.034 8.216 6.440
253 H LEU 29 H LEU 29 -5.884 7.044 -0.404
254 HA LEU 29 HA LEU 29 -7.898 9.017 -0.130
255 1HB LEU 29 2HB LEU 29 -5.643 8.524 -2.013
256 2HB LEU 29 1HB LEU 29 -6.890 9.649 -2.516
257 HG LEU 29 HG LEU 29 -5.499 9.932 0.130
258 1HD1 LEU 29 1HD1 LEU 29 -4.306 10.214 -2.454
259 2HD1 LEU 29 2HD1 LEU 29 -3.599 10.499 -0.863
260 3HD1 LEU 29 3HD1 LEU 29 -4.444 11.801 -1.697
261 1HD2 LEU 29 1HD2 LEU 29 -7.184 11.430 0.245
262 2HD2 LEU 29 2HD2 LEU 29 -7.390 11.494 -1.505
263 3HD2 LEU 29 3HD2 LEU 29 -6.097 12.414 -0.734
264 H VAL 30 H VAL 30 -7.559 6.131 -1.959
265 HA VAL 30 HA VAL 30 -9.831 6.702 -3.682
266 HB VAL 30 HB VAL 30 -7.949 4.350 -3.488
267 1HG1 VAL 30 1HG1 VAL 30 -9.954 3.279 -4.010
268 2HG1 VAL 30 2HG1 VAL 30 -9.202 3.560 -5.580
269 3HG1 VAL 30 3HG1 VAL 30 -10.509 4.608 -5.028
270 1HG2 VAL 30 1HG2 VAL 30 -6.902 6.058 -4.682
271 2HG2 VAL 30 2HG2 VAL 30 -8.399 6.549 -5.477
272 3HG2 VAL 30 3HG2 VAL 30 -7.606 5.041 -5.940
273 H LEU 31 H LEU 31 -8.974 4.984 -0.794
274 HA LEU 31 HA LEU 31 -11.046 3.153 -0.555
275 1HB LEU 31 2HB LEU 31 -9.533 2.886 1.138
276 2HB LEU 31 1HB LEU 31 -9.302 4.609 1.347
277 HG LEU 31 HG LEU 31 -11.870 3.343 2.223
278 1HD1 LEU 31 1HD1 LEU 31 -10.698 1.988 3.573
279 2HD1 LEU 31 2HD1 LEU 31 -10.434 3.452 4.520
280 3HD1 LEU 31 3HD1 LEU 31 -9.207 2.909 3.375
281 1HD2 LEU 31 1HD2 LEU 31 -12.236 5.297 3.268
282 2HD2 LEU 31 2HD2 LEU 31 -11.013 5.923 2.162
283 3HD2 LEU 31 3HD2 LEU 31 -10.560 5.443 3.798
284 H ARG 32 H ARG 32 -11.023 6.589 -0.243
285 HA ARG 32 HA ARG 32 -13.388 7.029 1.178
286 1HB ARG 32 2HB ARG 32 -11.762 8.801 0.589
287 2HB ARG 32 1HB ARG 32 -12.248 8.673 -1.096
288 1HG ARG 32 2HG ARG 32 -14.455 9.157 0.770
289 2HG ARG 32 1HG ARG 32 -13.257 10.450 0.690
290 1HD ARG 32 2HD ARG 32 -14.308 11.168 -1.138
291 2HD ARG 32 1HD ARG 32 -13.685 9.738 -1.961
292 HE ARG 32 HE ARG 32 -15.823 8.985 -2.062
293 1HH1 ARG 32 1HH1 ARG 32 -15.577 11.134 0.677
294 2HH1 ARG 32 2HH1 ARG 32 -17.253 10.997 1.092
295 1HH2 ARG 32 1HH2 ARG 32 -18.023 8.798 -1.515
296 2HH2 ARG 32 2HH2 ARG 32 -18.641 9.671 -0.152
297 H CYS 33 H CYS 33 -12.865 5.712 -1.919
298 HA CYS 33 HA CYS 33 -14.982 6.396 -3.452
299 1HB CYS 33 2HB CYS 33 -13.656 4.916 -4.567
300 2HB CYS 33 1HB CYS 33 -13.352 3.949 -3.133
301 H SER 34 H SER 34 -17.124 5.888 -3.642
302 HA SER 34 HA SER 34 -18.585 3.882 -2.517
303 1HB SER 34 2HB SER 34 -18.090 4.399 -0.286
304 2HB SER 34 1HB SER 34 -18.142 6.138 -0.576
305 HG SER 34 HG SER 34 -20.294 6.111 -0.477
Start of MODEL 10
1 1H CYS 1 1HT CYS 1 -14.489 -1.062 -2.892
2 2H CYS 1 2HT CYS 1 -15.203 0.079 -3.957
3 3H CYS 1 3HT CYS 1 -15.740 -0.036 -2.331
4 HA CYS 1 HA CYS 1 -13.083 0.833 -3.253
5 1HB CYS 1 2HB CYS 1 -15.574 2.176 -3.020
6 2HB CYS 1 1HB CYS 1 -14.571 2.739 -1.689
7 H TRP 2 H TRP 2 -12.720 -1.177 -1.686
8 HA TRP 2 HA TRP 2 -11.772 -0.062 0.772
9 1HB TRP 2 2HB TRP 2 -13.114 -1.886 2.115
10 2HB TRP 2 1HB TRP 2 -13.830 -0.318 1.765
11 HD1 TRP 2 HD TRP 2 -13.678 -3.636 -0.263
12 HE1 TRP 2 1HE TRP 2 -16.058 -4.166 -1.081
13 HE3 TRP 2 3HE TRP 2 -16.156 0.339 1.796
14 HZ2 TRP 2 2HZ TRP 2 -18.641 -3.054 -0.882
15 HZ3 TRP 2 3HZ TRP 2 -18.583 0.530 1.431
16 HH2 TRP 2 HH TRP 2 -19.797 -1.133 0.119
17 H LEU 3 H LEU 3 -11.133 -1.931 -1.655
18 HA LEU 3 HA LEU 3 -10.099 -4.270 -0.263
19 1HB LEU 3 2HB LEU 3 -9.736 -3.576 -3.169
20 2HB LEU 3 1HB LEU 3 -9.594 -5.153 -2.416
21 HG LEU 3 HG LEU 3 -12.152 -3.591 -2.781
22 1HD1 LEU 3 1HD1 LEU 3 -10.840 -5.807 -4.272
23 2HD1 LEU 3 2HD1 LEU 3 -11.753 -4.424 -4.875
24 3HD1 LEU 3 3HD1 LEU 3 -12.599 -5.789 -4.146
25 1HD2 LEU 3 1HD2 LEU 3 -13.260 -5.588 -1.920
26 2HD2 LEU 3 2HD2 LEU 3 -12.172 -4.895 -0.716
27 3HD2 LEU 3 3HD2 LEU 3 -11.692 -6.335 -1.615
28 H CYS 4 H CYS 4 -9.080 -1.199 -0.580
29 HA CYS 4 HA CYS 4 -6.489 -1.299 -1.542
30 1HB CYS 4 2HB CYS 4 -8.115 0.576 -0.170
31 2HB CYS 4 1HB CYS 4 -6.566 0.509 0.668
32 H ARG 5 H ARG 5 -7.581 -1.711 1.821
33 HA ARG 5 HA ARG 5 -5.341 -2.039 3.238
34 1HB ARG 5 2HB ARG 5 -6.463 -3.805 4.555
35 2HB ARG 5 1HB ARG 5 -7.527 -2.449 4.205
36 1HG ARG 5 2HG ARG 5 -8.294 -3.897 2.195
37 2HG ARG 5 1HG ARG 5 -7.585 -5.226 3.115
38 1HD ARG 5 2HD ARG 5 -9.144 -5.085 4.785
39 2HD ARG 5 1HD ARG 5 -9.425 -3.365 4.524
40 HE ARG 5 HE ARG 5 -10.418 -4.471 2.278
41 1HH1 ARG 5 1HH1 ARG 5 -10.919 -5.172 5.663
42 2HH1 ARG 5 2HH1 ARG 5 -12.544 -5.724 5.434
43 1HH2 ARG 5 1HH2 ARG 5 -12.549 -5.198 1.976
44 2HH2 ARG 5 2HH2 ARG 5 -13.471 -5.740 3.338
45 H ALA 6 H ALA 6 -6.698 -4.656 1.220
46 HA ALA 6 HA ALA 6 -4.566 -6.465 1.640
47 1HB ALA 6 1HB ALA 6 -6.900 -6.301 -0.162
48 2HB ALA 6 2HB ALA 6 -6.336 -7.630 0.852
49 3HB ALA 6 3HB ALA 6 -5.562 -7.316 -0.701
50 H LEU 7 H LEU 7 -5.108 -3.889 -0.666
51 HA LEU 7 HA LEU 7 -2.955 -4.603 -2.409
52 1HB LEU 7 2HB LEU 7 -4.810 -3.313 -3.257
53 2HB LEU 7 1HB LEU 7 -4.529 -2.053 -2.070
54 HG LEU 7 HG LEU 7 -2.175 -2.512 -3.709
55 1HD1 LEU 7 1HD1 LEU 7 -4.018 -3.139 -5.315
56 2HD1 LEU 7 2HD1 LEU 7 -2.980 -1.806 -5.817
57 3HD1 LEU 7 3HD1 LEU 7 -4.588 -1.477 -5.173
58 1HD2 LEU 7 1HD2 LEU 7 -2.098 -0.504 -2.641
59 2HD2 LEU 7 2HD2 LEU 7 -3.842 -0.263 -2.735
60 3HD2 LEU 7 3HD2 LEU 7 -2.835 0.026 -4.154
61 H ILE 8 H ILE 8 -3.339 -2.445 0.365
62 HA ILE 8 HA ILE 8 -0.843 -1.190 0.037
63 HB ILE 8 HB ILE 8 -1.082 -0.368 2.320
64 1HG1 ILE 8 2HG1 ILE 8 -3.674 -1.855 2.559
65 2HG1 ILE 8 1HG1 ILE 8 -2.170 -2.609 3.068
66 1HG2 ILE 8 1HG2 ILE 8 -2.920 1.030 1.923
67 2HG2 ILE 8 2HG2 ILE 8 -3.803 -0.221 1.051
68 3HG2 ILE 8 3HG2 ILE 8 -2.401 0.547 0.307
69 1HD1 ILE 8 1HD1 ILE 8 -3.096 0.058 4.091
70 2HD1 ILE 8 2HD1 ILE 8 -1.810 -0.967 4.729
71 3HD1 ILE 8 3HD1 ILE 8 -3.493 -1.473 4.872
72 H LYS 9 H LYS 9 -1.806 -4.249 1.243
73 HA LYS 9 HA LYS 9 0.594 -4.719 2.705
74 1HB LYS 9 2HB LYS 9 -0.477 -7.193 1.773
75 2HB LYS 9 1HB LYS 9 -0.364 -6.581 3.405
76 1HG LYS 9 2HG LYS 9 -2.526 -5.486 1.797
77 2HG LYS 9 1HG LYS 9 -2.650 -7.200 2.168
78 1HD LYS 9 2HD LYS 9 -3.756 -5.873 3.894
79 2HD LYS 9 1HD LYS 9 -2.360 -6.740 4.533
80 1HE LYS 9 2HE LYS 9 -1.354 -4.283 3.720
81 2HE LYS 9 1HE LYS 9 -2.898 -3.906 4.477
82 1HZ LYS 9 1HZ LYS 9 -2.171 -4.550 6.493
83 2HZ LYS 9 2HZ LYS 9 -0.651 -4.195 5.843
84 3HZ LYS 9 3HZ LYS 9 -1.197 -5.795 5.887
85 H ARG 10 H ARG 10 -0.680 -5.169 -0.475
86 HA ARG 10 HA ARG 10 1.260 -6.805 -1.548
87 1HB ARG 10 2HB ARG 10 -0.139 -4.502 -2.932
88 2HB ARG 10 1HB ARG 10 0.712 -5.809 -3.737
89 1HG ARG 10 2HG ARG 10 -1.790 -6.060 -2.085
90 2HG ARG 10 1HG ARG 10 -1.668 -6.181 -3.839
91 1HD ARG 10 2HD ARG 10 -1.296 -8.354 -3.632
92 2HD ARG 10 1HD ARG 10 0.198 -7.994 -2.770
93 HE ARG 10 HE ARG 10 -1.887 -7.813 -0.935
94 1HH1 ARG 10 1HH1 ARG 10 -0.363 -10.234 -2.928
95 2HH1 ARG 10 2HH1 ARG 10 -0.711 -11.534 -1.839
96 1HH2 ARG 10 1HH2 ARG 10 -2.359 -9.532 0.502
97 2HH2 ARG 10 2HH2 ARG 10 -1.848 -11.138 0.103
98 H ILE 11 H ILE 11 1.207 -3.552 -0.507
99 HA ILE 11 HA ILE 11 3.556 -2.657 -1.842
100 HB ILE 11 HB ILE 11 1.762 -1.584 0.202
101 1HG1 ILE 11 2HG1 ILE 11 2.054 -0.842 -2.200
102 2HG1 ILE 11 1HG1 ILE 11 2.058 0.441 -0.998
103 1HG2 ILE 11 1HG2 ILE 11 3.656 -1.682 1.652
104 2HG2 ILE 11 2HG2 ILE 11 3.457 -0.003 1.134
105 3HG2 ILE 11 3HG2 ILE 11 4.708 -1.014 0.404
106 1HD1 ILE 11 1HD1 ILE 11 4.627 -0.741 -1.955
107 2HD1 ILE 11 2HD1 ILE 11 4.316 0.851 -1.262
108 3HD1 ILE 11 3HD1 ILE 11 3.788 0.485 -2.904
109 H GLN 12 H GLN 12 2.864 -3.950 1.422
110 HA GLN 12 HA GLN 12 5.570 -3.958 2.311
111 1HB GLN 12 2HB GLN 12 4.217 -6.376 3.154
112 2HB GLN 12 1HB GLN 12 4.784 -5.032 4.128
113 1HG GLN 12 2HG GLN 12 2.332 -4.535 2.648
114 2HG GLN 12 1HG GLN 12 2.246 -5.822 3.844
115 1HE2 GLN 12 1HE2 GLN 12 4.369 -3.045 3.979
116 2HE2 GLN 12 2HE2 GLN 12 3.621 -2.287 5.356
117 H ALA 13 H ALA 13 3.601 -6.136 0.435
118 HA ALA 13 HA ALA 13 5.229 -8.278 0.246
119 1HB ALA 13 1HB ALA 13 3.945 -8.984 -1.521
120 2HB ALA 13 2HB ALA 13 3.953 -7.398 -2.288
121 3HB ALA 13 3HB ALA 13 2.902 -7.702 -0.903
122 H MET 14 H MET 14 5.452 -5.155 -1.175
123 HA MET 14 HA MET 14 7.413 -5.529 -3.128
124 1HB MET 14 2HB MET 14 5.963 -3.415 -2.356
125 2HB MET 14 1HB MET 14 7.448 -3.034 -1.494
126 1HG MET 14 2HG MET 14 7.830 -3.774 -4.292
127 2HG MET 14 1HG MET 14 6.864 -2.324 -4.052
128 1HE MET 14 1HE MET 14 9.196 0.117 -2.264
129 2HE MET 14 2HE MET 14 8.329 -1.065 -1.283
130 3HE MET 14 3HE MET 14 7.544 -0.338 -2.684
131 H ILE 15 H ILE 15 7.738 -4.553 0.331
132 HA ILE 15 HA ILE 15 9.856 -6.158 0.973
133 HB ILE 15 HB ILE 15 11.740 -4.326 0.954
134 1HG1 ILE 15 2HG1 ILE 15 11.779 -2.957 -1.030
135 2HG1 ILE 15 1HG1 ILE 15 10.257 -3.637 -1.588
136 1HG2 ILE 15 1HG2 ILE 15 12.698 -5.922 -0.226
137 2HG2 ILE 15 2HG2 ILE 15 11.848 -5.384 -1.674
138 3HG2 ILE 15 3HG2 ILE 15 11.112 -6.588 -0.616
139 1HD1 ILE 15 1HD1 ILE 15 10.176 -1.330 -0.561
140 2HD1 ILE 15 2HD1 ILE 15 10.488 -2.119 0.987
141 3HD1 ILE 15 3HD1 ILE 15 9.034 -2.515 0.073
142 HA PRO 16 HA PRO 16 9.184 -3.949 4.742
143 1HB PRO 16 2HB PRO 16 10.758 -5.398 6.341
144 2HB PRO 16 1HB PRO 16 9.317 -6.100 5.598
145 1HG PRO 16 2HG PRO 16 12.181 -6.468 4.893
146 2HG PRO 16 1HG PRO 16 10.835 -7.613 4.773
147 1HD PRO 16 2HD PRO 16 11.922 -6.056 2.680
148 2HD PRO 16 1HD PRO 16 10.422 -7.002 2.634
149 H LYS 17 H LYS 17 12.601 -4.681 3.950
150 HA LYS 17 HA LYS 17 13.686 -2.639 5.585
151 1HB LYS 17 2HB LYS 17 14.726 -4.429 3.440
152 2HB LYS 17 1HB LYS 17 15.674 -3.006 3.849
153 1HG LYS 17 2HG LYS 17 15.312 -3.907 6.306
154 2HG LYS 17 1HG LYS 17 15.108 -5.437 5.453
155 1HD LYS 17 2HD LYS 17 17.314 -5.628 5.247
156 2HD LYS 17 1HD LYS 17 17.370 -4.107 4.355
157 1HE LYS 17 2HE LYS 17 18.574 -3.307 6.055
158 2HE LYS 17 1HE LYS 17 17.075 -3.306 6.983
159 1HZ LYS 17 1HZ LYS 17 17.601 -5.386 7.924
160 2HZ LYS 17 2HZ LYS 17 19.018 -4.470 8.031
161 3HZ LYS 17 3HZ LYS 17 18.869 -5.661 6.839
162 H GLY 18 H GLY 18 12.433 -2.728 2.362
163 1HA GLY 18 2HA GLY 18 13.580 -0.258 1.478
164 2HA GLY 18 1HA GLY 18 12.260 -1.130 0.710
165 H GLY 19 H GLY 19 13.001 1.739 2.062
166 1HA GLY 19 2HA GLY 19 10.181 2.255 2.683
167 2HA GLY 19 1HA GLY 19 11.386 2.671 3.888
168 H ARG 20 H ARG 20 9.448 4.089 1.857
169 HA ARG 20 HA ARG 20 10.672 6.555 1.791
170 1HB ARG 20 2HB ARG 20 11.746 4.806 -0.221
171 2HB ARG 20 1HB ARG 20 10.874 6.117 -1.004
172 1HG ARG 20 2HG ARG 20 12.195 7.735 0.316
173 2HG ARG 20 1HG ARG 20 13.120 6.388 0.982
174 1HD ARG 20 2HD ARG 20 12.928 6.428 -1.949
175 2HD ARG 20 1HD ARG 20 13.802 7.788 -1.247
176 HE ARG 20 HE ARG 20 14.667 5.320 -0.133
177 1HH1 ARG 20 1HH1 ARG 20 14.955 7.335 -2.970
178 2HH1 ARG 20 2HH1 ARG 20 16.510 6.713 -3.407
179 1HH2 ARG 20 1HH2 ARG 20 16.716 4.506 -0.706
180 2HH2 ARG 20 2HH2 ARG 20 17.510 5.109 -2.124
181 H MET 21 H MET 21 8.278 6.330 2.418
182 HA MET 21 HA MET 21 6.118 6.955 2.020
