Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
11530 | 1rmk RC | 6135 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ALA 1 1HT ALA 1 2.633 -11.606 -0.105
2 2H ALA 1 2HT ALA 1 1.772 -10.170 0.132
3 3H ALA 1 3HT ALA 1 3.136 -10.501 1.078
4 HA ALA 1 HA ALA 1 4.581 -10.288 -0.779
5 1HB ALA 1 1HB ALA 1 3.827 -9.892 -2.998
6 2HB ALA 1 2HB ALA 1 2.160 -9.675 -2.463
7 3HB ALA 1 3HB ALA 1 2.909 -11.270 -2.391
8 H CYS 2 H CYS 2 5.466 -8.263 -1.226
9 HA CYS 2 HA CYS 2 4.154 -6.051 0.145
10 1HB CYS 2 2HB CYS 2 6.291 -4.935 -0.020
11 2HB CYS 2 1HB CYS 2 6.518 -6.552 0.619
12 H SER 3 H SER 3 3.257 -4.368 -0.808
13 HA SER 3 HA SER 3 2.831 -4.407 -3.636
14 1HB SER 3 2HB SER 3 2.047 -2.327 -1.582
15 2HB SER 3 1HB SER 3 1.413 -2.453 -3.222
16 HG SER 3 HG SER 3 0.134 -4.002 -2.603
17 H LYS 4 H LYS 4 3.534 -2.988 -5.175
18 HA LYS 4 HA LYS 4 6.056 -1.678 -4.647
19 1HB LYS 4 2HB LYS 4 4.408 -1.730 -7.186
20 2HB LYS 4 1HB LYS 4 6.101 -1.265 -7.046
21 1HG LYS 4 2HG LYS 4 6.798 -3.449 -6.650
22 2HG LYS 4 1HG LYS 4 5.178 -3.984 -6.204
23 1HD LYS 4 2HD LYS 4 4.586 -3.358 -8.658
24 2HD LYS 4 1HD LYS 4 6.331 -3.478 -8.916
25 1HE LYS 4 2HE LYS 4 5.202 -5.597 -9.405
26 2HE LYS 4 1HE LYS 4 6.318 -5.754 -8.048
27 1HZ LYS 4 1HZ LYS 4 4.253 -6.864 -7.550
28 2HZ LYS 4 2HZ LYS 4 3.357 -5.461 -7.873
29 3HZ LYS 4 3HZ LYS 4 4.404 -5.513 -6.544
30 H LYS 5 H LYS 5 6.446 0.567 -5.009
31 HA LYS 5 HA LYS 5 4.803 2.263 -3.687
32 1HB LYS 5 2HB LYS 5 7.065 2.895 -4.111
33 2HB LYS 5 1HB LYS 5 6.786 2.932 -5.848
34 1HG LYS 5 2HG LYS 5 5.716 4.949 -5.771
35 2HG LYS 5 1HG LYS 5 5.142 4.703 -4.137
36 1HD LYS 5 2HD LYS 5 7.387 5.101 -3.276
37 2HD LYS 5 1HD LYS 5 7.982 5.316 -4.926
38 1HE LYS 5 2HE LYS 5 6.917 7.339 -5.194
39 2HE LYS 5 1HE LYS 5 5.693 6.977 -3.979
40 1HZ LYS 5 1HZ LYS 5 8.541 7.651 -3.465
41 2HZ LYS 5 2HZ LYS 5 7.436 7.184 -2.266
42 3HZ LYS 5 3HZ LYS 5 7.199 8.624 -3.130
43 H TRP 6 H TRP 6 5.091 2.697 -7.195
44 HA TRP 6 HA TRP 6 2.545 4.029 -7.131
45 1HB TRP 6 2HB TRP 6 4.100 3.378 -9.630
46 2HB TRP 6 1HB TRP 6 2.991 4.715 -9.343
47 HD1 TRP 6 HD TRP 6 6.582 3.600 -8.594
48 HE1 TRP 6 1HE TRP 6 7.978 5.660 -7.959
49 HE3 TRP 6 3HE TRP 6 2.834 7.053 -8.275
50 HZ2 TRP 6 2HZ TRP 6 7.546 8.385 -7.377
51 HZ3 TRP 6 3HZ TRP 6 3.405 9.362 -7.665
52 HH2 TRP 6 HH TRP 6 5.715 10.014 -7.218
53 H GLU 7 H GLU 7 2.545 1.257 -6.390
54 HA GLU 7 HA GLU 7 1.177 0.025 -8.698
55 1HB GLU 7 2HB GLU 7 2.928 -1.186 -7.172