183 1HB MET 21 2HB MET 21 6.170 8.832 0.790
184 2HB MET 21 1HB MET 21 7.649 8.314 -0.012
185 1HG MET 21 2HG MET 21 6.270 6.979 -1.592
186 2HG MET 21 1HG MET 21 4.825 7.637 -0.833
187 1HE MET 21 1HE MET 21 8.240 8.684 -2.345
188 2HE MET 21 2HE MET 21 7.994 9.997 -1.194
189 3HE MET 21 3HE MET 21 7.937 10.321 -2.926
190 H LEU 22 H LEU 22 4.199 6.449 0.582
191 HA LEU 22 HA LEU 22 4.622 4.398 -1.364
192 1HB LEU 22 2HB LEU 22 2.721 3.456 0.635
193 2HB LEU 22 1HB LEU 22 3.912 2.611 -0.320
194 HG LEU 22 HG LEU 22 4.900 4.269 1.943
195 1HD1 LEU 22 1HD1 LEU 22 4.583 2.089 3.333
196 2HD1 LEU 22 2HD1 LEU 22 3.239 1.813 2.224
197 3HD1 LEU 22 3HD1 LEU 22 3.279 3.272 3.215
198 1HD2 LEU 22 1HD2 LEU 22 6.023 2.490 0.144
199 2HD2 LEU 22 2HD2 LEU 22 5.895 1.560 1.636
200 3HD2 LEU 22 3HD2 LEU 22 6.767 3.092 1.626
201 HA PRO 23 HA PRO 23 0.605 5.622 -2.705
202 1HB PRO 23 2HB PRO 23 -0.462 3.401 -3.699
203 2HB PRO 23 1HB PRO 23 1.036 4.072 -4.344
204 1HG PRO 23 2HG PRO 23 0.619 1.691 -2.655
205 2HG PRO 23 1HG PRO 23 1.894 2.027 -3.837
206 1HD PRO 23 2HD PRO 23 2.015 2.332 -1.012
207 2HD PRO 23 1HD PRO 23 3.242 2.770 -2.183
208 H GLN 24 H GLN 24 0.529 3.048 -0.378
209 HA GLN 24 HA GLN 24 -2.126 2.615 0.079
210 1HB GLN 24 2HB GLN 24 -1.424 2.471 2.579
211 2HB GLN 24 1HB GLN 24 -0.737 1.339 1.424
212 1HG GLN 24 2HG GLN 24 0.897 2.248 3.032
213 2HG GLN 24 1HG GLN 24 1.312 2.543 1.347
214 1HE2 GLN 24 1HE2 GLN 24 -0.863 4.199 3.608
215 2HE2 GLN 24 2HE2 GLN 24 -0.122 5.752 3.452
216 H LEU 25 H LEU 25 -0.423 5.560 0.455
217 HA LEU 25 HA LEU 25 -2.419 6.647 2.264
218 1HB LEU 25 2HB LEU 25 -1.142 8.871 1.563
219 2HB LEU 25 1HB LEU 25 -0.519 7.775 2.778
220 HG LEU 25 HG LEU 25 0.862 6.712 0.932
221 1HD1 LEU 25 1HD1 LEU 25 0.307 7.313 -1.139
222 2HD1 LEU 25 2HD1 LEU 25 1.182 8.809 -0.810
223 3HD1 LEU 25 3HD1 LEU 25 -0.567 8.741 -0.585
224 1HD2 LEU 25 1HD2 LEU 25 1.274 9.525 1.884
225 2HD2 LEU 25 2HD2 LEU 25 2.476 8.689 0.902
226 3HD2 LEU 25 3HD2 LEU 25 2.015 8.039 2.475
227 H VAL 26 H VAL 26 -1.640 6.902 -1.141
228 HA VAL 26 HA VAL 26 -3.876 8.709 -1.609
229 HB VAL 26 HB VAL 26 -3.236 7.767 -4.100
230 1HG1 VAL 26 1HG1 VAL 26 -3.435 10.142 -3.080
231 2HG1 VAL 26 2HG1 VAL 26 -2.465 9.900 -4.534
232 3HG1 VAL 26 3HG1 VAL 26 -1.678 10.048 -2.964
233 1HG2 VAL 26 1HG2 VAL 26 -1.319 6.503 -3.041
234 2HG2 VAL 26 2HG2 VAL 26 -0.579 8.073 -2.731
235 3HG2 VAL 26 3HG2 VAL 26 -0.903 7.564 -4.386
236 H CYS 27 H CYS 27 -3.032 5.408 -1.669
237 HA CYS 27 HA CYS 27 -5.145 4.335 -3.141
238 1HB CYS 27 2HB CYS 27 -3.790 2.609 -2.906
239 2HB CYS 27 1HB CYS 27 -2.896 3.390 -1.629
240 H ARG 28 H ARG 28 -4.583 4.626 0.317
241 HA ARG 28 HA ARG 28 -7.146 3.643 0.932
242 1HB ARG 28 2HB ARG 28 -5.044 5.069 2.530
243 2HB ARG 28 1HB ARG 28 -6.618 4.724 3.231
244 1HG ARG 28 2HG ARG 28 -6.297 2.376 2.983
245 2HG ARG 28 1HG ARG 28 -4.838 2.604 2.036
246 1HD ARG 28 2HD ARG 28 -5.283 2.983 4.968
247 2HD ARG 28 1HD ARG 28 -4.004 2.096 4.143
248 HE ARG 28 HE ARG 28 -3.356 4.517 3.398
249 1HH1 ARG 28 1HH1 ARG 28 -4.466 3.489 6.554
250 2HH1 ARG 28 2HH1 ARG 28 -3.654 4.770 7.389
251 1HH2 ARG 28 1HH2 ARG 28 -2.284 6.190 4.508
252 2HH2 ARG 28 2HH2 ARG 28 -2.418 6.297 6.232
253 H LEU 29 H LEU 29 -5.932 6.738 0.049
254 HA LEU 29 HA LEU 29 -8.182 8.208 1.100
255 1HB LEU 29 2HB LEU 29 -5.708 8.870 -0.408
256 2HB LEU 29 1HB LEU 29 -7.053 9.989 -0.520
257 HG LEU 29 HG LEU 29 -5.928 9.093 2.125
258 1HD1 LEU 29 1HD1 LEU 29 -4.164 10.164 0.750
259 2HD1 LEU 29 2HD1 LEU 29 -4.596 11.091 2.186
260 3HD1 LEU 29 3HD1 LEU 29 -5.194 11.588 0.603
261 1HD2 LEU 29 1HD2 LEU 29 -7.224 10.730 3.068
262 2HD2 LEU 29 2HD2 LEU 29 -8.260 10.225 1.733
263 3HD2 LEU 29 3HD2 LEU 29 -7.286 11.689 1.590
264 H VAL 30 H VAL 30 -7.233 6.768 -1.917
265 HA VAL 30 HA VAL 30 -9.423 8.028 -3.368
266 HB VAL 30 HB VAL 30 -7.331 6.054 -4.295
267 1HG1 VAL 30 1HG1 VAL 30 -9.202 5.745 -5.710
268 2HG1 VAL 30 2HG1 VAL 30 -8.102 6.809 -6.587
269 3HG1 VAL 30 3HG1 VAL 30 -9.525 7.478 -5.789
270 1HG2 VAL 30 1HG2 VAL 30 -6.947 8.655 -3.661
271 2HG2 VAL 30 2HG2 VAL 30 -7.401 8.795 -5.360
272 3HG2 VAL 30 3HG2 VAL 30 -6.029 7.791 -4.895
273 H LEU 31 H LEU 31 -8.689 5.008 -1.833
274 HA LEU 31 HA LEU 31 -10.919 3.697 -3.138
275 1HB LEU 31 2HB LEU 31 -8.568 2.799 -1.817
276 2HB LEU 31 1HB LEU 31 -9.958 2.112 -0.997
277 HG LEU 31 HG LEU 31 -10.691 1.616 -3.516
278 1HD1 LEU 31 1HD1 LEU 31 -7.795 2.149 -3.622
279 2HD1 LEU 31 2HD1 LEU 31 -9.020 2.242 -4.888
280 3HD1 LEU 31 3HD1 LEU 31 -8.343 0.680 -4.430
281 1HD2 LEU 31 1HD2 LEU 31 -9.993 -0.630 -3.183
282 2HD2 LEU 31 2HD2 LEU 31 -10.388 0.033 -1.595
283 3HD2 LEU 31 3HD2 LEU 31 -8.703 -0.123 -2.093
284 H ARG 32 H ARG 32 -10.281 5.438 -0.245
285 HA ARG 32 HA ARG 32 -12.286 4.427 1.441
286 1HB ARG 32 2HB ARG 32 -12.205 6.554 2.600
287 2HB ARG 32 1HB ARG 32 -10.573 6.088 2.151
288 1HG ARG 32 2HG ARG 32 -10.301 8.040 1.152
289 2HG ARG 32 1HG ARG 32 -11.601 7.641 0.029
290 1HD ARG 32 2HD ARG 32 -11.817 9.078 2.668
291 2HD ARG 32 1HD ARG 32 -12.142 9.721 1.060
292 HE ARG 32 HE ARG 32 -13.784 7.489 1.962
293 1HH1 ARG 32 1HH1 ARG 32 -13.504 10.940 1.469
294 2HH1 ARG 32 2HH1 ARG 32 -15.215 11.198 1.466
295 1HH2 ARG 32 1HH2 ARG 32 -16.031 7.838 1.965
296 2HH2 ARG 32 2HH2 ARG 32 -16.648 9.441 1.748
297 H CYS 33 H CYS 33 -12.417 6.161 -1.477
298 HA CYS 33 HA CYS 33 -14.496 7.740 -1.681
299 1HB CYS 33 2HB CYS 33 -14.405 7.277 -3.894
300 2HB CYS 33 1HB CYS 33 -13.074 6.230 -3.436
301 H SER 34 H SER 34 -16.732 7.712 -1.799
302 HA SER 34 HA SER 34 -18.220 5.276 -1.471
303 1HB SER 34 2HB SER 34 -17.721 5.454 0.827
304 2HB SER 34 1HB SER 34 -17.900 7.209 0.818
305 HG SER 34 HG SER 34 -20.065 5.487 0.242
Start of MODEL 11
1 1H CYS 1 1HT CYS 1 -13.125 -2.265 -3.717
2 2H CYS 1 2HT CYS 1 -14.561 -1.536 -4.310
3 3H CYS 1 3HT CYS 1 -14.469 -2.047 -2.673
4 HA CYS 1 HA CYS 1 -12.668 -0.029 -3.811
5 1HB CYS 1 2HB CYS 1 -15.516 0.133 -3.154
6 2HB CYS 1 1HB CYS 1 -14.548 1.301 -2.265
7 H TRP 2 H TRP 2 -12.525 -2.328 -1.793
8 HA TRP 2 HA TRP 2 -11.483 -0.675 0.390
9 1HB TRP 2 2HB TRP 2 -12.361 -2.676 1.897
10 2HB TRP 2 1HB TRP 2 -13.371 -1.284 1.516
11 HD1 TRP 2 HD TRP 2 -12.738 -4.812 -0.008
12 HE1 TRP 2 1HE TRP 2 -14.999 -5.725 -0.833
13 HE3 TRP 2 3HE TRP 2 -15.697 -0.795 1.115
14 HZ2 TRP 2 2HZ TRP 2 -17.681 -4.859 -0.984
15 HZ3 TRP 2 3HZ TRP 2 -18.099 -0.918 0.597
16 HH2 TRP 2 HH TRP 2 -19.069 -2.909 -0.431
17 H LEU 3 H LEU 3 -10.843 -3.052 -1.834
18 HA LEU 3 HA LEU 3 -9.012 -4.568 -0.153
19 1HB LEU 3 2HB LEU 3 -8.496 -5.660 -2.454
20 2HB LEU 3 1HB LEU 3 -10.005 -6.017 -1.637
21 HG LEU 3 HG LEU 3 -10.046 -3.766 -3.569
22 1HD1 LEU 3 1HD1 LEU 3 -9.284 -6.515 -4.289
23 2HD1 LEU 3 2HD1 LEU 3 -9.016 -4.998 -5.146
24 3HD1 LEU 3 3HD1 LEU 3 -10.581 -5.805 -5.250
25 1HD2 LEU 3 1HD2 LEU 3 -11.968 -6.049 -3.375
26 2HD2 LEU 3 2HD2 LEU 3 -12.262 -4.377 -3.852
27 3HD2 LEU 3 3HD2 LEU 3 -11.971 -4.773 -2.157
28 H CYS 4 H CYS 4 -8.873 -1.658 -1.664
29 HA CYS 4 HA CYS 4 -6.509 -1.631 -3.109
30 1HB CYS 4 2HB CYS 4 -8.005 0.265 -3.114
31 2HB CYS 4 1HB CYS 4 -7.747 0.525 -1.394
32 H ARG 5 H ARG 5 -6.832 -0.524 0.275
33 HA ARG 5 HA ARG 5 -4.212 -0.119 0.853
34 1HB ARG 5 2HB ARG 5 -4.773 -0.118 3.105
35 2HB ARG 5 1HB ARG 5 -6.306 0.216 2.316
36 1HG ARG 5 2HG ARG 5 -5.499 -2.543 3.201
37 2HG ARG 5 1HG ARG 5 -6.356 -1.409 4.240
38 1HD ARG 5 2HD ARG 5 -8.288 -1.529 3.021
39 2HD ARG 5 1HD ARG 5 -7.451 -1.937 1.526
40 HE ARG 5 HE ARG 5 -7.087 -4.181 2.566
41 1HH1 ARG 5 1HH1 ARG 5 -9.801 -2.193 3.529
42 2HH1 ARG 5 2HH1 ARG 5 -10.753 -3.540 4.050
43 1HH2 ARG 5 1HH2 ARG 5 -8.341 -5.941 3.252
44 2HH2 ARG 5 2HH2 ARG 5 -9.926 -5.668 3.894
45 H ALA 6 H ALA 6 -5.866 -3.262 1.185
46 HA ALA 6 HA ALA 6 -3.493 -4.587 2.062
47 1HB ALA 6 1HB ALA 6 -4.934 -6.664 1.534
48 2HB ALA 6 2HB ALA 6 -6.228 -5.496 1.269
49 3HB ALA 6 3HB ALA 6 -5.430 -5.586 2.838
50 H LEU 7 H LEU 7 -4.499 -3.575 -1.012
51 HA LEU 7 HA LEU 7 -3.321 -5.762 -2.472
52 1HB LEU 7 2HB LEU 7 -5.056 -4.827 -3.684
53 2HB LEU 7 1HB LEU 7 -4.681 -3.196 -3.170
54 HG LEU 7 HG LEU 7 -2.646 -4.458 -4.895
55 1HD1 LEU 7 1HD1 LEU 7 -4.619 -5.344 -5.963
56 2HD1 LEU 7 2HD1 LEU 7 -3.944 -4.045 -6.946
57 3HD1 LEU 7 3HD1 LEU 7 -5.375 -3.750 -5.960
58 1HD2 LEU 7 1HD2 LEU 7 -3.649 -1.812 -4.217
59 2HD2 LEU 7 2HD2 LEU 7 -3.429 -2.025 -5.954
60 3HD2 LEU 7 3HD2 LEU 7 -2.081 -2.301 -4.854
61 H ILE 8 H ILE 8 -2.682 -2.282 -2.545
62 HA ILE 8 HA ILE 8 -0.141 -2.541 -3.600
63 HB ILE 8 HB ILE 8 0.227 -0.201 -2.629
64 1HG1 ILE 8 2HG1 ILE 8 -2.027 0.903 -2.050
65 2HG1 ILE 8 1HG1 ILE 8 -2.616 -0.726 -1.776
66 1HG2 ILE 8 1HG2 ILE 8 -2.242 -0.151 -4.266
67 2HG2 ILE 8 2HG2 ILE 8 -0.802 -0.924 -4.939
68 3HG2 ILE 8 3HG2 ILE 8 -0.746 0.766 -4.437
69 1HD1 ILE 8 1HD1 ILE 8 -1.126 0.973 -0.038
70 2HD1 ILE 8 2HD1 ILE 8 -0.221 -0.509 -0.335
71 3HD1 ILE 8 3HD1 ILE 8 -1.865 -0.593 0.292
72 H LYS 9 H LYS 9 -1.268 -2.913 -0.416
73 HA LYS 9 HA LYS 9 1.167 -2.440 0.857
74 1HB LYS 9 2HB LYS 9 -0.576 -2.286 2.300
75 2HB LYS 9 1HB LYS 9 -1.364 -3.691 1.602
76 1HG LYS 9 2HG LYS 9 -0.540 -4.150 3.854
77 2HG LYS 9 1HG LYS 9 0.219 -5.168 2.617
78 1HD LYS 9 2HD LYS 9 1.692 -4.068 4.471
79 2HD LYS 9 1HD LYS 9 2.259 -4.085 2.804
80 1HE LYS 9 2HE LYS 9 1.476 -1.794 2.499
81 2HE LYS 9 1HE LYS 9 0.868 -1.775 4.153
82 1HZ LYS 9 1HZ LYS 9 2.893 -1.361 4.960
83 2HZ LYS 9 2HZ LYS 9 3.335 -0.965 3.377
84 3HZ LYS 9 3HZ LYS 9 3.635 -2.518 3.972
85 H ARG 10 H ARG 10 -0.520 -5.504 0.259
86 HA ARG 10 HA ARG 10 1.513 -7.094 1.216
87 1HB ARG 10 2HB ARG 10 0.620 -8.931 -0.242
88 2HB ARG 10 1HB ARG 10 -0.559 -8.175 0.814
89 1HG ARG 10 2HG ARG 10 -1.642 -8.489 -1.229
90 2HG ARG 10 1HG ARG 10 -1.233 -6.775 -1.176
91 1HD ARG 10 2HD ARG 10 0.902 -8.316 -2.350
92 2HD ARG 10 1HD ARG 10 -0.624 -8.575 -3.200
93 HE ARG 10 HE ARG 10 0.092 -5.832 -2.585
94 1HH1 ARG 10 1HH1 ARG 10 0.065 -8.395 -4.970
95 2HH1 ARG 10 2HH1 ARG 10 0.056 -7.313 -6.321
96 1HH2 ARG 10 1HH2 ARG 10 0.056 -4.410 -4.382
97 2HH2 ARG 10 2HH2 ARG 10 0.055 -5.055 -5.988
98 H ILE 11 H ILE 11 1.345 -5.190 -1.645
99 HA ILE 11 HA ILE 11 3.417 -6.636 -2.962
100 HB ILE 11 HB ILE 11 1.790 -4.437 -3.660
101 1HG1 ILE 11 2HG1 ILE 11 4.043 -5.674 -5.254
102 2HG1 ILE 11 1HG1 ILE 11 2.454 -6.406 -5.068
103 1HG2 ILE 11 1HG2 ILE 11 3.587 -3.017 -2.765
104 2HG2 ILE 11 2HG2 ILE 11 3.325 -2.786 -4.495
105 3HG2 ILE 11 3HG2 ILE 11 4.699 -3.739 -3.927
106 1HD1 ILE 11 1HD1 ILE 11 3.336 -4.398 -6.916
107 2HD1 ILE 11 2HD1 ILE 11 1.969 -3.811 -5.969
108 3HD1 ILE 11 3HD1 ILE 11 1.829 -5.312 -6.884
109 H GLN 12 H GLN 12 3.191 -3.906 -0.729
110 HA GLN 12 HA GLN 12 6.007 -3.379 -0.933
111 1HB GLN 12 2HB GLN 12 5.143 -2.538 1.633
112 2HB GLN 12 1HB GLN 12 5.518 -1.544 0.239
113 1HG GLN 12 2HG GLN 12 2.856 -2.785 0.351
114 2HG GLN 12 1HG GLN 12 3.208 -1.482 1.470
115 1HE2 GLN 12 1HE2 GLN 12 4.655 -1.825 -1.689
116 2HE2 GLN 12 2HE2 GLN 12 3.895 -0.445 -2.402
117 H ALA 13 H ALA 13 3.886 -4.999 1.303
118 HA ALA 13 HA ALA 13 5.609 -5.726 3.216
119 1HB ALA 13 1HB ALA 13 4.151 -7.600 3.729
120 2HB ALA 13 2HB ALA 13 3.425 -7.482 2.126
121 3HB ALA 13 3HB ALA 13 3.199 -6.179 3.295
122 H MET 14 H MET 14 5.377 -6.953 -0.020
123 HA MET 14 HA MET 14 7.068 -9.237 0.517
124 1HB MET 14 2HB MET 14 6.072 -8.104 -2.097
125 2HB MET 14 1HB MET 14 6.906 -9.641 -1.905
126 1HG MET 14 2HG MET 14 4.501 -9.198 -0.249
127 2HG MET 14 1HG MET 14 4.258 -9.427 -1.979
128 1HE MET 14 1HE MET 14 4.813 -12.459 1.184
129 2HE MET 14 2HE MET 14 4.635 -10.709 1.305
130 3HE MET 14 3HE MET 14 6.240 -11.424 1.155
131 H ILE 15 H ILE 15 7.542 -5.915 -0.497
132 HA ILE 15 HA ILE 15 9.865 -5.997 -1.952
133 HB ILE 15 HB ILE 15 10.467 -3.857 -1.193
134 1HG1 ILE 15 2HG1 ILE 15 8.896 -4.466 1.318
135 2HG1 ILE 15 1HG1 ILE 15 10.632 -4.234 1.179
136 1HG2 ILE 15 1HG2 ILE 15 7.850 -3.060 -0.631
137 2HG2 ILE 15 2HG2 ILE 15 7.712 -4.470 -1.682
138 3HG2 ILE 15 3HG2 ILE 15 8.662 -3.075 -2.195
139 1HD1 ILE 15 1HD1 ILE 15 9.945 -1.877 0.293
140 2HD1 ILE 15 2HD1 ILE 15 9.975 -2.216 2.024
141 3HD1 ILE 15 3HD1 ILE 15 8.443 -2.223 1.150
142 HA PRO 16 HA PRO 16 12.980 -7.797 0.605
143 1HB PRO 16 2HB PRO 16 15.204 -6.912 -0.593
144 2HB PRO 16 1HB PRO 16 14.096 -8.023 -1.409
145 1HG PRO 16 2HG PRO 16 14.400 -5.067 -1.736
146 2HG PRO 16 1HG PRO 16 14.129 -6.308 -2.970
147 1HD PRO 16 2HD PRO 16 12.157 -4.691 -1.905
148 2HD PRO 16 1HD PRO 16 11.868 -6.262 -2.678
149 H LYS 17 H LYS 17 13.625 -4.350 -0.108
150 HA LYS 17 HA LYS 17 13.930 -3.759 2.686
151 1HB LYS 17 2HB LYS 17 16.302 -4.066 0.909
152 2HB LYS 17 1HB LYS 17 16.318 -2.755 2.080
153 1HG LYS 17 2HG LYS 17 15.774 -4.500 3.833
154 2HG LYS 17 1HG LYS 17 16.139 -5.707 2.600
155 1HD LYS 17 2HD LYS 17 18.362 -5.318 2.694
156 2HD LYS 17 1HD LYS 17 18.153 -3.583 2.941
157 1HE LYS 17 2HE LYS 17 18.757 -3.961 5.058
158 2HE LYS 17 1HE LYS 17 17.159 -4.672 5.266
159 1HZ LYS 17 1HZ LYS 17 19.173 -6.445 4.171
160 2HZ LYS 17 2HZ LYS 17 17.997 -6.739 5.350
161 3HZ LYS 17 3HZ LYS 17 19.438 -5.960 5.770
162 H GLY 18 H GLY 18 12.081 -2.687 1.126
163 1HA GLY 18 2HA GLY 18 13.113 -0.130 0.109
164 2HA GLY 18 1HA GLY 18 11.516 -0.793 -0.204
165 H GLY 19 H GLY 19 12.286 1.877 0.777
166 1HA GLY 19 2HA GLY 19 10.304 2.112 2.814
167 2HA GLY 19 1HA GLY 19 11.917 2.254 3.491
168 H ARG 20 H ARG 20 9.456 4.078 2.750
169 HA ARG 20 HA ARG 20 10.708 6.510 2.769
170 1HB ARG 20 2HB ARG 20 11.002 5.295 0.205
171 2HB ARG 20 1HB ARG 20 9.921 6.671 0.033
172 1HG ARG 20 2HG ARG 20 11.583 8.124 0.243
173 2HG ARG 20 1HG ARG 20 12.219 7.309 1.672
174 1HD ARG 20 2HD ARG 20 12.912 5.560 -0.284
175 2HD ARG 20 1HD ARG 20 13.019 7.094 -1.146
176 HE ARG 20 HE ARG 20 14.334 7.086 1.415
177 1HH1 ARG 20 1HH1 ARG 20 14.676 6.427 -1.995
178 2HH1 ARG 20 2HH1 ARG 20 16.399 6.601 -1.982
179 1HH2 ARG 20 1HH2 ARG 20 16.596 7.314 1.436
180 2HH2 ARG 20 2HH2 ARG 20 17.491 7.104 -0.031
181 H MET 21 H MET 21 8.294 5.692 0.305
182 HA MET 21 HA MET 21 6.215 6.841 2.038
183 1HB MET 21 2HB MET 21 6.386 8.613 0.572
184 2HB MET 21 1HB MET 21 6.940 7.603 -0.757
185 1HG MET 21 2HG MET 21 4.664 6.737 -1.051
186 2HG MET 21 1HG MET 21 4.110 7.741 0.285
187 1HE MET 21 1HE MET 21 5.613 10.736 -0.406
188 2HE MET 21 2HE MET 21 4.162 10.140 0.401
189 3HE MET 21 3HE MET 21 4.020 11.247 -0.965
190 H LEU 22 H LEU 22 3.986 6.237 1.245
191 HA LEU 22 HA LEU 22 4.010 3.628 -0.057
192 1HB LEU 22 2HB LEU 22 2.848 4.456 2.550
193 2HB LEU 22 1HB LEU 22 2.024 3.257 1.580
194 HG LEU 22 HG LEU 22 4.811 3.052 2.727
195 1HD1 LEU 22 1HD1 LEU 22 2.895 2.720 4.282
196 2HD1 LEU 22 2HD1 LEU 22 3.934 1.306 4.095
197 3HD1 LEU 22 3HD1 LEU 22 2.376 1.370 3.272
198 1HD2 LEU 22 1HD2 LEU 22 4.759 2.000 0.531
199 2HD2 LEU 22 2HD2 LEU 22 3.320 1.093 0.994
200 3HD2 LEU 22 3HD2 LEU 22 4.853 0.785 1.806
201 HA PRO 23 HA PRO 23 0.297 4.857 -2.131
202 1HB PRO 23 2HB PRO 23 -0.935 2.316 -1.980
203 2HB PRO 23 1HB PRO 23 0.123 2.887 -3.252
204 1HG PRO 23 2HG PRO 23 0.695 0.844 -1.478
205 2HG PRO 23 1HG PRO 23 1.871 1.695 -2.484
206 1HD PRO 23 2HD PRO 23 1.205 2.073 0.389
207 2HD PRO 23 1HD PRO 23 2.744 2.237 -0.438
208 H GLN 24 H GLN 24 -0.014 3.202 0.914
209 HA GLN 24 HA GLN 24 -2.704 3.192 1.395
210 1HB GLN 24 2HB GLN 24 -1.979 3.672 3.838
211 2HB GLN 24 1HB GLN 24 -1.416 2.205 3.058
212 1HG GLN 24 2HG GLN 24 0.711 2.806 3.250
213 2HG GLN 24 1HG GLN 24 0.392 4.430 2.641
214 1HE2 GLN 24 1HE2 GLN 24 0.988 2.498 5.380
215 2HE2 GLN 24 2HE2 GLN 24 0.876 3.741 6.575
216 H LEU 25 H LEU 25 -0.719 5.941 0.968
217 HA LEU 25 HA LEU 25 -2.559 7.642 2.409
218 1HB LEU 25 2HB LEU 25 -1.158 9.429 0.947
219 2HB LEU 25 1HB LEU 25 -0.631 8.800 2.496
220 HG LEU 25 HG LEU 25 0.177 7.283 0.072
221 1HD1 LEU 25 1HD1 LEU 25 1.852 8.729 -0.603
222 2HD1 LEU 25 2HD1 LEU 25 1.755 9.692 0.872
223 3HD1 LEU 25 3HD1 LEU 25 0.479 9.805 -0.342
224 1HD2 LEU 25 1HD2 LEU 25 1.143 6.268 1.838
225 2HD2 LEU 25 2HD2 LEU 25 1.068 7.714 2.845
226 3HD2 LEU 25 3HD2 LEU 25 2.350 7.539 1.647
227 H VAL 26 H VAL 26 -1.712 7.318 -0.983
228 HA VAL 26 HA VAL 26 -3.998 8.835 -1.858
229 HB VAL 26 HB VAL 26 -2.752 6.967 -3.768
230 1HG1 VAL 26 1HG1 VAL 26 -3.826 9.718 -3.716
231 2HG1 VAL 26 2HG1 VAL 26 -4.037 8.436 -4.909
232 3HG1 VAL 26 3HG1 VAL 26 -2.554 9.388 -4.892
233 1HG2 VAL 26 1HG2 VAL 26 -1.145 9.073 -2.358
234 2HG2 VAL 26 2HG2 VAL 26 -0.774 8.594 -4.013
235 3HG2 VAL 26 3HG2 VAL 26 -0.709 7.401 -2.715
236 H CYS 27 H CYS 27 -3.221 5.568 -1.180
237 HA CYS 27 HA CYS 27 -5.288 4.270 -2.583
238 1HB CYS 27 2HB CYS 27 -3.396 3.016 -1.900
239 2HB CYS 27 1HB CYS 27 -3.593 3.464 -0.235
240 H ARG 28 H ARG 28 -4.809 5.358 0.737
241 HA ARG 28 HA ARG 28 -7.337 4.365 1.455
242 1HB ARG 28 2HB ARG 28 -5.245 5.899 2.844
243 2HB ARG 28 1HB ARG 28 -6.877 6.173 3.428
244 1HG ARG 28 2HG ARG 28 -6.423 4.397 4.721
245 2HG ARG 28 1HG ARG 28 -6.891 3.489 3.289
246 1HD ARG 28 2HD ARG 28 -4.888 2.512 3.933
247 2HD ARG 28 1HD ARG 28 -4.403 3.634 2.666
248 HE ARG 28 HE ARG 28 -3.367 4.972 4.262
249 1HH1 ARG 28 1HH1 ARG 28 -5.053 2.315 5.788
250 2HH1 ARG 28 2HH1 ARG 28 -4.268 2.533 7.314
251 1HH2 ARG 28 1HH2 ARG 28 -2.339 5.252 6.275
252 2HH2 ARG 28 2HH2 ARG 28 -2.731 4.198 7.592
253 H LEU 29 H LEU 29 -6.205 7.218 -0.054
254 HA LEU 29 HA LEU 29 -8.359 8.961 0.539
255 1HB LEU 29 2HB LEU 29 -6.335 8.788 -1.665
256 2HB LEU 29 1HB LEU 29 -7.685 9.895 -1.822
257 HG LEU 29 HG LEU 29 -5.551 9.933 0.309
258 1HD1 LEU 29 1HD1 LEU 29 -4.635 10.940 -1.560
259 2HD1 LEU 29 2HD1 LEU 29 -5.347 12.307 -0.702
260 3HD1 LEU 29 3HD1 LEU 29 -6.182 11.603 -2.087
261 1HD2 LEU 29 1HD2 LEU 29 -7.265 10.700 1.580
262 2HD2 LEU 29 2HD2 LEU 29 -8.226 11.193 0.186
263 3HD2 LEU 29 3HD2 LEU 29 -6.887 12.201 0.735
264 H VAL 30 H VAL 30 -7.811 6.375 -1.696
265 HA VAL 30 HA VAL 30 -10.321 6.752 -3.091
266 HB VAL 30 HB VAL 30 -8.148 4.671 -3.305
267 1HG1 VAL 30 1HG1 VAL 30 -10.069 3.392 -3.738
268 2HG1 VAL 30 2HG1 VAL 30 -9.483 3.877 -5.329
269 3HG1 VAL 30 3HG1 VAL 30 -10.856 4.711 -4.603
270 1HG2 VAL 30 1HG2 VAL 30 -7.445 6.570 -4.428
271 2HG2 VAL 30 2HG2 VAL 30 -9.073 6.980 -4.968
272 3HG2 VAL 30 3HG2 VAL 30 -8.210 5.632 -5.710
273 H LEU 31 H LEU 31 -9.063 4.979 -0.407
274 HA LEU 31 HA LEU 31 -10.814 2.838 -0.223
275 1HB LEU 31 2HB LEU 31 -9.226 2.670 1.401
276 2HB LEU 31 1HB LEU 31 -9.185 4.396 1.680
277 HG LEU 31 HG LEU 31 -11.587 2.905 2.611
278 1HD1 LEU 31 1HD1 LEU 31 -10.339 1.452 3.765
279 2HD1 LEU 31 2HD1 LEU 31 -9.963 2.825 4.806
280 3HD1 LEU 31 3HD1 LEU 31 -8.857 2.372 3.508
281 1HD2 LEU 31 1HD2 LEU 31 -11.917 4.729 3.876
282 2HD2 LEU 31 2HD2 LEU 31 -10.766 5.495 2.781
283 3HD2 LEU 31 3HD2 LEU 31 -10.215 4.848 4.325
284 H ARG 32 H ARG 32 -11.201 6.167 0.757
285 HA ARG 32 HA ARG 32 -13.651 6.001 2.075
286 1HB ARG 32 2HB ARG 32 -12.025 8.015 1.719
287 2HB ARG 32 1HB ARG 32 -13.000 8.323 0.289
288 1HG ARG 32 2HG ARG 32 -14.556 7.898 2.730
289 2HG ARG 32 1HG ARG 32 -13.500 9.311 2.771
290 1HD ARG 32 2HD ARG 32 -15.078 10.398 1.639
291 2HD ARG 32 1HD ARG 32 -14.668 9.390 0.251
292 HE ARG 32 HE ARG 32 -16.641 8.277 0.533
293 1HH1 ARG 32 1HH1 ARG 32 -15.910 10.015 3.469
294 2HH1 ARG 32 2HH1 ARG 32 -17.416 9.620 4.226
295 1HH2 ARG 32 1HH2 ARG 32 -18.621 7.750 1.529
296 2HH2 ARG 32 2HH2 ARG 32 -18.956 8.333 3.126
297 H CYS 33 H CYS 33 -12.835 5.995 -1.280
298 HA CYS 33 HA CYS 33 -14.344 6.381 -3.122
299 1HB CYS 33 2HB CYS 33 -13.347 4.326 -3.459
300 2HB CYS 33 1HB CYS 33 -14.089 3.607 -2.039
301 H SER 34 H SER 34 -16.176 3.963 -1.278
302 HA SER 34 HA SER 34 -18.671 4.624 -2.172
303 1HB SER 34 2HB SER 34 -17.850 2.726 -0.545
304 2HB SER 34 1HB SER 34 -18.388 3.848 0.704
305 HG SER 34 HG SER 34 -20.428 3.900 -0.463
Start of MODEL 12
1 1H CYS 1 1HT CYS 1 -13.453 -0.682 -5.514
2 2H CYS 1 2HT CYS 1 -13.419 -1.539 -4.028
3 3H CYS 1 3HT CYS 1 -11.957 -0.996 -4.739
4 HA CYS 1 HA CYS 1 -12.483 1.229 -4.357
5 1HB CYS 1 2HB CYS 1 -15.142 0.184 -3.348
6 2HB CYS 1 1HB CYS 1 -14.633 1.864 -3.320
7 H TRP 2 H TRP 2 -11.682 -1.400 -2.818
8 HA TRP 2 HA TRP 2 -10.988 -0.026 -0.404
9 1HB TRP 2 2HB TRP 2 -12.120 -2.071 0.916
10 2HB TRP 2 1HB TRP 2 -12.933 -0.533 0.646
11 HD1 TRP 2 HD TRP 2 -12.623 -3.812 -1.447
12 HE1 TRP 2 1HE TRP 2 -14.976 -4.392 -2.321
13 HE3 TRP 2 3HE TRP 2 -15.215 0.093 0.575
14 HZ2 TRP 2 2HZ TRP 2 -17.589 -3.324 -2.170
15 HZ3 TRP 2 3HZ TRP 2 -17.633 0.246 0.167
16 HH2 TRP 2 HH TRP 2 -18.796 -1.426 -1.179
17 H LEU 3 H LEU 3 -9.505 -1.301 -2.439
18 HA LEU 3 HA LEU 3 -8.564 -3.798 -1.278
19 1HB LEU 3 2HB LEU 3 -6.812 -3.111 -3.343
20 2HB LEU 3 1HB LEU 3 -8.101 -4.294 -3.392
21 HG LEU 3 HG LEU 3 -8.716 -1.429 -4.003
22 1HD1 LEU 3 1HD1 LEU 3 -6.667 -2.482 -5.309
23 2HD1 LEU 3 2HD1 LEU 3 -7.871 -1.474 -6.111
24 3HD1 LEU 3 3HD1 LEU 3 -7.969 -3.231 -6.233
25 1HD2 LEU 3 1HD2 LEU 3 -9.906 -4.110 -4.503
26 2HD2 LEU 3 2HD2 LEU 3 -10.198 -2.830 -5.680
27 3HD2 LEU 3 3HD2 LEU 3 -10.682 -2.610 -3.998
28 H CYS 4 H CYS 4 -8.109 -0.679 -0.555
29 HA CYS 4 HA CYS 4 -5.567 0.108 -0.468
30 1HB CYS 4 2HB CYS 4 -7.842 0.349 1.337
31 2HB CYS 4 1HB CYS 4 -6.299 0.518 2.161
32 H ARG 5 H ARG 5 -6.618 -1.315 2.549
33 HA ARG 5 HA ARG 5 -4.391 -1.969 3.762
34 1HB ARG 5 2HB ARG 5 -5.523 -4.297 4.336
35 2HB ARG 5 1HB ARG 5 -6.158 -2.777 4.948
36 1HG ARG 5 2HG ARG 5 -8.112 -3.457 4.148
37 2HG ARG 5 1HG ARG 5 -7.479 -3.043 2.561
38 1HD ARG 5 2HD ARG 5 -6.537 -5.455 2.566
39 2HD ARG 5 1HD ARG 5 -7.703 -5.733 3.864
40 HE ARG 5 HE ARG 5 -9.083 -4.483 1.823
41 1HH1 ARG 5 1HH1 ARG 5 -7.414 -7.529 2.262
42 2HH1 ARG 5 2HH1 ARG 5 -8.358 -8.344 1.060
43 1HH2 ARG 5 1HH2 ARG 5 -10.294 -5.546 0.259