56 2HB GLU 7 1HB GLU 7 1.560 -1.398 -6.089
57 1HG GLU 7 2HG GLU 7 0.332 -2.563 -7.835
58 2HG GLU 7 1HG GLU 7 1.667 -2.314 -8.957
59 H TYR 8 H TYR 8 -0.103 -1.476 -6.098
60 HA TYR 8 HA TYR 8 -2.240 0.466 -5.653
61 1HB TYR 8 2HB TYR 8 -3.039 -0.853 -7.535
62 2HB TYR 8 1HB TYR 8 -2.670 -2.349 -6.684
63 HD1 TYR 8 1HD TYR 8 -4.520 -3.471 -5.908
64 HD2 TYR 8 2HD TYR 8 -4.596 0.782 -5.946
65 HE1 TYR 8 1HE TYR 8 -6.796 -3.509 -4.977
66 HE2 TYR 8 2HE TYR 8 -6.870 0.756 -5.012
67 HH TYR 8 HH TYR 8 -8.883 -1.453 -5.126
68 H CYS 9 H CYS 9 -2.925 0.474 -3.606
69 HA CYS 9 HA CYS 9 -2.982 -1.852 -1.963
70 1HB CYS 9 2HB CYS 9 -0.557 -1.358 -1.849
71 2HB CYS 9 1HB CYS 9 -0.928 0.258 -1.253
72 H ILE 10 H ILE 10 -4.667 -1.594 -0.698
73 HA ILE 10 HA ILE 10 -5.526 1.132 -0.014
74 HB ILE 10 HB ILE 10 -7.161 -0.138 -1.341
75 1HG1 ILE 10 2HG1 ILE 10 -8.053 0.226 1.529
76 2HG1 ILE 10 1HG1 ILE 10 -7.944 1.509 0.328
77 1HG2 ILE 10 1HG2 ILE 10 -6.552 -2.390 -0.680
78 2HG2 ILE 10 2HG2 ILE 10 -8.272 -2.114 -0.410
79 3HG2 ILE 10 3HG2 ILE 10 -7.152 -2.094 0.952
80 1HD1 ILE 10 1HD1 ILE 10 -9.869 0.916 -0.666
81 2HD1 ILE 10 2HD1 ILE 10 -10.198 0.168 0.898
82 3HD1 ILE 10 3HD1 ILE 10 -9.584 -0.809 -0.435
83 H VAL 11 H VAL 11 -5.995 1.626 2.153
84 HA VAL 11 HA VAL 11 -5.138 -0.425 4.079
85 HB VAL 11 HB VAL 11 -4.416 1.535 5.536
86 1HG1 VAL 11 1HG1 VAL 11 -3.082 0.018 3.676
87 2HG1 VAL 11 2HG1 VAL 11 -2.334 1.056 4.890
88 3HG1 VAL 11 3HG1 VAL 11 -2.607 1.665 3.257
89 1HG2 VAL 11 1HG2 VAL 11 -3.777 3.586 4.312
90 2HG2 VAL 11 2HG2 VAL 11 -5.523 3.336 4.347
91 3HG2 VAL 11 3HG2 VAL 11 -4.608 2.968 2.884
92 HA PRO 12 HA PRO 12 -9.472 0.934 5.241
93 1HB PRO 12 2HB PRO 12 -10.003 -1.937 5.425
94 2HB PRO 12 1HB PRO 12 -10.863 -0.704 4.502
95 1HG PRO 12 2HG PRO 12 -9.353 -2.606 3.321
96 2HG PRO 12 1HG PRO 12 -9.532 -0.976 2.648
97 1HD PRO 12 2HD PRO 12 -7.268 -2.135 4.231
98 2HD PRO 12 1HD PRO 12 -7.219 -1.076 2.804
99 H ILE 13 H ILE 13 -10.001 1.182 7.340
100 HA ILE 13 HA ILE 13 -8.258 0.260 9.375
101 HB ILE 13 HB ILE 13 -9.979 1.298 10.936
102 1HG1 ILE 13 2HG1 ILE 13 -11.173 2.212 8.304
103 2HG1 ILE 13 1HG1 ILE 13 -11.917 1.057 9.403
104 1HG2 ILE 13 1HG2 ILE 13 -8.423 2.875 10.718
105 2HG2 ILE 13 2HG2 ILE 13 -9.484 3.621 9.524
106 3HG2 ILE 13 3HG2 ILE 13 -8.201 2.529 9.003
107 1HD1 ILE 13 1HD1 ILE 13 -12.973 2.809 10.267
108 2HD1 ILE 13 2HD1 ILE 13 -11.890 3.956 9.480
109 3HD1 ILE 13 3HD1 ILE 13 -11.434 3.225 11.019