44 2HH2 ARG 5 2HH2 ARG 5 -9.992 -7.216 -0.081
45 H ALA 6 H ALA 6 -5.687 -4.257 1.331
46 HA ALA 6 HA ALA 6 -3.294 -5.842 1.403
47 1HB ALA 6 1HB ALA 6 -4.500 -6.789 -0.771
48 2HB ALA 6 2HB ALA 6 -5.871 -5.957 -0.040
49 3HB ALA 6 3HB ALA 6 -5.018 -7.209 0.862
50 H LEU 7 H LEU 7 -3.810 -2.907 0.059
51 HA LEU 7 HA LEU 7 -2.608 -3.299 -2.498
52 1HB LEU 7 2HB LEU 7 -3.301 -1.207 -2.953
53 2HB LEU 7 1HB LEU 7 -4.221 -1.352 -1.476
54 HG LEU 7 HG LEU 7 -1.463 -0.244 -1.311
55 1HD1 LEU 7 1HD1 LEU 7 -2.307 0.929 -3.217
56 2HD1 LEU 7 2HD1 LEU 7 -2.283 2.001 -1.820
57 3HD1 LEU 7 3HD1 LEU 7 -3.808 1.312 -2.371
58 1HD2 LEU 7 1HD2 LEU 7 -3.978 0.637 0.073
59 2HD2 LEU 7 2HD2 LEU 7 -2.310 0.967 0.532
60 3HD2 LEU 7 3HD2 LEU 7 -2.953 -0.666 0.676
61 H ILE 8 H ILE 8 -1.595 -1.589 0.460
62 HA ILE 8 HA ILE 8 1.086 -1.521 -0.599
63 HB ILE 8 HB ILE 8 1.760 -0.222 1.300
64 1HG1 ILE 8 2HG1 ILE 8 -1.030 -0.259 2.414
65 2HG1 ILE 8 1HG1 ILE 8 0.124 -1.515 2.864
66 1HG2 ILE 8 1HG2 ILE 8 0.028 0.601 -0.655
67 2HG2 ILE 8 2HG2 ILE 8 0.921 1.648 0.442
68 3HG2 ILE 8 3HG2 ILE 8 -0.738 1.206 0.816
69 1HD1 ILE 8 1HD1 ILE 8 0.981 -0.172 4.391
70 2HD1 ILE 8 2HD1 ILE 8 -0.145 1.103 3.920
71 3HD1 ILE 8 3HD1 ILE 8 1.426 0.977 3.129
72 H LYS 9 H LYS 9 -0.683 -3.612 1.446
73 HA LYS 9 HA LYS 9 1.699 -4.553 2.775
74 1HB LYS 9 2HB LYS 9 -0.809 -4.636 3.536
75 2HB LYS 9 1HB LYS 9 -0.753 -6.192 2.722
76 1HG LYS 9 2HG LYS 9 0.022 -6.995 4.648
77 2HG LYS 9 1HG LYS 9 1.545 -6.224 4.195
78 1HD LYS 9 2HD LYS 9 -0.606 -5.128 5.993
79 2HD LYS 9 1HD LYS 9 1.055 -5.554 6.416
80 1HE LYS 9 2HE LYS 9 0.770 -3.530 4.276
81 2HE LYS 9 1HE LYS 9 0.224 -3.022 5.872
82 1HZ LYS 9 1HZ LYS 9 2.804 -4.372 5.749
83 2HZ LYS 9 2HZ LYS 9 2.311 -3.063 6.695
84 3HZ LYS 9 3HZ LYS 9 2.743 -2.822 5.077
85 H ARG 10 H ARG 10 -0.483 -5.749 0.301
86 HA ARG 10 HA ARG 10 1.038 -8.085 -0.193
87 1HB ARG 10 2HB ARG 10 -0.767 -6.666 -2.162
88 2HB ARG 10 1HB ARG 10 -0.320 -8.368 -2.167
89 1HG ARG 10 2HG ARG 10 -1.835 -7.113 0.093
90 2HG ARG 10 1HG ARG 10 -2.635 -7.779 -1.334
91 1HD ARG 10 2HD ARG 10 -2.061 -9.153 0.918
92 2HD ARG 10 1HD ARG 10 -2.316 -9.879 -0.667
93 HE ARG 10 HE ARG 10 0.238 -9.494 0.701
94 1HH1 ARG 10 1HH1 ARG 10 -1.492 -10.701 -2.091
95 2HH1 ARG 10 2HH1 ARG 10 -0.128 -11.582 -2.691
96 1HH2 ARG 10 1HH2 ARG 10 2.016 -10.629 -0.113
97 2HH2 ARG 10 2HH2 ARG 10 1.855 -11.540 -1.577
98 H ILE 11 H ILE 11 1.154 -4.797 -1.156
99 HA ILE 11 HA ILE 11 3.017 -5.196 -3.293
100 HB ILE 11 HB ILE 11 1.566 -2.962 -2.175
101 1HG1 ILE 11 2HG1 ILE 11 2.917 -2.514 -4.717
102 2HG1 ILE 11 1HG1 ILE 11 2.123 -4.084 -4.667
103 1HG2 ILE 11 1HG2 ILE 11 4.469 -2.484 -2.820
104 2HG2 ILE 11 2HG2 ILE 11 3.690 -2.284 -1.252
105 3HG2 ILE 11 3HG2 ILE 11 3.257 -1.217 -2.591
106 1HD1 ILE 11 1HD1 ILE 11 0.031 -3.174 -4.522
107 2HD1 ILE 11 2HD1 ILE 11 0.854 -1.958 -5.500
108 3HD1 ILE 11 3HD1 ILE 11 0.614 -1.688 -3.774
109 H GLN 12 H GLN 12 3.148 -4.334 0.177
110 HA GLN 12 HA GLN 12 5.990 -3.838 0.016
111 1HB GLN 12 2HB GLN 12 5.936 -3.329 2.305
112 2HB GLN 12 1HB GLN 12 4.401 -2.745 1.684
113 1HG GLN 12 2HG GLN 12 3.376 -3.905 3.251
114 2HG GLN 12 1HG GLN 12 3.963 -5.391 2.514
115 1HE2 GLN 12 1HE2 GLN 12 6.628 -5.276 3.012
116 2HE2 GLN 12 2HE2 GLN 12 6.916 -5.327 4.719
117 H ALA 13 H ALA 13 4.053 -6.569 0.144
118 HA ALA 13 HA ALA 13 6.018 -8.175 1.529
119 1HB ALA 13 1HB ALA 13 3.447 -9.041 0.213
120 2HB ALA 13 2HB ALA 13 3.606 -8.578 1.906
121 3HB ALA 13 3HB ALA 13 4.445 -10.008 1.301
122 H MET 14 H MET 14 4.995 -7.358 -1.651
123 HA MET 14 HA MET 14 6.218 -9.532 -3.022
124 1HB MET 14 2HB MET 14 5.266 -6.803 -3.868
125 2HB MET 14 1HB MET 14 6.080 -7.875 -4.995
126 1HG MET 14 2HG MET 14 3.807 -9.007 -3.482
127 2HG MET 14 1HG MET 14 3.435 -7.794 -4.706
128 1HE MET 14 1HE MET 14 3.922 -12.094 -5.231
129 2HE MET 14 2HE MET 14 3.852 -11.129 -3.759
130 3HE MET 14 3HE MET 14 5.415 -11.520 -4.477
131 H ILE 15 H ILE 15 7.324 -6.401 -1.858
132 HA ILE 15 HA ILE 15 9.760 -6.406 -3.359
133 HB ILE 15 HB ILE 15 10.376 -4.474 -2.169
134 1HG1 ILE 15 2HG1 ILE 15 8.408 -5.316 -0.038
135 2HG1 ILE 15 1HG1 ILE 15 10.160 -5.272 0.110
136 1HG2 ILE 15 1HG2 ILE 15 8.719 -3.136 -2.858
137 2HG2 ILE 15 2HG2 ILE 15 7.515 -3.942 -1.853
138 3HG2 ILE 15 3HG2 ILE 15 7.966 -4.632 -3.413
139 1HD1 ILE 15 1HD1 ILE 15 9.651 -3.327 1.158
140 2HD1 ILE 15 2HD1 ILE 15 8.187 -3.065 0.213
141 3HD1 ILE 15 3HD1 ILE 15 9.765 -2.721 -0.493
142 HA PRO 16 HA PRO 16 12.355 -8.909 -0.837
143 1HB PRO 16 2HB PRO 16 14.722 -7.569 -0.845
144 2HB PRO 16 1HB PRO 16 14.101 -8.454 -2.239
145 1HG PRO 16 2HG PRO 16 14.118 -5.529 -1.703
146 2HG PRO 16 1HG PRO 16 14.303 -6.396 -3.237
147 1HD PRO 16 2HD PRO 16 11.994 -5.157 -2.396
148 2HD PRO 16 1HD PRO 16 12.052 -6.460 -3.595
149 H LYS 17 H LYS 17 13.099 -5.509 -0.008
150 HA LYS 17 HA LYS 17 12.243 -5.857 2.691
151 1HB LYS 17 2HB LYS 17 14.916 -6.580 2.104
152 2HB LYS 17 1HB LYS 17 14.977 -5.062 2.989
153 1HG LYS 17 2HG LYS 17 13.689 -6.014 4.794
154 2HG LYS 17 1HG LYS 17 13.499 -7.522 3.896
155 1HD LYS 17 2HD LYS 17 15.317 -8.209 4.999
156 2HD LYS 17 1HD LYS 17 16.218 -7.166 3.897
157 1HE LYS 17 2HE LYS 17 16.367 -5.440 5.463
158 2HE LYS 17 1HE LYS 17 15.052 -6.093 6.441
159 1HZ LYS 17 1HZ LYS 17 16.412 -7.627 7.413
160 2HZ LYS 17 2HZ LYS 17 17.527 -6.379 7.167
161 3HZ LYS 17 3HZ LYS 17 17.485 -7.695 6.106
162 H GLY 18 H GLY 18 11.584 -4.055 0.638
163 1HA GLY 18 2HA GLY 18 12.950 -1.559 1.115
164 2HA GLY 18 1HA GLY 18 11.531 -1.798 0.106
165 H GLY 19 H GLY 19 10.082 -0.355 0.813
166 1HA GLY 19 2HA GLY 19 8.383 -0.569 2.809
167 2HA GLY 19 1HA GLY 19 9.763 0.072 3.690
168 H ARG 20 H ARG 20 9.111 2.082 4.214
169 HA ARG 20 HA ARG 20 8.571 4.281 3.990
170 1HB ARG 20 2HB ARG 20 9.767 3.621 1.334
171 2HB ARG 20 1HB ARG 20 8.949 5.166 1.522
172 1HG ARG 20 2HG ARG 20 10.673 6.041 2.607
173 2HG ARG 20 1HG ARG 20 10.751 4.675 3.723
174 1HD ARG 20 2HD ARG 20 12.604 3.977 2.721
175 2HD ARG 20 1HD ARG 20 11.710 3.778 1.215
176 HE ARG 20 HE ARG 20 12.318 6.454 1.354
177 1HH1 ARG 20 1HH1 ARG 20 14.127 3.469 1.353
178 2HH1 ARG 20 2HH1 ARG 20 15.519 4.168 0.597
179 1HH2 ARG 20 1HH2 ARG 20 14.158 7.374 0.357
180 2HH2 ARG 20 2HH2 ARG 20 15.539 6.379 0.034
181 H MET 21 H MET 21 6.477 4.771 4.206
182 HA MET 21 HA MET 21 4.399 3.643 2.683
183 1HB MET 21 2HB MET 21 3.007 4.780 4.071
184 2HB MET 21 1HB MET 21 4.479 5.055 4.991
185 1HG MET 21 2HG MET 21 4.668 7.182 3.477
186 2HG MET 21 1HG MET 21 2.932 6.932 3.272
187 1HE MET 21 1HE MET 21 5.384 8.665 4.613
188 2HE MET 21 2HE MET 21 5.372 8.704 6.377
189 3HE MET 21 3HE MET 21 4.317 9.782 5.461
190 H LEU 22 H LEU 22 2.762 5.382 1.593
191 HA LEU 22 HA LEU 22 3.576 7.596 0.232
192 1HB LEU 22 2HB LEU 22 5.400 6.569 -0.807
193 2HB LEU 22 1HB LEU 22 4.533 5.067 -1.055
194 HG LEU 22 HG LEU 22 3.502 7.415 -2.531
195 1HD1 LEU 22 1HD1 LEU 22 6.073 7.497 -2.569
196 2HD1 LEU 22 2HD1 LEU 22 5.202 7.552 -4.102
197 3HD1 LEU 22 3HD1 LEU 22 5.954 6.048 -3.567
198 1HD2 LEU 22 1HD2 LEU 22 2.384 5.562 -3.211
199 2HD2 LEU 22 2HD2 LEU 22 3.720 4.483 -2.817
200 3HD2 LEU 22 3HD2 LEU 22 3.758 5.424 -4.308
201 HA PRO 23 HA PRO 23 -0.021 5.555 -2.139
202 1HB PRO 23 2HB PRO 23 -0.391 2.832 -1.359
203 2HB PRO 23 1HB PRO 23 0.175 3.449 -2.909
204 1HG PRO 23 2HG PRO 23 1.753 2.023 -1.178
205 2HG PRO 23 1HG PRO 23 2.386 3.201 -2.347
206 1HD PRO 23 2HD PRO 23 1.780 3.586 0.571
207 2HD PRO 23 1HD PRO 23 3.201 4.079 -0.333
208 H GLN 24 H GLN 24 0.053 3.819 0.946
209 HA GLN 24 HA GLN 24 -2.495 3.567 1.732
210 1HB GLN 24 2HB GLN 24 -1.814 4.084 4.058
211 2HB GLN 24 1HB GLN 24 -0.672 3.025 3.244
212 1HG GLN 24 2HG GLN 24 0.989 4.520 3.391
213 2HG GLN 24 1HG GLN 24 -0.062 5.882 3.021
214 1HE2 GLN 24 1HE2 GLN 24 1.483 4.067 5.463
215 2HE2 GLN 24 2HE2 GLN 24 0.923 4.977 6.819
216 H LEU 25 H LEU 25 -1.097 6.719 1.126
217 HA LEU 25 HA LEU 25 -3.458 7.877 2.406
218 1HB LEU 25 2HB LEU 25 -2.450 10.120 1.616
219 2HB LEU 25 1HB LEU 25 -1.751 9.268 2.976
220 HG LEU 25 HG LEU 25 -0.121 10.336 1.408
221 1HD1 LEU 25 1HD1 LEU 25 1.445 8.836 1.945
222 2HD1 LEU 25 2HD1 LEU 25 0.546 7.473 1.284
223 3HD1 LEU 25 3HD1 LEU 25 0.134 8.113 2.877
224 1HD2 LEU 25 1HD2 LEU 25 -0.541 8.061 -0.470
225 2HD2 LEU 25 2HD2 LEU 25 0.237 9.619 -0.733
226 3HD2 LEU 25 3HD2 LEU 25 -1.518 9.521 -0.627
227 H VAL 26 H VAL 26 -2.169 7.433 -0.796
228 HA VAL 26 HA VAL 26 -4.464 8.732 -2.034
229 HB VAL 26 HB VAL 26 -3.352 7.150 -3.997
230 1HG1 VAL 26 1HG1 VAL 26 -3.201 10.007 -3.249
231 2HG1 VAL 26 2HG1 VAL 26 -3.793 9.248 -4.728
232 3HG1 VAL 26 3HG1 VAL 26 -2.059 9.451 -4.471
233 1HG2 VAL 26 1HG2 VAL 26 -1.023 8.276 -2.468
234 2HG2 VAL 26 2HG2 VAL 26 -0.985 7.323 -3.950
235 3HG2 VAL 26 3HG2 VAL 26 -1.501 6.580 -2.440
236 H CYS 27 H CYS 27 -3.443 5.798 -0.786
237 HA CYS 27 HA CYS 27 -4.963 3.935 -2.147
238 1HB CYS 27 2HB CYS 27 -3.734 2.634 -0.858
239 2HB CYS 27 1HB CYS 27 -3.158 4.031 0.005
240 H ARG 28 H ARG 28 -5.461 5.341 1.045
241 HA ARG 28 HA ARG 28 -8.089 4.382 1.210
242 1HB ARG 28 2HB ARG 28 -6.778 6.615 2.770
243 2HB ARG 28 1HB ARG 28 -8.295 5.831 3.197
244 1HG ARG 28 2HG ARG 28 -7.249 4.058 4.093
245 2HG ARG 28 1HG ARG 28 -6.079 3.938 2.812
246 1HD ARG 28 2HD ARG 28 -5.192 6.167 3.986
247 2HD ARG 28 1HD ARG 28 -5.981 5.434 5.380
248 HE ARG 28 HE ARG 28 -3.497 4.708 4.331
249 1HH1 ARG 28 1HH1 ARG 28 -6.429 3.228 5.533
250 2HH1 ARG 28 2HH1 ARG 28 -5.661 1.732 5.940
251 1HH2 ARG 28 1HH2 ARG 28 -2.488 2.719 4.885
252 2HH2 ARG 28 2HH2 ARG 28 -3.433 1.447 5.575
253 H LEU 29 H LEU 29 -6.670 7.130 -0.286
254 HA LEU 29 HA LEU 29 -8.940 8.786 -0.474
255 1HB LEU 29 2HB LEU 29 -6.421 8.462 -2.019
256 2HB LEU 29 1HB LEU 29 -7.741 9.298 -2.814
257 HG LEU 29 HG LEU 29 -6.576 10.105 -0.152
258 1HD1 LEU 29 1HD1 LEU 29 -6.055 12.044 -2.116
259 2HD1 LEU 29 2HD1 LEU 29 -5.584 10.494 -2.815
260 3HD1 LEU 29 3HD1 LEU 29 -4.894 11.015 -1.279
261 1HD2 LEU 29 1HD2 LEU 29 -8.624 11.092 -0.093
262 2HD2 LEU 29 2HD2 LEU 29 -8.806 11.081 -1.847
263 3HD2 LEU 29 3HD2 LEU 29 -7.788 12.296 -1.074
264 H VAL 30 H VAL 30 -7.821 5.959 -2.172
265 HA VAL 30 HA VAL 30 -9.864 6.008 -4.181
266 HB VAL 30 HB VAL 30 -7.574 4.332 -3.558
267 1HG1 VAL 30 1HG1 VAL 30 -9.174 2.631 -2.949
268 2HG1 VAL 30 2HG1 VAL 30 -8.480 2.235 -4.522
269 3HG1 VAL 30 3HG1 VAL 30 -10.101 2.924 -4.420
270 1HG2 VAL 30 1HG2 VAL 30 -7.370 5.313 -5.593
271 2HG2 VAL 30 2HG2 VAL 30 -9.104 5.264 -5.914
272 3HG2 VAL 30 3HG2 VAL 30 -8.128 3.808 -6.114
273 H LEU 31 H LEU 31 -9.507 4.786 -0.967
274 HA LEU 31 HA LEU 31 -11.532 2.879 -0.874
275 1HB LEU 31 2HB LEU 31 -10.353 2.857 1.073
276 2HB LEU 31 1HB LEU 31 -10.139 4.591 1.091
277 HG LEU 31 HG LEU 31 -12.854 3.506 1.668
278 1HD1 LEU 31 1HD1 LEU 31 -12.386 2.788 3.785
279 2HD1 LEU 31 2HD1 LEU 31 -10.932 3.780 3.918