110 H LEU 14 H LEU 14 -8.602 -2.015 8.702
111 HA LEU 14 HA LEU 14 -9.957 -3.449 10.716
112 1HB LEU 14 2HB LEU 14 -11.823 -2.727 9.034
113 2HB LEU 14 1HB LEU 14 -11.120 -3.933 7.978
114 HG LEU 14 HG LEU 14 -13.150 -4.641 9.319
115 1HD1 LEU 14 1HD1 LEU 14 -10.623 -6.252 9.621
116 2HD1 LEU 14 2HD1 LEU 14 -11.726 -6.278 8.246
117 3HD1 LEU 14 3HD1 LEU 14 -12.263 -6.871 9.818
118 1HD2 LEU 14 1HD2 LEU 14 -11.164 -4.728 11.582
119 2HD2 LEU 14 2HD2 LEU 14 -12.843 -5.262 11.626
120 3HD2 LEU 14 3HD2 LEU 14 -12.468 -3.551 11.423
121 H GLY 15 H GLY 15 -8.448 -3.226 7.601
122 1HA GLY 15 2HA GLY 15 -6.435 -5.105 8.151
123 2HA GLY 15 1HA GLY 15 -7.683 -5.899 7.192
124 H PHE 16 H PHE 16 -4.803 -4.784 6.708
125 HA PHE 16 HA PHE 16 -5.448 -3.776 4.057
126 1HB PHE 16 2HB PHE 16 -3.707 -1.924 4.398
127 2HB PHE 16 1HB PHE 16 -5.286 -1.700 5.135
128 HD1 PHE 16 1HD PHE 16 -5.298 -0.823 7.233
129 HD2 PHE 16 2HD PHE 16 -1.993 -3.234 6.057
130 HE1 PHE 16 1HE PHE 16 -4.233 -0.419 9.412
131 HE2 PHE 16 2HE PHE 16 -0.925 -2.838 8.237
132 HZ PHE 16 HZ PHE 16 -2.044 -1.429 9.918
133 H VAL 17 H VAL 17 -3.480 -3.534 2.696
134 HA VAL 17 HA VAL 17 -1.858 -5.911 2.951
135 HB VAL 17 HB VAL 17 -1.353 -3.865 0.830
136 1HG1 VAL 17 1HG1 VAL 17 -0.645 -6.556 1.292
137 2HG1 VAL 17 2HG1 VAL 17 -0.249 -5.549 -0.100
138 3HG1 VAL 17 3HG1 VAL 17 -1.710 -6.536 -0.115
139 1HG2 VAL 17 1HG2 VAL 17 -3.444 -5.661 -0.001
140 2HG2 VAL 17 2HG2 VAL 17 -3.384 -3.900 -0.072
141 3HG2 VAL 17 3HG2 VAL 17 -3.961 -4.704 1.387
142 H TYR 18 H TYR 18 0.560 -5.187 1.908
143 HA TYR 18 HA TYR 18 1.632 -3.005 3.487
144 1HB TYR 18 2HB TYR 18 3.352 -4.418 4.556
145 2HB TYR 18 1HB TYR 18 1.729 -4.866 5.063
146 HD1 TYR 18 1HD TYR 18 4.689 -5.917 3.166
147 HD2 TYR 18 2HD TYR 18 0.775 -7.011 4.430
148 HE1 TYR 18 1HE TYR 18 5.136 -8.246 2.520
149 HE2 TYR 18 2HE TYR 18 1.215 -9.344 3.788
150 HH TYR 18 HH TYR 18 3.743 -10.738 3.523
151 H CYS 19 H CYS 19 3.329 -2.056 2.554
152 HA CYS 19 HA CYS 19 4.117 -2.937 -0.084
153 1HB CYS 19 2HB CYS 19 4.711 -0.548 1.609
154 2HB CYS 19 1HB CYS 19 5.535 -0.794 0.075
155 H CYS 20 H CYS 20 6.519 -2.666 -0.631
156 HA CYS 20 HA CYS 20 7.993 -4.571 0.886
157 1HB CYS 20 2HB CYS 20 9.113 -2.630 -1.138
158 2HB CYS 20 1HB CYS 20 9.778 -4.187 -0.672
159 HA PRO 21 HA PRO 21 9.846 -2.159 4.046
160 1HB PRO 21 2HB PRO 21 12.497 -3.094 3.074
161 2HB PRO 21 1HB PRO 21 11.796 -3.127 4.697
162 1HG PRO 21 2HG PRO 21 11.927 -5.355 3.226
163 2HG PRO 21 1HG PRO 21 10.518 -5.020 4.251
164 1HD PRO 21 2HD PRO 21 10.807 -4.773 1.287
165 2HD PRO 21 1HD PRO 21 9.398 -5.270 2.241
166 H GLY 22 H GLY 22 9.791 -0.112 3.787
167 1HA GLY 22 2HA GLY 22 11.306 1.839 3.445
168 2HA GLY 22 1HA GLY 22 11.595 1.177 1.843
169 H LEU 23 H LEU 23 8.775 0.389 1.479
170 HA LEU 23 HA LEU 23 7.730 3.066 0.873
171 1HB LEU 23 2HB LEU 23 6.965 0.392 -0.300
172 2HB LEU 23 1HB LEU 23 6.407 1.962 -0.845
173 HG LEU 23 HG LEU 23 9.286 1.063 -0.954
174 1HD1 LEU 23 1HD1 LEU 23 8.596 -0.233 -2.640
175 2HD1 LEU 23 2HD1 LEU 23 8.418 1.277 -3.533
176 3HD1 LEU 23 3HD1 LEU 23 7.023 0.557 -2.730
177 1HD2 LEU 23 1HD2 LEU 23 8.259 3.215 -2.682
178 2HD2 LEU 23 2HD2 LEU 23 9.800 3.073 -1.837
179 3HD2 LEU 23 3HD2 LEU 23 8.360 3.595 -0.964
180 H ILE 24 H ILE 24 5.541 3.561 1.305
181 HA ILE 24 HA ILE 24 4.155 1.663 3.083
182 HB ILE 24 HB ILE 24 3.302 3.554 4.446
183 1HG1 ILE 24 2HG1 ILE 24 3.917 5.311 2.666
184 2HG1 ILE 24 1HG1 ILE 24 4.167 5.732 4.353
185 1HG2 ILE 24 1HG2 ILE 24 5.833 4.014 5.351
186 2HG2 ILE 24 2HG2 ILE 24 6.025 2.516 4.441
187 3HG2 ILE 24 3HG2 ILE 24 4.842 2.609 5.745
188 1HD1 ILE 24 1HD1 ILE 24 5.976 6.196 2.471
189 2HD1 ILE 24 2HD1 ILE 24 6.464 4.558 2.905
190 3HD1 ILE 24 3HD1 ILE 24 6.418 5.820 4.136
191 H CYS 25 H CYS 25 2.036 1.403 2.738
192 HA CYS 25 HA CYS 25 0.873 2.244 0.332
193 1HB CYS 25 2HB CYS 25 -0.451 1.148 2.818
194 2HB CYS 25 1HB CYS 25 -1.226 1.292 1.245
195 H GLY 26 H GLY 26 -0.797 3.683 -0.136
196 1HA GLY 26 2HA GLY 26 -1.599 5.575 1.949
197 2HA GLY 26 1HA GLY 26 -0.769 6.216 0.540
198 HA PRO 27 HA PRO 27 -5.033 6.706 -0.830
199 1HB PRO 27 2HB PRO 27 -4.436 8.136 -3.062
200 2HB PRO 27 1HB PRO 27 -4.472 8.838 -1.441
201 1HG PRO 27 2HG PRO 27 -2.126 7.908 -3.050
202 2HG PRO 27 1HG PRO 27 -2.300 9.377 -2.069
203 1HD PRO 27 2HD PRO 27 -0.980 7.189 -1.185
204 2HD PRO 27 1HD PRO 27 -1.885 8.259 -0.096
205 H PHE 28 H PHE 28 -4.632 4.253 -1.208
206 HA PHE 28 HA PHE 28 -5.035 2.437 -2.483
207 1HB PHE 28 2HB PHE 28 -5.953 4.533 -4.466
208 2HB PHE 28 1HB PHE 28 -6.006 2.811 -4.829
209 HD1 PHE 28 1HD PHE 28 -8.128 2.002 -4.726
210 HD2 PHE 28 2HD PHE 28 -6.900 4.863 -1.825
211 HE1 PHE 28 1HE PHE 28 -10.326 1.832 -3.634
212 HE2 PHE 28 2HE PHE 28 -9.094 4.696 -0.726
213 HZ PHE 28 HZ PHE 28 -10.809 3.179 -1.630
214 H VAL 29 H VAL 29 -2.450 3.903 -2.484
215 HA VAL 29 HA VAL 29 -1.132 2.266 -4.483
216 HB VAL 29 HB VAL 29 0.313 4.134 -5.304
217 1HG1 VAL 29 1HG1 VAL 29 -2.159 5.293 -6.189