280 3HD1 LEU 31 3HD1 LEU 31 -10.902 2.296 2.965
281 1HD2 LEU 31 1HD2 LEU 31 -12.708 5.448 3.315
282 2HD2 LEU 31 2HD2 LEU 31 -12.741 5.857 1.599
283 3HD2 LEU 31 3HD2 LEU 31 -11.217 5.892 2.485
284 H ARG 32 H ARG 32 -11.620 6.332 -0.966
285 HA ARG 32 HA ARG 32 -14.267 6.802 -0.131
286 1HB ARG 32 2HB ARG 32 -12.702 8.638 -0.415
287 2HB ARG 32 1HB ARG 32 -12.536 8.280 -2.127
288 1HG ARG 32 2HG ARG 32 -13.939 10.149 -2.018
289 2HG ARG 32 1HG ARG 32 -15.017 8.786 -2.323
290 1HD ARG 32 2HD ARG 32 -14.519 9.441 0.510
291 2HD ARG 32 1HD ARG 32 -15.437 10.632 -0.409
292 HE ARG 32 HE ARG 32 -16.380 7.930 -0.719
293 1HH1 ARG 32 1HH1 ARG 32 -16.605 10.853 1.177
294 2HH1 ARG 32 2HH1 ARG 32 -18.177 10.478 1.797
295 1HH2 ARG 32 1HH2 ARG 32 -18.449 7.437 0.098
296 2HH2 ARG 32 2HH2 ARG 32 -19.223 8.540 1.186
297 H CYS 33 H CYS 33 -12.971 5.312 -2.918
298 HA CYS 33 HA CYS 33 -14.586 5.748 -5.009
299 1HB CYS 33 2HB CYS 33 -12.800 4.115 -5.074
300 2HB CYS 33 1HB CYS 33 -13.669 3.060 -3.981
301 H SER 34 H SER 34 -16.684 6.347 -4.567
302 HA SER 34 HA SER 34 -18.638 4.337 -4.512
303 1HB SER 34 2HB SER 34 -18.271 3.916 -2.235
304 2HB SER 34 1HB SER 34 -17.987 5.617 -1.870
305 HG SER 34 HG SER 34 -20.097 4.652 -1.252
Start of MODEL 13
1 1H CYS 1 1HT CYS 1 -10.957 0.700 -3.697
2 2H CYS 1 2HT CYS 1 -11.853 1.064 -5.114
3 3H CYS 1 3HT CYS 1 -12.129 -0.408 -4.278
4 HA CYS 1 HA CYS 1 -12.515 2.205 -3.015
5 1HB CYS 1 2HB CYS 1 -13.828 2.004 -5.141
6 2HB CYS 1 1HB CYS 1 -14.580 0.553 -4.490
7 H TRP 2 H TRP 2 -11.496 -0.502 -2.197
8 HA TRP 2 HA TRP 2 -12.629 -0.715 0.305
9 1HB TRP 2 2HB TRP 2 -14.409 -1.744 -1.622
10 2HB TRP 2 1HB TRP 2 -13.702 -3.147 -0.826
11 HD1 TRP 2 HD TRP 2 -13.639 -2.568 2.105
12 HE1 TRP 2 1HE TRP 2 -15.725 -1.972 3.486
13 HE3 TRP 2 3HE TRP 2 -16.679 -0.931 -1.673
14 HZ2 TRP 2 2HZ TRP 2 -18.312 -0.943 3.039
15 HZ3 TRP 2 3HZ TRP 2 -18.946 -0.157 -1.105
16 HH2 TRP 2 HH TRP 2 -19.743 -0.165 1.202
17 H LEU 3 H LEU 3 -11.220 -2.429 -2.404
18 HA LEU 3 HA LEU 3 -9.907 -4.388 -0.730
19 1HB LEU 3 2HB LEU 3 -9.095 -3.956 -3.560
20 2HB LEU 3 1HB LEU 3 -9.259 -5.451 -2.663
21 HG LEU 3 HG LEU 3 -11.595 -3.809 -3.638
22 1HD1 LEU 3 1HD1 LEU 3 -9.969 -5.924 -4.934
23 2HD1 LEU 3 2HD1 LEU 3 -10.807 -4.542 -5.640
24 3HD1 LEU 3 3HD1 LEU 3 -11.718 -5.974 -5.157
25 1HD2 LEU 3 1HD2 LEU 3 -12.550 -6.277 -3.308
26 2HD2 LEU 3 2HD2 LEU 3 -12.546 -5.076 -2.015
27 3HD2 LEU 3 3HD2 LEU 3 -11.284 -6.306 -2.079
28 H CYS 4 H CYS 4 -9.322 -1.196 -1.228
29 HA CYS 4 HA CYS 4 -6.719 -0.906 -1.992
30 1HB CYS 4 2HB CYS 4 -8.594 0.753 -0.855
31 2HB CYS 4 1HB CYS 4 -7.282 0.756 0.327
32 H ARG 5 H ARG 5 -7.522 -0.919 1.510
33 HA ARG 5 HA ARG 5 -5.159 -1.183 2.678
34 1HB ARG 5 2HB ARG 5 -6.107 -2.596 4.389
35 2HB ARG 5 1HB ARG 5 -7.351 -1.483 3.839
36 1HG ARG 5 2HG ARG 5 -8.151 -3.347 2.322
37 2HG ARG 5 1HG ARG 5 -7.083 -4.412 3.238
38 1HD ARG 5 2HD ARG 5 -8.264 -3.968 5.265
39 2HD ARG 5 1HD ARG 5 -9.202 -2.685 4.502
40 HE ARG 5 HE ARG 5 -9.543 -5.238 3.243
41 1HH1 ARG 5 1HH1 ARG 5 -10.616 -3.199 5.864
42 2HH1 ARG 5 2HH1 ARG 5 -12.169 -3.954 5.981
43 1HH2 ARG 5 1HH2 ARG 5 -11.578 -6.230 3.392
44 2HH2 ARG 5 2HH2 ARG 5 -12.717 -5.678 4.576
45 H ALA 6 H ALA 6 -6.681 -3.726 0.778
46 HA ALA 6 HA ALA 6 -4.800 -5.750 1.238
47 1HB ALA 6 1HB ALA 6 -7.099 -5.626 -0.162
48 2HB ALA 6 2HB ALA 6 -5.907 -6.909 -0.368
49 3HB ALA 6 3HB ALA 6 -5.935 -5.545 -1.485
50 H LEU 7 H LEU 7 -5.028 -3.593 -1.605
51 HA LEU 7 HA LEU 7 -2.671 -4.131 -2.846
52 1HB LEU 7 2HB LEU 7 -4.250 -2.656 -3.865
53 2HB LEU 7 1HB LEU 7 -4.131 -1.512 -2.542
54 HG LEU 7 HG LEU 7 -1.703 -2.098 -4.193
55 1HD1 LEU 7 1HD1 LEU 7 -3.165 -1.621 -5.945
56 2HD1 LEU 7 2HD1 LEU 7 -2.444 -0.057 -5.560
57 3HD1 LEU 7 3HD1 LEU 7 -4.069 -0.442 -4.995
58 1HD2 LEU 7 1HD2 LEU 7 -1.025 -0.682 -2.564
59 2HD2 LEU 7 2HD2 LEU 7 -2.643 -0.033 -2.301
60 3HD2 LEU 7 3HD2 LEU 7 -1.679 0.531 -3.665
61 H ILE 8 H ILE 8 -3.181 -2.326 0.094
62 HA ILE 8 HA ILE 8 -0.642 -1.170 0.040
63 HB ILE 8 HB ILE 8 -1.003 -0.285 2.153
64 1HG1 ILE 8 2HG1 ILE 8 -3.251 -1.663 3.237
65 2HG1 ILE 8 1HG1 ILE 8 -2.028 -2.853 2.804
66 1HG2 ILE 8 1HG2 ILE 8 -2.683 0.435 0.435
67 2HG2 ILE 8 2HG2 ILE 8 -3.220 0.634 2.104
68 3HG2 ILE 8 3HG2 ILE 8 -3.815 -0.719 1.147
69 1HD1 ILE 8 1HD1 ILE 8 -1.778 -0.538 4.689
70 2HD1 ILE 8 2HD1 ILE 8 -0.384 -1.434 4.082
71 3HD1 ILE 8 3HD1 ILE 8 -1.618 -2.260 5.036
72 H LYS 9 H LYS 9 -1.887 -4.209 0.990
73 HA LYS 9 HA LYS 9 0.215 -5.186 2.564
74 1HB LYS 9 2HB LYS 9 -0.876 -7.166 2.409
75 2HB LYS 9 1HB LYS 9 -2.088 -6.199 1.614
76 1HG LYS 9 2HG LYS 9 -0.115 -7.099 -0.288
77 2HG LYS 9 1HG LYS 9 -0.807 -8.450 0.575
78 1HD LYS 9 2HD LYS 9 -2.379 -8.321 -1.033
79 2HD LYS 9 1HD LYS 9 -3.046 -7.058 0.000
80 1HE LYS 9 2HE LYS 9 -2.026 -5.327 -1.334
81 2HE LYS 9 1HE LYS 9 -1.089 -6.506 -2.214
82 1HZ LYS 9 1HZ LYS 9 -2.844 -5.937 -3.623
83 2HZ LYS 9 2HZ LYS 9 -3.993 -6.044 -2.389
84 3HZ LYS 9 3HZ LYS 9 -3.274 -7.450 -2.993
85 H ARG 10 H ARG 10 -0.317 -4.964 -0.866
86 HA ARG 10 HA ARG 10 1.961 -6.370 -1.722
87 1HB ARG 10 2HB ARG 10 0.093 -4.428 -2.943
88 2HB ARG 10 1HB ARG 10 1.677 -4.529 -3.689
89 1HG ARG 10 2HG ARG 10 -0.514 -6.113 -4.215
90 2HG ARG 10 1HG ARG 10 1.141 -6.399 -4.744
91 1HD ARG 10 2HD ARG 10 0.177 -7.383 -2.073
92 2HD ARG 10 1HD ARG 10 -0.146 -8.302 -3.537
93 HE ARG 10 HE ARG 10 2.614 -7.592 -3.124
94 1HH1 ARG 10 1HH1 ARG 10 0.126 -9.950 -2.493
95 2HH1 ARG 10 2HH1 ARG 10 1.244 -11.252 -2.262
96 1HH2 ARG 10 1HH2 ARG 10 4.092 -9.297 -2.833
97 2HH2 ARG 10 2HH2 ARG 10 3.500 -10.882 -2.456
98 H ILE 11 H ILE 11 1.395 -3.231 -0.467
99 HA ILE 11 HA ILE 11 3.927 -2.144 -1.165
100 HB ILE 11 HB ILE 11 1.639 -1.252 0.353
101 1HG1 ILE 11 2HG1 ILE 11 2.871 1.000 -0.139
102 2HG1 ILE 11 1HG1 ILE 11 3.952 -0.010 -1.094
103 1HG2 ILE 11 1HG2 ILE 11 3.000 -1.634 2.314
104 2HG2 ILE 11 2HG2 ILE 11 2.845 0.103 2.033
105 3HG2 ILE 11 3HG2 ILE 11 4.335 -0.734 1.596
106 1HD1 ILE 11 1HD1 ILE 11 2.503 -0.099 -2.763
107 2HD1 ILE 11 2HD1 ILE 11 1.548 1.114 -1.907
108 3HD1 ILE 11 3HD1 ILE 11 1.198 -0.600 -1.687
109 H GLN 12 H GLN 12 2.634 -4.115 1.428
110 HA GLN 12 HA GLN 12 5.063 -3.859 2.991
111 1HB GLN 12 2HB GLN 12 3.970 -5.021 4.683
112 2HB GLN 12 1HB GLN 12 2.648 -4.178 3.896
113 1HG GLN 12 2HG GLN 12 1.602 -6.109 3.654
114 2HG GLN 12 1HG GLN 12 2.893 -6.657 2.591
115 1HE2 GLN 12 1HE2 GLN 12 4.829 -7.562 3.694
116 2HE2 GLN 12 2HE2 GLN 12 4.561 -8.543 5.092
117 H ALA 13 H ALA 13 3.703 -5.907 0.592
118 HA ALA 13 HA ALA 13 5.562 -8.028 1.144
119 1HB ALA 13 1HB ALA 13 3.179 -8.453 0.452
120 2HB ALA 13 2HB ALA 13 4.405 -9.331 -0.461
121 3HB ALA 13 3HB ALA 13 3.640 -7.903 -1.160
122 H MET 14 H MET 14 5.214 -5.338 -0.993
123 HA MET 14 HA MET 14 6.926 -6.167 -3.057
124 1HB MET 14 2HB MET 14 7.163 -3.828 -3.629
125 2HB MET 14 1HB MET 14 5.492 -4.154 -3.194
126 1HG MET 14 2HG MET 14 5.605 -2.922 -1.278
127 2HG MET 14 1HG MET 14 7.335 -3.169 -1.084
128 1HE MET 14 1HE MET 14 6.859 0.696 -1.327
129 2HE MET 14 2HE MET 14 8.103 -0.408 -0.742
130 3HE MET 14 3HE MET 14 6.414 -0.672 -0.306
131 H ILE 15 H ILE 15 7.541 -5.138 0.206
132 HA ILE 15 HA ILE 15 10.411 -5.493 -0.354
133 HB ILE 15 HB ILE 15 11.127 -3.627 0.855
134 1HG1 ILE 15 2HG1 ILE 15 9.654 -3.733 2.780
135 2HG1 ILE 15 1HG1 ILE 15 9.605 -2.114 2.098
136 1HG2 ILE 15 1HG2 ILE 15 9.650 -3.332 -1.400
137 2HG2 ILE 15 2HG2 ILE 15 10.596 -2.054 -0.642
138 3HG2 ILE 15 3HG2 ILE 15 8.868 -2.181 -0.318
139 1HD1 ILE 15 1HD1 ILE 15 7.397 -2.371 2.330
140 2HD1 ILE 15 2HD1 ILE 15 7.494 -4.131 2.335
141 3HD1 ILE 15 3HD1 ILE 15 7.534 -3.250 0.809
142 HA PRO 16 HA PRO 16 9.853 -8.103 3.250
143 1HB PRO 16 2HB PRO 16 12.068 -9.564 2.959
144 2HB PRO 16 1HB PRO 16 10.706 -9.744 1.846
145 1HG PRO 16 2HG PRO 16 13.287 -8.292 1.465
146 2HG PRO 16 1HG PRO 16 12.368 -9.268 0.307
147 1HD PRO 16 2HD PRO 16 12.330 -6.491 0.461
148 2HD PRO 16 1HD PRO 16 11.101 -7.491 -0.336
149 H LYS 17 H LYS 17 12.541 -6.012 2.544
150 HA LYS 17 HA LYS 17 12.874 -5.244 5.245
151 1HB LYS 17 2HB LYS 17 14.024 -7.417 5.394
152 2HB LYS 17 1HB LYS 17 15.092 -6.940 4.082
153 1HG LYS 17 2HG LYS 17 15.207 -4.919 6.066
154 2HG LYS 17 1HG LYS 17 15.383 -6.480 6.868
155 1HD LYS 17 2HD LYS 17 17.145 -7.052 5.183
156 2HD LYS 17 1HD LYS 17 17.040 -5.392 4.596
157 1HE LYS 17 2HE LYS 17 18.707 -5.065 6.084
158 2HE LYS 17 1HE LYS 17 17.362 -4.917 7.214
159 1HZ LYS 17 1HZ LYS 17 18.577 -7.551 6.696
160 2HZ LYS 17 2HZ LYS 17 17.729 -7.018 8.059
161 3HZ LYS 17 3HZ LYS 17 19.308 -6.479 7.782
162 H GLY 18 H GLY 18 12.404 -3.886 2.864
163 1HA GLY 18 2HA GLY 18 14.214 -1.780 3.005
164 2HA GLY 18 1HA GLY 18 14.764 -2.821 1.702
165 H GLY 19 H GLY 19 12.354 -0.566 2.758
166 1HA GLY 19 2HA GLY 19 11.662 0.079 0.059
167 2HA GLY 19 1HA GLY 19 10.368 -0.789 0.872
168 H ARG 20 H ARG 20 8.985 1.019 0.754
169 HA ARG 20 HA ARG 20 9.318 2.845 2.958
170 1HB ARG 20 2HB ARG 20 9.414 3.807 0.107
171 2HB ARG 20 1HB ARG 20 8.885 4.855 1.414
172 1HG ARG 20 2HG ARG 20 11.018 5.426 1.613
173 2HG ARG 20 1HG ARG 20 11.255 3.850 2.366
174 1HD ARG 20 2HD ARG 20 12.363 3.034 0.587
175 2HD ARG 20 1HD ARG 20 11.278 3.812 -0.565
176 HE ARG 20 HE ARG 20 12.743 5.866 0.453
177 1HH1 ARG 20 1HH1 ARG 20 13.536 2.836 -1.081
178 2HH1 ARG 20 2HH1 ARG 20 15.010 3.425 -1.773
179 1HH2 ARG 20 1HH2 ARG 20 14.677 6.649 -0.454
180 2HH2 ARG 20 2HH2 ARG 20 15.659 5.595 -1.417
181 H MET 21 H MET 21 7.377 4.091 0.437
182 HA MET 21 HA MET 21 5.002 2.680 0.582
183 1HB MET 21 2HB MET 21 3.685 3.885 2.211
184 2HB MET 21 1HB MET 21 5.115 3.266 3.025
185 1HG MET 21 2HG MET 21 6.019 5.682 2.298
186 2HG MET 21 1HG MET 21 4.304 6.042 2.457
187 1HE MET 21 1HE MET 21 4.396 3.323 4.992
188 2HE MET 21 2HE MET 21 3.137 4.471 4.546
189 3HE MET 21 3HE MET 21 3.829 4.510 6.166
190 H LEU 22 H LEU 22 3.083 4.639 0.469
191 HA LEU 22 HA LEU 22 3.032 7.009 -0.395
192 1HB LEU 22 2HB LEU 22 5.146 6.972 -1.503
193 2HB LEU 22 1HB LEU 22 4.635 5.662 -2.549
194 HG LEU 22 HG LEU 22 4.750 8.047 -3.518
195 1HD1 LEU 22 1HD1 LEU 22 3.382 7.377 -5.167
196 2HD1 LEU 22 2HD1 LEU 22 2.047 7.028 -4.069
197 3HD1 LEU 22 3HD1 LEU 22 3.358 5.863 -4.262
198 1HD2 LEU 22 1HD2 LEU 22 3.322 9.635 -2.854
199 2HD2 LEU 22 2HD2 LEU 22 3.165 8.665 -1.391
200 3HD2 LEU 22 3HD2 LEU 22 1.984 8.500 -2.690
201 HA PRO 23 HA PRO 23 0.271 4.858 -3.629
202 1HB PRO 23 2HB PRO 23 0.597 2.011 -3.535
203 2HB PRO 23 1HB PRO 23 0.985 3.117 -4.852
204 1HG PRO 23 2HG PRO 23 2.879 1.745 -3.436
205 2HG PRO 23 1HG PRO 23 3.183 3.310 -4.219
206 1HD PRO 23 2HD PRO 23 2.434 2.747 -1.356
207 2HD PRO 23 1HD PRO 23 3.757 3.780 -1.982
208 H GLN 24 H GLN 24 0.799 2.921 -0.760
209 HA GLN 24 HA GLN 24 -1.940 2.100 -0.490
210 1HB GLN 24 2HB GLN 24 -1.168 1.441 1.840
211 2HB GLN 24 1HB GLN 24 -0.409 0.608 0.484
212 1HG GLN 24 2HG GLN 24 1.584 1.240 1.209
213 2HG GLN 24 1HG GLN 24 1.117 2.936 1.121
214 1HE2 GLN 24 1HE2 GLN 24 0.652 0.086 3.179
215 2HE2 GLN 24 2HE2 GLN 24 0.774 0.934 4.680
216 H LEU 25 H LEU 25 -0.199 4.951 0.216
217 HA LEU 25 HA LEU 25 -2.060 5.812 2.268
218 1HB LEU 25 2HB LEU 25 0.218 7.251 0.904
219 2HB LEU 25 1HB LEU 25 -0.806 7.979 2.128
220 HG LEU 25 HG LEU 25 1.090 7.350 3.321
221 1HD1 LEU 25 1HD1 LEU 25 0.424 5.502 4.763
222 2HD1 LEU 25 2HD1 LEU 25 -0.781 4.998 3.579
223 3HD1 LEU 25 3HD1 LEU 25 -0.954 6.545 4.407
224 1HD2 LEU 25 1HD2 LEU 25 2.167 5.138 3.085
225 2HD2 LEU 25 2HD2 LEU 25 2.211 6.095 1.607
226 3HD2 LEU 25 3HD2 LEU 25 1.059 4.770 1.765
227 H VAL 26 H VAL 26 -1.211 6.540 -1.051
228 HA VAL 26 HA VAL 26 -3.319 8.446 -1.436
229 HB VAL 26 HB VAL 26 -2.956 7.665 -3.942
230 1HG1 VAL 26 1HG1 VAL 26 -1.468 9.463 -4.252
231 2HG1 VAL 26 2HG1 VAL 26 -0.769 9.270 -2.645
232 3HG1 VAL 26 3HG1 VAL 26 -2.413 9.883 -2.823
233 1HG2 VAL 26 1HG2 VAL 26 -0.160 7.285 -3.480
234 2HG2 VAL 26 2HG2 VAL 26 -1.293 6.287 -4.387
235 3HG2 VAL 26 3HG2 VAL 26 -1.084 6.029 -2.659
236 H CYS 27 H CYS 27 -2.704 5.096 -1.962
237 HA CYS 27 HA CYS 27 -4.939 4.205 -3.248
238 1HB CYS 27 2HB CYS 27 -3.645 2.438 -2.915
239 2HB CYS 27 1HB CYS 27 -2.883 3.134 -1.505
240 H ARG 28 H ARG 28 -4.420 4.393 0.196
241 HA ARG 28 HA ARG 28 -6.946 3.690 0.934
242 1HB ARG 28 2HB ARG 28 -4.770 5.221 2.256
243 2HB ARG 28 1HB ARG 28 -6.351 5.196 3.032
244 1HG ARG 28 2HG ARG 28 -6.095 2.588 2.556
245 2HG ARG 28 1HG ARG 28 -4.398 2.998 2.638
246 1HD ARG 28 2HD ARG 28 -6.485 3.470 4.756
247 2HD ARG 28 1HD ARG 28 -5.102 2.380 4.838
248 HE ARG 28 HE ARG 28 -4.051 4.892 4.413
249 1HH1 ARG 28 1HH1 ARG 28 -6.025 3.359 6.853
250 2HH1 ARG 28 2HH1 ARG 28 -5.459 4.382 8.132
251 1HH2 ARG 28 1HH2 ARG 28 -3.308 6.239 6.097
252 2HH2 ARG 28 2HH2 ARG 28 -3.919 6.016 7.703
253 H LEU 29 H LEU 29 -5.762 6.796 -0.121
254 HA LEU 29 HA LEU 29 -7.909 8.419 0.644
255 1HB LEU 29 2HB LEU 29 -6.421 8.623 -1.977
256 2HB LEU 29 1HB LEU 29 -7.321 9.897 -1.186
257 HG LEU 29 HG LEU 29 -4.803 8.650 -0.092
258 1HD1 LEU 29 1HD1 LEU 29 -4.399 9.927 -2.145
259 2HD1 LEU 29 2HD1 LEU 29 -3.702 10.712 -0.728
260 3HD1 LEU 29 3HD1 LEU 29 -5.203 11.322 -1.425
261 1HD2 LEU 29 1HD2 LEU 29 -5.798 9.472 1.793
262 2HD2 LEU 29 2HD2 LEU 29 -6.714 10.693 0.910
263 3HD2 LEU 29 3HD2 LEU 29 -4.995 10.934 1.222
264 H VAL 30 H VAL 30 -7.512 6.084 -1.890
265 HA VAL 30 HA VAL 30 -10.028 6.658 -3.187
266 HB VAL 30 HB VAL 30 -7.750 4.885 -3.667
267 1HG1 VAL 30 1HG1 VAL 30 -9.299 3.096 -3.237
268 2HG1 VAL 30 2HG1 VAL 30 -9.034 3.214 -4.976
269 3HG1 VAL 30 3HG1 VAL 30 -10.518 3.848 -4.266
270 1HG2 VAL 30 1HG2 VAL 30 -8.150 5.424 -5.929
271 2HG2 VAL 30 2HG2 VAL 30 -8.519 6.883 -5.009
272 3HG2 VAL 30 3HG2 VAL 30 -9.826 5.862 -5.608
273 H LEU 31 H LEU 31 -8.858 4.597 -0.650
274 HA LEU 31 HA LEU 31 -10.834 2.671 -0.509
275 1HB LEU 31 2HB LEU 31 -9.562 2.099 1.230
276 2HB LEU 31 1HB LEU 31 -8.800 3.670 1.228
277 HG LEU 31 HG LEU 31 -11.446 3.333 2.590
278 1HD1 LEU 31 1HD1 LEU 31 -10.601 2.356 4.462
279 2HD1 LEU 31 2HD1 LEU 31 -8.961 2.928 4.160
280 3HD1 LEU 31 3HD1 LEU 31 -9.602 1.564 3.243
281 1HD2 LEU 31 1HD2 LEU 31 -10.755 5.183 3.872
282 2HD2 LEU 31 2HD2 LEU 31 -10.278 5.562 2.219
283 3HD2 LEU 31 3HD2 LEU 31 -9.073 5.001 3.375
284 H ARG 32 H ARG 32 -10.908 6.030 0.347
285 HA ARG 32 HA ARG 32 -13.328 6.047 1.802
286 1HB ARG 32 2HB ARG 32 -11.687 7.958 1.655
287 2HB ARG 32 1HB ARG 32 -12.289 8.262 0.032
288 1HG ARG 32 2HG ARG 32 -14.195 8.177 2.327
289 2HG ARG 32 1HG ARG 32 -13.220 9.619 2.039
290 1HD ARG 32 2HD ARG 32 -14.529 10.254 0.352
291 2HD ARG 32 1HD ARG 32 -14.414 8.671 -0.415
292 HE ARG 32 HE ARG 32 -16.182 8.262 1.593
293 1HH1 ARG 32 1HH1 ARG 32 -15.998 10.600 -0.993
294 2HH1 ARG 32 2HH1 ARG 32 -17.715 10.800 -1.101
295 1HH2 ARG 32 1HH2 ARG 32 -18.442 8.527 1.451
296 2HH2 ARG 32 2HH2 ARG 32 -19.101 9.624 0.285
297 H CYS 33 H CYS 33 -12.734 7.115 -1.483
298 HA CYS 33 HA CYS 33 -14.202 7.428 -3.232
299 1HB CYS 33 2HB CYS 33 -14.792 5.205 -4.166
300 2HB CYS 33 1HB CYS 33 -13.133 5.295 -3.611
301 H SER 34 H SER 34 -16.486 5.691 -3.864
302 HA SER 34 HA SER 34 -18.747 5.737 -3.682
303 1HB SER 34 2HB SER 34 -18.411 4.353 -1.742
304 2HB SER 34 1HB SER 34 -18.017 5.753 -0.746
305 HG SER 34 HG SER 34 -20.221 4.912 -0.565
Start of MODEL 14
1 1H CYS 1 1HT CYS 1 -12.370 -0.188 -4.137
2 2H CYS 1 2HT CYS 1 -13.361 0.772 -5.158
3 3H CYS 1 3HT CYS 1 -14.077 -0.294 -4.018
4 HA CYS 1 HA CYS 1 -12.333 1.952 -3.287
5 1HB CYS 1 2HB CYS 1 -14.348 2.705 -4.530
6 2HB CYS 1 1HB CYS 1 -15.358 1.842 -3.376
7 H TRP 2 H TRP 2 -11.902 -0.456 -2.135
8 HA TRP 2 HA TRP 2 -12.397 0.028 0.583
9 1HB TRP 2 2HB TRP 2 -14.631 -1.047 -0.627
10 2HB TRP 2 1HB TRP 2 -13.847 -2.460 0.068
11 HD1 TRP 2 HD TRP 2 -12.746 -1.039 2.736
12 HE1 TRP 2 1HE TRP 2 -14.418 -0.426 4.593
13 HE3 TRP 2 3HE TRP 2 -17.048 -0.967 -0.031
14 HZ2 TRP 2 2HZ TRP 2 -17.187 0.027 4.855
15 HZ3 TRP 2 3HZ TRP 2 -19.167 -0.434 1.104
16 HH2 TRP 2 HH TRP 2 -19.233 0.050 3.496
17 H LEU 3 H LEU 3 -11.650 -2.364 -1.891
18 HA LEU 3 HA LEU 3 -10.285 -4.169 -0.144
19 1HB LEU 3 2HB LEU 3 -10.290 -3.885 -3.142
20 2HB LEU 3 1HB LEU 3 -9.456 -5.169 -2.289
21 HG LEU 3 HG LEU 3 -12.435 -4.681 -2.274
22 1HD1 LEU 3 1HD1 LEU 3 -10.633 -6.451 -3.829
23 2HD1 LEU 3 2HD1 LEU 3 -12.133 -5.657 -4.306
24 3HD1 LEU 3 3HD1 LEU 3 -12.183 -7.108 -3.306
25 1HD2 LEU 3 1HD2 LEU 3 -10.703 -6.681 -0.847
26 2HD2 LEU 3 2HD2 LEU 3 -12.419 -6.957 -1.145
27 3HD2 LEU 3 3HD2 LEU 3 -11.904 -5.583 -0.166
28 H CYS 4 H CYS 4 -9.384 -1.130 -0.994
29 HA CYS 4 HA CYS 4 -6.791 -1.318 -1.917
30 1HB CYS 4 2HB CYS 4 -8.410 0.730 -1.049
31 2HB CYS 4 1HB CYS 4 -7.070 0.770 0.092
32 H ARG 5 H ARG 5 -7.749 -1.052 1.534
33 HA ARG 5 HA ARG 5 -5.412 -1.191 2.829
34 1HB ARG 5 2HB ARG 5 -7.429 -1.293 4.102
35 2HB ARG 5 1HB ARG 5 -7.898 -2.817 3.366
36 1HG ARG 5 2HG ARG 5 -5.530 -3.492 4.526
37 2HG ARG 5 1HG ARG 5 -6.148 -2.285 5.654
38 1HD ARG 5 2HD ARG 5 -6.839 -4.603 6.205
39 2HD ARG 5 1HD ARG 5 -8.193 -3.509 5.931
40 HE ARG 5 HE ARG 5 -7.327 -5.079 3.649
41 1HH1 ARG 5 1HH1 ARG 5 -9.557 -4.775 6.321
42 2HH1 ARG 5 2HH1 ARG 5 -10.738 -5.823 5.614
43 1HH2 ARG 5 1HH2 ARG 5 -8.883 -6.457 2.721
44 2HH2 ARG 5 2HH2 ARG 5 -10.356 -6.778 3.572
45 H ALA 6 H ALA 6 -6.913 -3.856 1.085
46 HA ALA 6 HA ALA 6 -5.021 -5.834 1.764
47 1HB ALA 6 1HB ALA 6 -7.346 -5.854 0.378
48 2HB ALA 6 2HB ALA 6 -6.166 -7.164 0.334
49 3HB ALA 6 3HB ALA 6 -6.184 -5.950 -0.945
50 H LEU 7 H LEU 7 -5.334 -3.804 -1.144
51 HA LEU 7 HA LEU 7 -2.941 -4.484 -2.372
52 1HB LEU 7 2HB LEU 7 -4.658 -3.242 -3.531
53 2HB LEU 7 1HB LEU 7 -4.490 -1.896 -2.421
54 HG LEU 7 HG LEU 7 -2.126 -2.732 -4.044
55 1HD1 LEU 7 1HD1 LEU 7 -3.638 -2.610 -5.804
56 2HD1 LEU 7 2HD1 LEU 7 -2.969 -0.980 -5.726
57 3HD1 LEU 7 3HD1 LEU 7 -4.563 -1.312 -5.049
58 1HD2 LEU 7 1HD2 LEU 7 -3.054 -0.377 -2.524
59 2HD2 LEU 7 2HD2 LEU 7 -2.151 -0.051 -4.003
60 3HD2 LEU 7 3HD2 LEU 7 -1.429 -1.031 -2.728
61 H ILE 8 H ILE 8 -3.561 -2.387 0.366
62 HA ILE 8 HA ILE 8 -1.132 -1.030 0.160
63 HB ILE 8 HB ILE 8 -1.418 -0.142 2.311
64 1HG1 ILE 8 2HG1 ILE 8 -3.614 -1.592 3.428
65 2HG1 ILE 8 1HG1 ILE 8 -2.338 -2.729 3.009
66 1HG2 ILE 8 1HG2 ILE 8 -3.047 0.777 0.868
67 2HG2 ILE 8 2HG2 ILE 8 -3.868 0.453 2.396
68 3HG2 ILE 8 3HG2 ILE 8 -4.091 -0.636 1.031
69 1HD1 ILE 8 1HD1 ILE 8 -2.492 -0.856 5.184
70 2HD1 ILE 8 2HD1 ILE 8 -1.024 -0.620 4.237
71 3HD1 ILE 8 3HD1 ILE 8 -1.381 -2.202 4.928
72 H LYS 9 H LYS 9 -2.083 -4.105 1.315
73 HA LYS 9 HA LYS 9 0.347 -4.707 2.682
74 1HB LYS 9 2HB LYS 9 -0.856 -6.476 3.334
75 2HB LYS 9 1HB LYS 9 -2.122 -5.964 2.245
76 1HG LYS 9 2HG LYS 9 0.034 -7.450 0.933
77 2HG LYS 9 1HG LYS 9 -0.855 -8.366 2.142
78 1HD LYS 9 2HD LYS 9 -2.122 -8.788 0.284
79 2HD LYS 9 1HD LYS 9 -2.947 -7.368 0.922
80 1HE LYS 9 2HE LYS 9 -1.846 -5.934 -0.666
81 2HE LYS 9 1HE LYS 9 -0.799 -7.251 -1.193
82 1HZ LYS 9 1HZ LYS 9 -2.407 -8.134 -2.480
83 2HZ LYS 9 2HZ LYS 9 -3.038 -6.565 -2.450
84 3HZ LYS 9 3HZ LYS 9 -3.656 -7.745 -1.406
85 H ARG 10 H ARG 10 -0.759 -4.679 -0.572
86 HA ARG 10 HA ARG 10 1.184 -6.389 -1.705
87 1HB ARG 10 2HB ARG 10 -0.841 -4.543 -2.681
88 2HB ARG 10 1HB ARG 10 0.637 -4.423 -3.623
89 1HG ARG 10 2HG ARG 10 -1.155 -6.784 -3.233
90 2HG ARG 10 1HG ARG 10 -0.670 -6.000 -4.733
91 1HD ARG 10 2HD ARG 10 0.906 -7.566 -4.928
92 2HD ARG 10 1HD ARG 10 1.718 -6.809 -3.559
93 HE ARG 10 HE ARG 10 -0.323 -8.698 -2.819
94 1HH1 ARG 10 1HH1 ARG 10 3.049 -8.281 -3.629
95 2HH1 ARG 10 2HH1 ARG 10 3.552 -9.716 -2.802
96 1HH2 ARG 10 1HH2 ARG 10 0.342 -10.577 -1.722
97 2HH2 ARG 10 2HH2 ARG 10 2.017 -11.019 -1.719
98 H ILE 11 H ILE 11 1.192 -3.254 -0.361
99 HA ILE 11 HA ILE 11 3.666 -2.472 -1.662
100 HB ILE 11 HB ILE 11 2.024 -1.227 0.530
101 1HG1 ILE 11 2HG1 ILE 11 1.145 -0.810 -1.660
102 2HG1 ILE 11 1HG1 ILE 11 1.952 0.658 -1.136
103 1HG2 ILE 11 1HG2 ILE 11 3.895 -0.357 1.352
104 2HG2 ILE 11 2HG2 ILE 11 3.968 0.606 -0.121
105 3HG2 ILE 11 3HG2 ILE 11 4.852 -0.918 -0.018
106 1HD1 ILE 11 1HD1 ILE 11 3.926 -0.016 -2.480
107 2HD1 ILE 11 2HD1 ILE 11 2.470 0.279 -3.431
108 3HD1 ILE 11 3HD1 ILE 11 2.981 -1.373 -3.093
109 H GLN 12 H GLN 12 2.446 -3.921 1.203
110 HA GLN 12 HA GLN 12 4.631 -3.881 2.913
111 1HB GLN 12 2HB GLN 12 2.160 -5.247 2.603
112 2HB GLN 12 1HB GLN 12 3.390 -6.466 2.858
113 1HG GLN 12 2HG GLN 12 2.056 -4.815 4.672
114 2HG GLN 12 1HG GLN 12 3.214 -6.136 4.957
115 1HE2 GLN 12 1HE2 GLN 12 5.517 -5.526 4.866
116 2HE2 GLN 12 2HE2 GLN 12 5.984 -3.978 5.475
117 H ALA 13 H ALA 13 3.685 -6.008 0.320
118 HA ALA 13 HA ALA 13 5.868 -7.681 0.604
119 1HB ALA 13 1HB ALA 13 5.046 -8.863 -1.195
120 2HB ALA 13 2HB ALA 13 4.565 -7.399 -2.055
121 3HB ALA 13 3HB ALA 13 3.598 -7.983 -0.702
122 H MET 14 H MET 14 5.315 -4.701 -1.062
123 HA MET 14 HA MET 14 7.321 -4.616 -2.938
124 1HB MET 14 2HB MET 14 6.830 -2.425 -3.085
125 2HB MET 14 1HB MET 14 5.596 -2.761 -1.886
126 1HG MET 14 2HG MET 14 6.547 -1.066 -0.797
127 2HG MET 14 1HG MET 14 7.714 -2.277 -0.280
128 1HE MET 14 1HE MET 14 8.581 1.270 -0.776
129 2HE MET 14 2HE MET 14 10.141 0.466 -0.607
130 3HE MET 14 3HE MET 14 8.755 -0.086 0.338
131 H ILE 15 H ILE 15 7.521 -4.515 0.532
132 HA ILE 15 HA ILE 15 9.346 -5.461 1.650
133 HB ILE 15 HB ILE 15 11.608 -5.290 1.079
134 1HG1 ILE 15 2HG1 ILE 15 12.576 -3.611 -0.022
135 2HG1 ILE 15 1HG1 ILE 15 11.673 -4.003 -1.470
136 1HG2 ILE 15 1HG2 ILE 15 11.005 -5.827 -1.627
137 2HG2 ILE 15 2HG2 ILE 15 9.661 -6.383 -0.627
138 3HG2 ILE 15 3HG2 ILE 15 11.298 -6.954 -0.302
139 1HD1 ILE 15 1HD1 ILE 15 9.808 -2.571 -0.318
140 2HD1 ILE 15 2HD1 ILE 15 11.140 -1.805 -1.176
141 3HD1 ILE 15 3HD1 ILE 15 11.172 -1.915 0.581