218 2HG1 VAL 29 2HG1 VAL 29 -2.297 3.535 -6.125
219 3HG1 VAL 29 3HG1 VAL 29 -1.010 4.286 -7.070
220 1HG2 VAL 29 1HG2 VAL 29 -1.630 5.839 -3.748
221 2HG2 VAL 29 2HG2 VAL 29 -0.570 6.473 -5.007
222 3HG2 VAL 29 3HG2 VAL 29 0.121 5.740 -3.559
223 H CYS 30 H CYS 30 1.387 3.482 -4.105
224 HA CYS 30 HA CYS 30 1.770 3.341 -1.198
225 1HB CYS 30 2HB CYS 30 2.290 1.152 -2.474
226 2HB CYS 30 1HB CYS 30 3.648 2.031 -3.156
227 H VAL 31 H VAL 31 3.781 4.405 -0.510
228 HA VAL 31 HA VAL 31 4.994 6.127 -2.550
229 HB VAL 31 HB VAL 31 4.926 8.070 -0.964
230 1HG1 VAL 31 1HG1 VAL 31 2.442 8.541 -1.323
231 2HG1 VAL 31 2HG1 VAL 31 2.378 6.956 -2.095
232 3HG1 VAL 31 3HG1 VAL 31 3.422 8.216 -2.753
233 1HG2 VAL 31 1HG2 VAL 31 4.349 6.487 1.007
234 2HG2 VAL 31 2HG2 VAL 31 2.683 6.715 0.476
235 3HG2 VAL 31 3HG2 VAL 31 3.651 8.105 0.966
Start of MODEL 2
1 1H ALA 1 1HT ALA 1 6.573 -11.314 0.594
2 2H ALA 1 2HT ALA 1 5.026 -11.886 0.967
3 3H ALA 1 3HT ALA 1 5.601 -10.469 1.692
4 HA ALA 1 HA ALA 1 5.638 -10.387 -1.174
5 1HB ALA 1 1HB ALA 1 3.307 -11.425 0.108
6 2HB ALA 1 2HB ALA 1 3.564 -11.066 -1.599
7 3HB ALA 1 3HB ALA 1 2.948 -9.815 -0.518
8 H CYS 2 H CYS 2 5.354 -8.233 -1.831
9 HA CYS 2 HA CYS 2 4.671 -6.221 0.150
10 1HB CYS 2 2HB CYS 2 6.742 -5.002 -0.064
11 2HB CYS 2 1HB CYS 2 7.084 -6.623 0.513
12 H SER 3 H SER 3 3.693 -4.545 -0.757
13 HA SER 3 HA SER 3 3.116 -4.627 -3.555
14 1HB SER 3 2HB SER 3 2.392 -2.505 -1.522
15 2HB SER 3 1HB SER 3 1.623 -2.771 -3.088
16 HG SER 3 HG SER 3 0.618 -4.501 -2.329
17 H LYS 4 H LYS 4 3.678 -3.186 -5.143
18 HA LYS 4 HA LYS 4 6.206 -1.838 -4.798
19 1HB LYS 4 2HB LYS 4 4.346 -1.816 -7.188
20 2HB LYS 4 1HB LYS 4 6.052 -1.379 -7.177
21 1HG LYS 4 2HG LYS 4 6.742 -3.588 -6.908
22 2HG LYS 4 1HG LYS 4 5.150 -4.115 -6.359
23 1HD LYS 4 2HD LYS 4 4.381 -3.388 -8.731
24 2HD LYS 4 1HD LYS 4 6.096 -3.509 -9.133
25 1HE LYS 4 2HE LYS 4 4.910 -5.595 -9.623
26 2HE LYS 4 1HE LYS 4 6.128 -5.821 -8.367
27 1HZ LYS 4 1HZ LYS 4 3.181 -5.607 -8.010
28 2HZ LYS 4 2HZ LYS 4 4.278 -5.541 -6.724
29 3HZ LYS 4 3HZ LYS 4 4.174 -6.940 -7.668
30 H LYS 5 H LYS 5 6.540 0.428 -5.071
31 HA LYS 5 HA LYS 5 4.883 2.039 -3.624
32 1HB LYS 5 2HB LYS 5 7.110 2.767 -4.008
33 2HB LYS 5 1HB LYS 5 6.869 2.797 -5.753
34 1HG LYS 5 2HG LYS 5 5.686 4.766 -5.690
35 2HG LYS 5 1HG LYS 5 5.170 4.523 -4.037
36 1HD LYS 5 2HD LYS 5 7.418 5.015 -3.246
37 2HD LYS 5 1HD LYS 5 7.963 5.218 -4.914
38 1HE LYS 5 2HE LYS 5 6.900 7.222 -5.167
39 2HE LYS 5 1HE LYS 5 5.626 6.817 -4.018
40 1HZ LYS 5 1HZ LYS 5 7.320 7.036 -2.226
41 2HZ LYS 5 2HZ LYS 5 6.998 8.485 -3.047
42 3HZ LYS 5 3HZ LYS 5 8.413 7.626 -3.383
43 H TRP 6 H TRP 6 5.121 2.427 -7.149
44 HA TRP 6 HA TRP 6 2.629 3.859 -7.066
45 1HB TRP 6 2HB TRP 6 4.109 3.061 -9.571
46 2HB TRP 6 1HB TRP 6 3.044 4.442 -9.318
47 HD1 TRP 6 HD TRP 6 6.596 3.229 -8.470
48 HE1 TRP 6 1HE TRP 6 8.064 5.270 -7.948
49 HE3 TRP 6 3HE TRP 6 2.989 6.845 -8.458
50 HZ2 TRP 6 2HZ TRP 6 7.736 8.042 -7.560
51 HZ3 TRP 6 3HZ TRP 6 3.646 9.166 -7.993
52 HH2 TRP 6 HH TRP 6 5.973 9.750 -7.546
53 H GLU 7 H GLU 7 2.638 1.057 -6.281
54 HA GLU 7 HA GLU 7 1.002 -0.130 -8.428
55 1HB GLU 7 2HB GLU 7 2.877 -1.418 -7.169
56 2HB GLU 7 1HB GLU 7 1.709 -1.525 -5.860
57 1HG GLU 7 2HG GLU 7 0.164 -2.717 -7.264
58 2HG GLU 7 1HG GLU 7 1.213 -2.499 -8.663
59 H TYR 8 H TYR 8 -1.148 -0.579 -8.134
60 HA TYR 8 HA TYR 8 -2.593 1.097 -6.408
61 1HB TYR 8 2HB TYR 8 -3.576 0.345 -8.482
62 2HB TYR 8 1HB TYR 8 -3.448 -1.339 -7.988
63 HD1 TYR 8 1HD TYR 8 -4.959 1.835 -6.686
64 HD2 TYR 8 2HD TYR 8 -5.398 -2.350 -7.310
65 HE1 TYR 8 1HE TYR 8 -7.224 1.936 -5.738
66 HE2 TYR 8 2HE TYR 8 -7.666 -2.259 -6.364
67 HH TYR 8 HH TYR 8 -8.807 0.254 -4.569
68 H CYS 9 H CYS 9 -2.750 0.925 -4.294
69 HA CYS 9 HA CYS 9 -2.643 -1.723 -3.046
70 1HB CYS 9 2HB CYS 9 -1.166 0.179 -2.212
71 2HB CYS 9 1HB CYS 9 -2.637 0.960 -1.643
72 H ILE 10 H ILE 10 -4.467 -2.667 -2.442
73 HA ILE 10 HA ILE 10 -6.987 -1.607 -2.978
74 HB ILE 10 HB ILE 10 -6.234 -3.912 -1.172
75 1HG1 ILE 10 2HG1 ILE 10 -7.249 -5.185 -3.191
76 2HG1 ILE 10 1HG1 ILE 10 -7.006 -3.684 -4.073
77 1HG2 ILE 10 1HG2 ILE 10 -8.811 -4.360 -2.053
78 2HG2 ILE 10 2HG2 ILE 10 -8.806 -2.647 -1.632
79 3HG2 ILE 10 3HG2 ILE 10 -8.334 -3.853 -0.434
80 1HD1 ILE 10 1HD1 ILE 10 -4.892 -4.209 -4.430
81 2HD1 ILE 10 2HD1 ILE 10 -5.165 -5.753 -3.623
82 3HD1 ILE 10 3HD1 ILE 10 -4.601 -4.363 -2.697
83 H VAL 11 H VAL 11 -5.261 -1.869 0.113
84 HA VAL 11 HA VAL 11 -7.423 -0.490 1.465
85 HB VAL 11 HB VAL 11 -6.335 -2.363 2.608
86 1HG1 VAL 11 1HG1 VAL 11 -3.906 -0.843 1.981
87 2HG1 VAL 11 2HG1 VAL 11 -4.136 -2.574 2.222
88 3HG1 VAL 11 3HG1 VAL 11 -3.969 -1.505 3.614
89 1HG2 VAL 11 1HG2 VAL 11 -6.077 0.358 3.855
90 2HG2 VAL 11 2HG2 VAL 11 -5.776 -1.128 4.757
91 3HG2 VAL 11 3HG2 VAL 11 -7.367 -0.828 4.057
92 HA PRO 12 HA PRO 12 -5.362 3.421 0.929
93 1HB PRO 12 2HB PRO 12 -7.292 4.964 1.926