142 HA PRO 16 HA PRO 16 10.073 -2.020 4.274
143 1HB PRO 16 2HB PRO 16 11.548 -3.239 6.139
144 2HB PRO 16 1HB PRO 16 9.876 -3.724 5.839
145 1HG PRO 16 2HG PRO 16 12.397 -5.096 5.109
146 2HG PRO 16 1HG PRO 16 10.799 -5.780 5.442
147 1HD PRO 16 2HD PRO 16 11.966 -5.228 2.886
148 2HD PRO 16 1HD PRO 16 10.335 -5.834 3.228
149 H LYS 17 H LYS 17 13.110 -3.897 3.762
150 HA LYS 17 HA LYS 17 14.943 -1.963 4.427
151 1HB LYS 17 2HB LYS 17 14.979 -4.454 3.024
152 2HB LYS 17 1HB LYS 17 15.942 -3.301 2.110
153 1HG LYS 17 2HG LYS 17 16.540 -3.164 4.936
154 2HG LYS 17 1HG LYS 17 16.753 -4.796 4.303
155 1HD LYS 17 2HD LYS 17 18.465 -4.188 2.920
156 2HD LYS 17 1HD LYS 17 17.852 -2.547 2.704
157 1HE LYS 17 2HE LYS 17 19.891 -2.454 3.975
158 2HE LYS 17 1HE LYS 17 18.542 -2.033 5.028
159 1HZ LYS 17 1HZ LYS 17 19.582 -4.796 4.901
160 2HZ LYS 17 2HZ LYS 17 18.665 -4.068 6.121
161 3HZ LYS 17 3HZ LYS 17 20.288 -3.639 5.916
162 H GLY 18 H GLY 18 12.955 -2.243 1.623
163 1HA GLY 18 2HA GLY 18 14.309 -0.077 0.220
164 2HA GLY 18 1HA GLY 18 12.970 -1.046 -0.384
165 H GLY 19 H GLY 19 13.507 2.000 0.044
166 1HA GLY 19 2HA GLY 19 10.770 2.551 0.805
167 2HA GLY 19 1HA GLY 19 11.965 3.148 1.944
168 H ARG 20 H ARG 20 10.192 4.809 0.711
169 HA ARG 20 HA ARG 20 11.638 6.960 -0.128
170 1HB ARG 20 2HB ARG 20 11.580 5.018 -2.210
171 2HB ARG 20 1HB ARG 20 10.534 6.339 -2.705
172 1HG ARG 20 2HG ARG 20 12.322 7.459 -3.355
173 2HG ARG 20 1HG ARG 20 12.853 7.535 -1.674
174 1HD ARG 20 2HD ARG 20 14.479 6.038 -2.017
175 2HD ARG 20 1HD ARG 20 13.414 4.963 -2.919
176 HE ARG 20 HE ARG 20 13.891 6.928 -4.693
177 1HH1 ARG 20 1HH1 ARG 20 16.011 4.993 -2.705
178 2HH1 ARG 20 2HH1 ARG 20 17.330 5.064 -3.825
179 1HH2 ARG 20 1HH2 ARG 20 15.625 7.012 -6.171
180 2HH2 ARG 20 2HH2 ARG 20 17.111 6.206 -5.791
181 H MET 21 H MET 21 8.779 5.048 -0.661
182 HA MET 21 HA MET 21 6.847 6.491 0.487
183 1HB MET 21 2HB MET 21 6.666 8.456 -0.621
184 2HB MET 21 1HB MET 21 7.702 7.902 -1.930
185 1HG MET 21 2HG MET 21 5.772 6.716 -2.926
186 2HG MET 21 1HG MET 21 4.746 7.344 -1.641
187 1HE MET 21 1HE MET 21 6.723 10.491 -1.927
188 2HE MET 21 2HE MET 21 5.300 9.979 -1.019
189 3HE MET 21 3HE MET 21 5.153 11.221 -2.260
190 H LEU 22 H LEU 22 4.608 5.990 -0.423
191 HA LEU 22 HA LEU 22 4.632 3.976 -2.456
192 1HB LEU 22 2HB LEU 22 3.252 3.300 0.087
193 2HB LEU 22 1HB LEU 22 3.703 2.300 -1.273
194 HG LEU 22 HG LEU 22 5.928 3.521 0.257
195 1HD1 LEU 22 1HD1 LEU 22 5.090 2.865 2.222
196 2HD1 LEU 22 2HD1 LEU 22 5.601 1.264 1.693
197 3HD1 LEU 22 3HD1 LEU 22 3.924 1.767 1.481
198 1HD2 LEU 22 1HD2 LEU 22 5.405 1.097 -1.355
199 2HD2 LEU 22 2HD2 LEU 22 6.584 0.959 -0.051
200 3HD2 LEU 22 3HD2 LEU 22 6.811 2.159 -1.324
201 HA PRO 23 HA PRO 23 0.552 5.401 -3.170
202 1HB PRO 23 2HB PRO 23 -0.413 3.189 -4.437
203 2HB PRO 23 1HB PRO 23 0.733 4.321 -5.132
204 1HG PRO 23 2HG PRO 23 1.163 1.583 -4.380
205 2HG PRO 23 1HG PRO 23 2.266 2.686 -5.218
206 1HD PRO 23 2HD PRO 23 2.146 1.969 -2.383
207 2HD PRO 23 1HD PRO 23 3.466 2.690 -3.290
208 H GLN 24 H GLN 24 0.955 2.552 -1.285
209 HA GLN 24 HA GLN 24 -1.688 1.831 -0.803
210 1HB GLN 24 2HB GLN 24 -0.744 1.010 1.451
211 2HB GLN 24 1HB GLN 24 -0.121 0.273 -0.017
212 1HG GLN 24 2HG GLN 24 1.764 0.644 1.288
213 2HG GLN 24 1HG GLN 24 1.771 1.997 0.163
214 1HE2 GLN 24 1HE2 GLN 24 0.384 1.188 3.323
215 2HE2 GLN 24 2HE2 GLN 24 0.771 2.696 4.071
216 H LEU 25 H LEU 25 0.024 4.637 0.102
217 HA LEU 25 HA LEU 25 -1.718 5.237 2.342
218 1HB LEU 25 2HB LEU 25 0.578 6.567 1.015
219 2HB LEU 25 1HB LEU 25 -0.554 7.600 1.853
220 HG LEU 25 HG LEU 25 0.444 7.191 3.793
221 1HD1 LEU 25 1HD1 LEU 25 -0.895 5.344 4.316
222 2HD1 LEU 25 2HD1 LEU 25 0.756 4.806 4.624
223 3HD1 LEU 25 3HD1 LEU 25 -0.074 4.305 3.151
224 1HD2 LEU 25 1HD2 LEU 25 2.568 7.152 3.074
225 2HD2 LEU 25 2HD2 LEU 25 2.253 5.909 1.864
226 3HD2 LEU 25 3HD2 LEU 25 2.495 5.456 3.552
227 H VAL 26 H VAL 26 -1.215 6.595 -0.867
228 HA VAL 26 HA VAL 26 -3.526 8.282 -0.705
229 HB VAL 26 HB VAL 26 -2.387 7.401 -3.328
230 1HG1 VAL 26 1HG1 VAL 26 -3.595 9.926 -2.237
231 2HG1 VAL 26 2HG1 VAL 26 -4.207 8.881 -3.519
232 3HG1 VAL 26 3HG1 VAL 26 -2.770 9.867 -3.795
233 1HG2 VAL 26 1HG2 VAL 26 -0.332 7.834 -2.395
234 2HG2 VAL 26 2HG2 VAL 26 -0.980 9.006 -1.248
235 3HG2 VAL 26 3HG2 VAL 26 -0.782 9.448 -2.944
236 H CYS 27 H CYS 27 -2.769 5.060 -1.490
237 HA CYS 27 HA CYS 27 -4.897 4.313 -3.083
238 1HB CYS 27 2HB CYS 27 -3.596 2.555 -3.041
239 2HB CYS 27 1HB CYS 27 -2.806 3.029 -1.565
240 H ARG 28 H ARG 28 -4.542 4.176 0.429
241 HA ARG 28 HA ARG 28 -7.200 3.259 0.700
242 1HB ARG 28 2HB ARG 28 -5.977 4.736 2.979
243 2HB ARG 28 1HB ARG 28 -6.901 3.242 2.983
244 1HG ARG 28 2HG ARG 28 -5.029 2.057 3.078
245 2HG ARG 28 1HG ARG 28 -4.451 2.798 1.597
246 1HD ARG 28 2HD ARG 28 -3.388 4.546 2.756
247 2HD ARG 28 1HD ARG 28 -4.278 4.216 4.237
248 HE ARG 28 HE ARG 28 -1.841 2.988 3.376
249 1HH1 ARG 28 1HH1 ARG 28 -4.734 2.507 5.276
250 2HH1 ARG 28 2HH1 ARG 28 -3.991 1.365 6.345
251 1HH2 ARG 28 1HH2 ARG 28 -0.866 1.490 4.796
252 2HH2 ARG 28 2HH2 ARG 28 -1.799 0.791 6.075
253 H LEU 29 H LEU 29 -5.781 6.358 0.263
254 HA LEU 29 HA LEU 29 -7.962 7.893 1.304
255 1HB LEU 29 2HB LEU 29 -5.475 8.447 -0.200
256 2HB LEU 29 1HB LEU 29 -6.760 9.633 -0.342
257 HG LEU 29 HG LEU 29 -5.672 8.693 2.307
258 1HD1 LEU 29 1HD1 LEU 29 -4.147 10.021 0.548
259 2HD1 LEU 29 2HD1 LEU 29 -4.059 10.279 2.291
260 3HD1 LEU 29 3HD1 LEU 29 -4.997 11.381 1.283
261 1HD2 LEU 29 1HD2 LEU 29 -6.995 10.280 3.282
262 2HD2 LEU 29 2HD2 LEU 29 -8.009 9.854 1.904
263 3HD2 LEU 29 3HD2 LEU 29 -7.013 11.307 1.847
264 H VAL 30 H VAL 30 -7.173 6.522 -1.792
265 HA VAL 30 HA VAL 30 -9.353 7.935 -3.117
266 HB VAL 30 HB VAL 30 -7.398 5.895 -4.213
267 1HG1 VAL 30 1HG1 VAL 30 -9.380 5.835 -5.547
268 2HG1 VAL 30 2HG1 VAL 30 -8.185 6.784 -6.429
269 3HG1 VAL 30 3HG1 VAL 30 -9.494 7.594 -5.569
270 1HG2 VAL 30 1HG2 VAL 30 -5.980 7.630 -4.055
271 2HG2 VAL 30 2HG2 VAL 30 -7.279 8.800 -3.818
272 3HG2 VAL 30 3HG2 VAL 30 -6.857 8.269 -5.445
273 H LEU 31 H LEU 31 -8.636 4.791 -1.831
274 HA LEU 31 HA LEU 31 -11.018 3.663 -3.045
275 1HB LEU 31 2HB LEU 31 -8.611 2.601 -1.791
276 2HB LEU 31 1HB LEU 31 -10.074 1.729 -1.362
277 HG LEU 31 HG LEU 31 -10.511 1.822 -3.944
278 1HD1 LEU 31 1HD1 LEU 31 -8.855 2.428 -5.282
279 2HD1 LEU 31 2HD1 LEU 31 -7.700 1.405 -4.428
280 3HD1 LEU 31 3HD1 LEU 31 -8.021 3.042 -3.855
281 1HD2 LEU 31 1HD2 LEU 31 -8.416 -0.110 -3.023
282 2HD2 LEU 31 2HD2 LEU 31 -9.776 -0.383 -4.108
283 3HD2 LEU 31 3HD2 LEU 31 -10.057 -0.163 -2.383
284 H ARG 32 H ARG 32 -10.344 5.420 -0.322
285 HA ARG 32 HA ARG 32 -12.261 4.128 1.427
286 1HB ARG 32 2HB ARG 32 -11.909 6.104 2.895
287 2HB ARG 32 1HB ARG 32 -10.414 5.274 2.493
288 1HG ARG 32 2HG ARG 32 -9.916 7.553 2.334
289 2HG ARG 32 1HG ARG 32 -10.111 7.010 0.673
290 1HD ARG 32 2HD ARG 32 -11.206 9.225 1.352
291 2HD ARG 32 1HD ARG 32 -12.173 8.070 0.436
292 HE ARG 32 HE ARG 32 -12.433 7.907 3.314
293 1HH1 ARG 32 1HH1 ARG 32 -13.684 9.273 0.354
294 2HH1 ARG 32 2HH1 ARG 32 -15.254 9.584 1.017
295 1HH2 ARG 32 1HH2 ARG 32 -14.495 8.321 4.185
296 2HH2 ARG 32 2HH2 ARG 32 -15.713 9.045 3.190
297 H CYS 33 H CYS 33 -12.417 5.931 -1.289
298 HA CYS 33 HA CYS 33 -14.199 7.945 -1.074
299 1HB CYS 33 2HB CYS 33 -14.461 7.728 -3.361
300 2HB CYS 33 1HB CYS 33 -13.009 6.781 -3.108
301 H SER 34 H SER 34 -16.554 7.860 -1.945
302 HA SER 34 HA SER 34 -18.733 7.332 -1.562
303 1HB SER 34 2HB SER 34 -17.976 5.164 -2.641
304 2HB SER 34 1HB SER 34 -17.803 4.510 -1.012
305 HG SER 34 HG SER 34 -19.875 4.223 -0.971
Start of MODEL 15
1 1H CYS 1 1HT CYS 1 -16.007 0.216 -3.431
2 2H CYS 1 2HT CYS 1 -16.093 0.052 -1.725
3 3H CYS 1 3HT CYS 1 -15.088 -0.995 -2.641
4 HA CYS 1 HA CYS 1 -13.638 0.722 -3.195
5 1HB CYS 1 2HB CYS 1 -15.945 2.354 -2.296
6 2HB CYS 1 1HB CYS 1 -14.355 3.000 -1.913
7 H TRP 2 H TRP 2 -13.164 -1.134 -1.490
8 HA TRP 2 HA TRP 2 -11.870 0.182 0.711
9 1HB TRP 2 2HB TRP 2 -12.969 -1.529 2.355
10 2HB TRP 2 1HB TRP 2 -13.790 -0.022 1.967
11 HD1 TRP 2 HD TRP 2 -13.857 -2.943 -0.499
12 HE1 TRP 2 1HE TRP 2 -16.268 -3.828 -0.661
13 HE3 TRP 2 3HE TRP 2 -15.977 -0.221 3.275
14 HZ2 TRP 2 2HZ TRP 2 -18.740 -3.432 0.644
15 HZ3 TRP 2 3HZ TRP 2 -18.367 -0.538 3.758
16 HH2 TRP 2 HH TRP 2 -19.721 -2.109 2.468
17 H LEU 3 H LEU 3 -11.307 -1.608 -1.636
18 HA LEU 3 HA LEU 3 -10.262 -4.038 -0.435
19 1HB LEU 3 2HB LEU 3 -9.955 -2.953 -3.236
20 2HB LEU 3 1HB LEU 3 -9.483 -4.555 -2.702
21 HG LEU 3 HG LEU 3 -12.305 -3.490 -2.820
22 1HD1 LEU 3 1HD1 LEU 3 -10.668 -5.242 -4.597
23 2HD1 LEU 3 2HD1 LEU 3 -11.772 -3.932 -5.017
24 3HD1 LEU 3 3HD1 LEU 3 -12.410 -5.487 -4.483
25 1HD2 LEU 3 1HD2 LEU 3 -12.667 -6.081 -2.474
26 2HD2 LEU 3 2HD2 LEU 3 -12.477 -4.987 -1.103
27 3HD2 LEU 3 3HD2 LEU 3 -11.108 -5.950 -1.657
28 H CYS 4 H CYS 4 -9.306 -0.937 -0.407
29 HA CYS 4 HA CYS 4 -6.706 -0.819 -1.225
30 1HB CYS 4 2HB CYS 4 -8.438 0.720 0.412
31 2HB CYS 4 1HB CYS 4 -6.859 0.631 1.194
32 H ARG 5 H ARG 5 -7.527 -1.182 2.202
33 HA ARG 5 HA ARG 5 -5.280 -1.824 3.417
34 1HB ARG 5 2HB ARG 5 -6.682 -3.841 4.490
35 2HB ARG 5 1HB ARG 5 -6.999 -2.153 4.868
36 1HG ARG 5 2HG ARG 5 -8.985 -2.144 3.796
37 2HG ARG 5 1HG ARG 5 -8.427 -3.235 2.526
38 1HD ARG 5 2HD ARG 5 -8.681 -5.136 3.970
39 2HD ARG 5 1HD ARG 5 -9.043 -4.097 5.348
40 HE ARG 5 HE ARG 5 -10.971 -3.459 3.557
41 1HH1 ARG 5 1HH1 ARG 5 -9.849 -6.479 4.895
42 2HH1 ARG 5 2HH1 ARG 5 -11.400 -7.244 4.791
43 1HH2 ARG 5 1HH2 ARG 5 -13.011 -4.463 3.419
44 2HH2 ARG 5 2HH2 ARG 5 -13.195 -6.099 3.954
45 H ALA 6 H ALA 6 -6.884 -3.932 1.126
46 HA ALA 6 HA ALA 6 -5.208 -6.176 1.468
47 1HB ALA 6 1HB ALA 6 -7.472 -5.570 -0.030
48 2HB ALA 6 2HB ALA 6 -6.606 -7.106 0.004
49 3HB ALA 6 3HB ALA 6 -6.221 -5.903 -1.227
50 H LEU 7 H LEU 7 -5.292 -3.991 -1.389
51 HA LEU 7 HA LEU 7 -2.798 -4.802 -2.323
52 1HB LEU 7 2HB LEU 7 -3.035 -3.315 -4.021
53 2HB LEU 7 1HB LEU 7 -4.695 -3.424 -3.484
54 HG LEU 7 HG LEU 7 -4.188 -1.135 -3.970
55 1HD1 LEU 7 1HD1 LEU 7 -4.066 -1.086 -1.014
56 2HD1 LEU 7 2HD1 LEU 7 -5.419 -1.909 -1.792
57 3HD1 LEU 7 3HD1 LEU 7 -5.112 -0.207 -2.131
58 1HD2 LEU 7 1HD2 LEU 7 -2.236 -0.691 -1.848
59 2HD2 LEU 7 2HD2 LEU 7 -2.283 -0.070 -3.499
60 3HD2 LEU 7 3HD2 LEU 7 -1.630 -1.678 -3.178
61 H ILE 8 H ILE 8 -3.503 -2.687 0.308
62 HA ILE 8 HA ILE 8 -1.117 -1.229 0.078
63 HB ILE 8 HB ILE 8 -1.378 -0.460 2.334
64 1HG1 ILE 8 2HG1 ILE 8 -3.622 -1.522 3.433
65 2HG1 ILE 8 1HG1 ILE 8 -2.947 -2.923 2.613
66 1HG2 ILE 8 1HG2 ILE 8 -4.204 -0.611 1.384
67 2HG2 ILE 8 2HG2 ILE 8 -2.988 0.219 0.411
68 3HG2 ILE 8 3HG2 ILE 8 -3.315 0.755 2.059
69 1HD1 ILE 8 1HD1 ILE 8 -2.301 -2.395 5.074
70 2HD1 ILE 8 2HD1 ILE 8 -1.182 -1.256 4.325
71 3HD1 ILE 8 3HD1 ILE 8 -1.082 -2.974 3.938