94 2HB PRO 12 1HB PRO 12 -7.511 4.110 0.394
95 1HG PRO 12 2HG PRO 12 -8.576 3.450 3.102
96 2HG PRO 12 1HG PRO 12 -9.355 3.290 1.519
97 1HD PRO 12 2HD PRO 12 -8.127 1.229 2.934
98 2HD PRO 12 1HD PRO 12 -8.501 1.207 1.201
99 H ILE 13 H ILE 13 -6.112 5.450 2.794
100 HA ILE 13 HA ILE 13 -4.079 5.199 4.727
101 HB ILE 13 HB ILE 13 -6.395 7.141 4.808
102 1HG1 ILE 13 2HG1 ILE 13 -3.712 7.445 3.436
103 2HG1 ILE 13 1HG1 ILE 13 -5.238 7.153 2.607
104 1HG2 ILE 13 1HG2 ILE 13 -5.390 8.036 6.578
105 2HG2 ILE 13 2HG2 ILE 13 -3.878 8.190 5.685
106 3HG2 ILE 13 3HG2 ILE 13 -4.237 6.701 6.561
107 1HD1 ILE 13 1HD1 ILE 13 -5.742 9.377 4.169
108 2HD1 ILE 13 2HD1 ILE 13 -5.415 9.355 2.437
109 3HD1 ILE 13 3HD1 ILE 13 -4.098 9.623 3.579
110 H LEU 14 H LEU 14 -4.585 3.222 5.661
111 HA LEU 14 HA LEU 14 -5.912 3.339 8.152
112 1HB LEU 14 2HB LEU 14 -7.806 3.024 6.397
113 2HB LEU 14 1HB LEU 14 -7.158 1.412 6.190
114 HG LEU 14 HG LEU 14 -9.158 1.618 7.716
115 1HD1 LEU 14 1HD1 LEU 14 -6.593 0.345 8.585
116 2HD1 LEU 14 2HD1 LEU 14 -8.035 -0.405 7.897
117 3HD1 LEU 14 3HD1 LEU 14 -8.060 0.197 9.554
118 1HD2 LEU 14 1HD2 LEU 14 -8.890 3.493 9.006
119 2HD2 LEU 14 2HD2 LEU 14 -7.168 3.209 9.260
120 3HD2 LEU 14 3HD2 LEU 14 -8.360 2.239 10.126
121 H GLY 15 H GLY 15 -4.653 1.462 5.454
122 1HA GLY 15 2HA GLY 15 -2.822 0.023 5.488
123 2HA GLY 15 1HA GLY 15 -2.780 0.152 7.238
124 H PHE 16 H PHE 16 -2.561 -2.154 5.450
125 HA PHE 16 HA PHE 16 -3.991 -4.052 6.949
126 1HB PHE 16 2HB PHE 16 -5.923 -3.269 5.614
127 2HB PHE 16 1HB PHE 16 -5.035 -3.611 4.134
128 HD1 PHE 16 1HD PHE 16 -5.979 -5.390 3.048
129 HD2 PHE 16 2HD PHE 16 -5.585 -5.545 7.283
130 HE1 PHE 16 1HE PHE 16 -6.871 -7.682 3.043
131 HE2 PHE 16 2HE PHE 16 -6.474 -7.839 7.285
132 HZ PHE 16 HZ PHE 16 -7.117 -8.911 5.163
133 H VAL 17 H VAL 17 -2.731 -3.399 3.705
134 HA VAL 17 HA VAL 17 -1.294 -5.944 3.691
135 HB VAL 17 HB VAL 17 -1.013 -3.931 1.495
136 1HG1 VAL 17 1HG1 VAL 17 -1.545 -6.625 0.669
137 2HG1 VAL 17 2HG1 VAL 17 -0.272 -6.604 1.890
138 3HG1 VAL 17 3HG1 VAL 17 -0.101 -5.643 0.421
139 1HG2 VAL 17 1HG2 VAL 17 -3.546 -4.635 2.373
140 2HG2 VAL 17 2HG2 VAL 17 -3.245 -5.718 1.013
141 3HG2 VAL 17 3HG2 VAL 17 -3.130 -3.972 0.792
142 H TYR 18 H TYR 18 1.018 -5.310 2.386
143 HA TYR 18 HA TYR 18 2.261 -3.079 3.760
144 1HB TYR 18 2HB TYR 18 2.490 -4.878 5.398
145 2HB TYR 18 1HB TYR 18 3.206 -5.925 4.177
146 HD1 TYR 18 1HD TYR 18 3.856 -2.362 5.134
147 HD2 TYR 18 2HD TYR 18 5.422 -6.296 4.713