72 H LYS 9 H LYS 9 -2.039 -4.225 1.558
73 HA LYS 9 HA LYS 9 0.408 -4.751 2.859
74 1HB LYS 9 2HB LYS 9 -0.711 -6.580 3.504
75 2HB LYS 9 1HB LYS 9 -2.006 -6.076 2.446
76 1HG LYS 9 2HG LYS 9 0.138 -7.500 1.060
77 2HG LYS 9 1HG LYS 9 -0.688 -8.454 2.278
78 1HD LYS 9 2HD LYS 9 -2.061 -8.882 0.523
79 2HD LYS 9 1HD LYS 9 -2.825 -7.402 1.098
80 1HE LYS 9 2HE LYS 9 -1.803 -6.091 -0.591
81 2HE LYS 9 1HE LYS 9 -0.655 -7.374 -0.983
82 1HZ LYS 9 1HZ LYS 9 -2.846 -6.924 -2.394
83 2HZ LYS 9 2HZ LYS 9 -3.475 -8.033 -1.285
84 3HZ LYS 9 3HZ LYS 9 -2.157 -8.463 -2.250
85 H ARG 10 H ARG 10 -0.723 -4.958 -0.394
86 HA ARG 10 HA ARG 10 1.253 -6.612 -1.483
87 1HB ARG 10 2HB ARG 10 -0.823 -4.896 -2.488
88 2HB ARG 10 1HB ARG 10 0.653 -4.599 -3.396
89 1HG ARG 10 2HG ARG 10 -0.902 -7.140 -3.119
90 2HG ARG 10 1HG ARG 10 -0.472 -6.259 -4.583
91 1HD ARG 10 2HD ARG 10 1.274 -7.625 -4.797
92 2HD ARG 10 1HD ARG 10 1.959 -6.876 -3.357
93 HE ARG 10 HE ARG 10 0.124 -8.919 -2.652
94 1HH1 ARG 10 1HH1 ARG 10 3.359 -8.399 -3.855
95 2HH1 ARG 10 2HH1 ARG 10 3.964 -9.903 -3.247
96 1HH2 ARG 10 1HH2 ARG 10 0.916 -10.908 -1.860
97 2HH2 ARG 10 2HH2 ARG 10 2.577 -11.329 -2.117
98 H ILE 11 H ILE 11 1.153 -3.359 -0.410
99 HA ILE 11 HA ILE 11 3.626 -2.587 -1.597
100 HB ILE 11 HB ILE 11 2.123 -1.363 0.717
101 1HG1 ILE 11 2HG1 ILE 11 0.862 -1.038 -1.267
102 2HG1 ILE 11 1HG1 ILE 11 1.753 0.461 -1.039
103 1HG2 ILE 11 1HG2 ILE 11 3.641 0.424 0.728
104 2HG2 ILE 11 2HG2 ILE 11 4.382 -0.089 -0.788
105 3HG2 ILE 11 3HG2 ILE 11 4.641 -1.029 0.682
106 1HD1 ILE 11 1HD1 ILE 11 3.413 -0.320 -2.682
107 2HD1 ILE 11 2HD1 ILE 11 1.791 -0.151 -3.351
108 3HD1 ILE 11 3HD1 ILE 11 2.420 -1.751 -2.959
109 H GLN 12 H GLN 12 2.596 -4.084 1.426
110 HA GLN 12 HA GLN 12 5.063 -3.869 2.779
111 1HB GLN 12 2HB GLN 12 4.218 -5.371 4.330
112 2HB GLN 12 1HB GLN 12 2.735 -4.742 3.632
113 1HG GLN 12 2HG GLN 12 2.101 -6.795 3.142
114 2HG GLN 12 1HG GLN 12 3.499 -6.987 2.090
115 1HE2 GLN 12 1HE2 GLN 12 5.535 -7.619 3.179
116 2HE2 GLN 12 2HE2 GLN 12 5.437 -8.739 4.492
117 H ALA 13 H ALA 13 3.958 -5.693 0.113
118 HA ALA 13 HA ALA 13 6.114 -7.586 0.189
119 1HB ALA 13 1HB ALA 13 4.760 -8.777 -1.116
120 2HB ALA 13 2HB ALA 13 4.861 -7.537 -2.365
121 3HB ALA 13 3HB ALA 13 3.610 -7.441 -1.125
122 H MET 14 H MET 14 5.419 -4.485 -1.135
123 HA MET 14 HA MET 14 7.164 -4.323 -3.278
124 1HB MET 14 2HB MET 14 7.122 -1.978 -3.039
125 2HB MET 14 1HB MET 14 5.584 -2.499 -2.370
126 1HG MET 14 2HG MET 14 6.078 -1.262 -0.601
127 2HG MET 14 1HG MET 14 7.264 -2.486 -0.181
128 1HE MET 14 1HE MET 14 7.340 0.995 0.449
129 2HE MET 14 2HE MET 14 9.080 0.821 0.679
130 3HE MET 14 3HE MET 14 7.983 -0.432 1.261
131 H ILE 15 H ILE 15 7.694 -4.311 0.161
132 HA ILE 15 HA ILE 15 9.626 -5.245 1.136
133 HB ILE 15 HB ILE 15 11.806 -5.144 0.316
134 1HG1 ILE 15 2HG1 ILE 15 12.639 -3.336 -0.692
135 2HG1 ILE 15 1HG1 ILE 15 11.853 -3.864 -2.165
136 1HG2 ILE 15 1HG2 ILE 15 10.991 -5.590 -2.345
137 2HG2 ILE 15 2HG2 ILE 15 9.716 -6.161 -1.267
138 3HG2 ILE 15 3HG2 ILE 15 11.363 -6.760 -1.082
139 1HD1 ILE 15 1HD1 ILE 15 10.930 -1.843 -2.141
140 2HD1 ILE 15 2HD1 ILE 15 11.274 -1.595 -0.431
141 3HD1 ILE 15 3HD1 ILE 15 9.853 -2.498 -0.922
142 HA PRO 16 HA PRO 16 10.491 -1.632 3.479
143 1HB PRO 16 2HB PRO 16 12.301 -2.569 5.192
144 2HB PRO 16 1HB PRO 16 10.667 -3.244 5.136
145 1HG PRO 16 2HG PRO 16 13.217 -4.356 4.070
146 2HG PRO 16 1HG PRO 16 11.834 -5.202 4.783
147 1HD PRO 16 2HD PRO 16 12.364 -4.890 2.035
148 2HD PRO 16 1HD PRO 16 10.849 -5.453 2.756
149 H LYS 17 H LYS 17 13.534 -3.241 2.490
150 HA LYS 17 HA LYS 17 15.111 -0.891 2.805
151 1HB LYS 17 2HB LYS 17 15.734 -3.450 1.326
152 2HB LYS 17 1HB LYS 17 16.901 -2.209 1.760
153 1HG LYS 17 2HG LYS 17 16.054 -2.651 4.181
154 2HG LYS 17 1HG LYS 17 15.497 -4.180 3.497
155 1HD LYS 17 2HD LYS 17 17.558 -4.969 3.799
156 2HD LYS 17 1HD LYS 17 18.096 -3.862 2.534
157 1HE LYS 17 2HE LYS 17 19.089 -2.479 4.000
158 2HE LYS 17 1HE LYS 17 17.779 -2.623 5.171
159 1HZ LYS 17 1HZ LYS 17 18.679 -4.654 5.972
160 2HZ LYS 17 2HZ LYS 17 19.946 -3.535 5.926
161 3HZ LYS 17 3HZ LYS 17 19.825 -4.725 4.730
162 H GLY 18 H GLY 18 13.023 -1.904 0.323
163 1HA GLY 18 2HA GLY 18 14.353 -1.013 -1.975
164 2HA GLY 18 1HA GLY 18 12.613 -1.062 -1.784
165 H GLY 19 H GLY 19 11.554 0.842 -1.838
166 1HA GLY 19 2HA GLY 19 12.506 3.171 -0.584
167 2HA GLY 19 1HA GLY 19 12.934 3.237 -2.281
168 H ARG 20 H ARG 20 9.922 1.716 -1.245
169 HA ARG 20 HA ARG 20 8.541 4.026 -2.439
170 1HB ARG 20 2HB ARG 20 7.442 1.228 -2.283
171 2HB ARG 20 1HB ARG 20 6.737 2.591 -3.116
172 1HG ARG 20 2HG ARG 20 9.289 1.176 -3.830
173 2HG ARG 20 1HG ARG 20 7.758 1.131 -4.709
174 1HD ARG 20 2HD ARG 20 8.552 2.822 -5.926
175 2HD ARG 20 1HD ARG 20 8.312 3.831 -4.500
176 HE ARG 20 HE ARG 20 10.831 2.440 -4.545
177 1HH1 ARG 20 1HH1 ARG 20 9.132 5.320 -5.545
178 2HH1 ARG 20 2HH1 ARG 20 10.568 6.282 -5.646
179 1HH2 ARG 20 1HH2 ARG 20 12.717 3.700 -4.673
180 2HH2 ARG 20 2HH2 ARG 20 12.606 5.362 -5.150
181 H MET 21 H MET 21 6.062 3.754 -1.778
182 HA MET 21 HA MET 21 4.716 3.213 0.318
183 1HB MET 21 2HB MET 21 5.315 4.631 2.257
184 2HB MET 21 1HB MET 21 6.599 3.485 1.898
185 1HG MET 21 2HG MET 21 7.521 5.515 0.475
186 2HG MET 21 1HG MET 21 6.542 6.441 1.609
187 1HE MET 21 1HE MET 21 7.910 5.495 5.020
188 2HE MET 21 2HE MET 21 6.492 5.877 4.044
189 3HE MET 21 3HE MET 21 7.772 7.072 4.247
190 H LEU 22 H LEU 22 2.959 4.225 -0.584
191 HA LEU 22 HA LEU 22 2.422 6.923 -0.411
192 1HB LEU 22 2HB LEU 22 4.277 7.508 -1.691
193 2HB LEU 22 1HB LEU 22 4.078 6.158 -2.778
194 HG LEU 22 HG LEU 22 3.639 8.555 -3.625
195 1HD1 LEU 22 1HD1 LEU 22 3.080 7.190 -5.289
196 2HD1 LEU 22 2HD1 LEU 22 1.415 7.405 -4.744
197 3HD1 LEU 22 3HD1 LEU 22 2.349 6.012 -4.198
198 1HD2 LEU 22 1HD2 LEU 22 1.660 8.400 -1.598
199 2HD2 LEU 22 2HD2 LEU 22 0.847 8.454 -3.162
200 3HD2 LEU 22 3HD2 LEU 22 1.989 9.720 -2.720
201 HA PRO 23 HA PRO 23 -0.430 5.012 -3.710
202 1HB PRO 23 2HB PRO 23 0.228 2.306 -4.291
203 2HB PRO 23 1HB PRO 23 0.418 3.728 -5.315
204 1HG PRO 23 2HG PRO 23 2.515 2.247 -4.288
205 2HG PRO 23 1HG PRO 23 2.637 3.930 -4.835
206 1HD PRO 23 2HD PRO 23 2.226 2.875 -2.052
207 2HD PRO 23 1HD PRO 23 3.329 4.157 -2.613
208 H GLN 24 H GLN 24 0.602 3.125 -1.018
209 HA GLN 24 HA GLN 24 -1.982 1.761 -0.767
210 1HB GLN 24 2HB GLN 24 -0.931 0.775 1.300
211 2HB GLN 24 1HB GLN 24 -0.166 0.316 -0.211
212 1HG GLN 24 2HG GLN 24 1.774 1.042 0.573
213 2HG GLN 24 1HG GLN 24 1.115 2.664 0.730
214 1HE2 GLN 24 1HE2 GLN 24 3.004 2.048 2.433
215 2HE2 GLN 24 2HE2 GLN 24 2.376 1.741 4.012
216 H LEU 25 H LEU 25 -0.238 4.497 0.437
217 HA LEU 25 HA LEU 25 -2.155 4.928 2.568
218 1HB LEU 25 2HB LEU 25 -0.122 6.961 1.772
219 2HB LEU 25 1HB LEU 25 -0.897 6.714 3.325
220 HG LEU 25 HG LEU 25 1.282 6.025 3.693
221 1HD1 LEU 25 1HD1 LEU 25 1.197 3.575 3.935
222 2HD1 LEU 25 2HD1 LEU 25 -0.283 3.555 2.978
223 3HD1 LEU 25 3HD1 LEU 25 -0.250 4.380 4.537
224 1HD2 LEU 25 1HD2 LEU 25 1.269 5.438 0.886
225 2HD2 LEU 25 2HD2 LEU 25 1.930 4.077 1.792
226 3HD2 LEU 25 3HD2 LEU 25 2.631 5.682 1.977
227 H VAL 26 H VAL 26 -1.313 6.162 -0.575
228 HA VAL 26 HA VAL 26 -3.360 8.208 -0.522
229 HB VAL 26 HB VAL 26 -1.679 7.118 -2.786
230 1HG1 VAL 26 1HG1 VAL 26 -3.782 9.274 -2.830
231 2HG1 VAL 26 2HG1 VAL 26 -3.752 7.784 -3.773
232 3HG1 VAL 26 3HG1 VAL 26 -2.575 9.057 -4.097
233 1HG2 VAL 26 1HG2 VAL 26 -1.639 9.732 -1.289
234 2HG2 VAL 26 2HG2 VAL 26 -0.687 9.400 -2.735
235 3HG2 VAL 26 3HG2 VAL 26 -0.406 8.474 -1.260
236 H CYS 27 H CYS 27 -2.794 4.958 -1.483
237 HA CYS 27 HA CYS 27 -4.935 4.306 -3.040
238 1HB CYS 27 2HB CYS 27 -4.051 2.303 -2.728
239 2HB CYS 27 1HB CYS 27 -2.980 2.989 -1.539
240 H ARG 28 H ARG 28 -4.747 4.277 0.455
241 HA ARG 28 HA ARG 28 -7.465 3.699 0.823
242 1HB ARG 28 2HB ARG 28 -5.929 5.219 2.891
243 2HB ARG 28 1HB ARG 28 -7.110 3.936 3.114
244 1HG ARG 28 2HG ARG 28 -5.523 2.335 3.061
245 2HG ARG 28 1HG ARG 28 -4.735 3.053 1.691
246 1HD ARG 28 2HD ARG 28 -3.091 3.536 3.121
247 2HD ARG 28 1HD ARG 28 -4.130 4.853 3.644
248 HE ARG 28 HE ARG 28 -3.330 2.589 5.137
249 1HH1 ARG 28 1HH1 ARG 28 -5.965 4.838 4.732
250 2HH1 ARG 28 2HH1 ARG 28 -6.637 4.528 6.292
251 1HH2 ARG 28 1HH2 ARG 28 -4.204 2.197 7.201
252 2HH2 ARG 28 2HH2 ARG 28 -5.636 3.036 7.697
253 H LEU 29 H LEU 29 -5.721 6.621 0.233
254 HA LEU 29 HA LEU 29 -7.766 8.398 1.098
255 1HB LEU 29 2HB LEU 29 -5.262 8.634 -0.474
256 2HB LEU 29 1HB LEU 29 -6.446 9.911 -0.671
257 HG LEU 29 HG LEU 29 -5.229 9.058 1.957
258 1HD1 LEU 29 1HD1 LEU 29 -3.491 10.124 0.854
259 2HD1 LEU 29 2HD1 LEU 29 -4.255 11.442 1.740
260 3HD1 LEU 29 3HD1 LEU 29 -4.570 11.241 0.016
261 1HD2 LEU 29 1HD2 LEU 29 -6.252 11.473 2.437
262 2HD2 LEU 29 2HD2 LEU 29 -7.175 9.989 2.668
263 3HD2 LEU 29 3HD2 LEU 29 -7.388 10.939 1.198
264 H VAL 30 H VAL 30 -7.036 6.778 -1.898
265 HA VAL 30 HA VAL 30 -9.187 8.147 -3.306
266 HB VAL 30 HB VAL 30 -7.348 5.986 -4.324
267 1HG1 VAL 30 1HG1 VAL 30 -9.006 5.950 -5.882
268 2HG1 VAL 30 2HG1 VAL 30 -8.082 7.312 -6.516
269 3HG1 VAL 30 3HG1 VAL 30 -9.520 7.602 -5.537
270 1HG2 VAL 30 1HG2 VAL 30 -7.069 8.947 -4.145
271 2HG2 VAL 30 2HG2 VAL 30 -6.418 8.120 -5.560
272 3HG2 VAL 30 3HG2 VAL 30 -5.855 7.682 -3.947
273 H LEU 31 H LEU 31 -8.356 4.837 -2.452
274 HA LEU 31 HA LEU 31 -10.756 3.736 -3.456
275 1HB LEU 31 2HB LEU 31 -8.399 2.666 -2.665
276 2HB LEU 31 1HB LEU 31 -9.425 2.230 -1.309
277 HG LEU 31 HG LEU 31 -10.974 1.091 -2.816
278 1HD1 LEU 31 1HD1 LEU 31 -9.251 2.351 -4.875
279 2HD1 LEU 31 2HD1 LEU 31 -10.996 2.100 -4.853
280 3HD1 LEU 31 3HD1 LEU 31 -9.916 0.754 -5.220
281 1HD2 LEU 31 1HD2 LEU 31 -8.881 -0.383 -3.893
282 2HD2 LEU 31 2HD2 LEU 31 -9.674 -0.649 -2.342
283 3HD2 LEU 31 3HD2 LEU 31 -8.210 0.328 -2.427
284 H ARG 32 H ARG 32 -10.077 5.422 -0.554
285 HA ARG 32 HA ARG 32 -11.879 4.294 1.242
286 1HB ARG 32 2HB ARG 32 -10.575 6.038 2.123
287 2HB ARG 32 1HB ARG 32 -10.949 7.119 0.789
288 1HG ARG 32 2HG ARG 32 -13.073 6.247 2.715
289 2HG ARG 32 1HG ARG 32 -11.991 7.589 3.089
290 1HD ARG 32 2HD ARG 32 -12.878 8.055 0.479
291 2HD ARG 32 1HD ARG 32 -14.303 7.516 1.364
292 HE ARG 32 HE ARG 32 -12.889 9.992 1.690
293 1HH1 ARG 32 1HH1 ARG 32 -14.997 7.675 3.229
294 2HH1 ARG 32 2HH1 ARG 32 -15.639 8.819 4.359
295 1HH2 ARG 32 1HH2 ARG 32 -13.732 11.500 3.179
296 2HH2 ARG 32 2HH2 ARG 32 -14.921 10.991 4.331
297 H CYS 33 H CYS 33 -12.307 6.206 -1.576
298 HA CYS 33 HA CYS 33 -14.460 7.429 -1.961
299 1HB CYS 33 2HB CYS 33 -13.996 6.726 -4.034
300 2HB CYS 33 1HB CYS 33 -13.273 5.249 -3.425
301 H SER 34 H SER 34 -16.421 7.594 -1.130
302 HA SER 34 HA SER 34 -18.327 5.538 -1.103
303 1HB SER 34 2HB SER 34 -17.084 4.545 0.706
304 2HB SER 34 1HB SER 34 -16.993 6.088 1.556
305 HG SER 34 HG SER 34 -19.407 4.720 0.961