148 HE1 TYR 18 1HE TYR 18 6.092 -1.528 5.724
149 HE2 TYR 18 2HE TYR 18 7.663 -5.473 5.303
150 HH TYR 18 HH TYR 18 8.365 -2.976 6.834
151 H CYS 19 H CYS 19 3.603 -2.096 2.475
152 HA CYS 19 HA CYS 19 4.306 -3.160 -0.098
153 1HB CYS 19 2HB CYS 19 4.948 -0.653 1.405
154 2HB CYS 19 1HB CYS 19 5.645 -0.963 -0.176
155 H CYS 20 H CYS 20 6.754 -2.666 -0.732
156 HA CYS 20 HA CYS 20 8.327 -4.511 0.764
157 1HB CYS 20 2HB CYS 20 9.341 -2.490 -1.233
158 2HB CYS 20 1HB CYS 20 10.090 -4.014 -0.783
159 HA PRO 21 HA PRO 21 9.979 -2.073 3.996
160 1HB PRO 21 2HB PRO 21 12.695 -2.794 3.014
161 2HB PRO 21 1HB PRO 21 12.000 -2.895 4.637
162 1HG PRO 21 2HG PRO 21 12.271 -5.092 3.145
163 2HG PRO 21 1HG PRO 21 10.837 -4.856 4.162
164 1HD PRO 21 2HD PRO 21 11.133 -4.561 1.204
165 2HD PRO 21 1HD PRO 21 9.747 -5.148 2.140
166 H GLY 22 H GLY 22 9.728 -0.046 3.765
167 1HA GLY 22 2HA GLY 22 11.069 2.043 3.534
168 2HA GLY 22 1HA GLY 22 11.474 1.459 1.926
169 H LEU 23 H LEU 23 8.711 0.428 1.489
170 HA LEU 23 HA LEU 23 7.490 3.023 0.862
171 1HB LEU 23 2HB LEU 23 6.892 0.312 -0.320
172 2HB LEU 23 1HB LEU 23 6.329 1.864 -0.910
173 HG LEU 23 HG LEU 23 9.231 1.034 -0.862
174 1HD1 LEU 23 1HD1 LEU 23 7.071 0.502 -2.786
175 2HD1 LEU 23 2HD1 LEU 23 8.590 -0.351 -2.513
176 3HD1 LEU 23 3HD1 LEU 23 8.570 1.128 -3.473
177 1HD2 LEU 23 1HD2 LEU 23 8.503 3.513 -0.856
178 2HD2 LEU 23 2HD2 LEU 23 8.011 3.206 -2.521
179 3HD2 LEU 23 3HD2 LEU 23 9.692 2.977 -2.043
180 H ILE 24 H ILE 24 5.271 3.373 1.256
181 HA ILE 24 HA ILE 24 3.897 1.361 2.909
182 HB ILE 24 HB ILE 24 3.038 3.232 4.378
183 1HG1 ILE 24 2HG1 ILE 24 5.413 4.711 3.221
184 2HG1 ILE 24 1HG1 ILE 24 3.727 5.095 2.894
185 1HG2 ILE 24 1HG2 ILE 24 5.656 1.945 4.415
186 2HG2 ILE 24 2HG2 ILE 24 4.434 2.076 5.681
187 3HG2 ILE 24 3HG2 ILE 24 5.566 3.400 5.408
188 1HD1 ILE 24 1HD1 ILE 24 5.243 6.262 4.808
189 2HD1 ILE 24 2HD1 ILE 24 4.423 5.006 5.736
190 3HD1 ILE 24 3HD1 ILE 24 3.481 6.189 4.827
191 H CYS 25 H CYS 25 1.758 1.154 2.511
192 HA CYS 25 HA CYS 25 0.619 2.294 0.205
193 1HB CYS 25 2HB CYS 25 -0.553 0.753 2.507
194 2HB CYS 25 1HB CYS 25 -1.578 1.391 1.228
195 H GLY 26 H GLY 26 -0.960 3.847 -0.105
196 1HA GLY 26 2HA GLY 26 -1.851 5.436 2.175
197 2HA GLY 26 1HA GLY 26 -0.868 6.259 0.973
198 HA PRO 27 HA PRO 27 -4.802 7.181 -0.908
199 1HB PRO 27 2HB PRO 27 -3.865 8.457 -3.105
200 2HB PRO 27 1HB PRO 27 -3.861 9.189 -1.497
201 1HG PRO 27 2HG PRO 27 -1.626 7.861 -2.980
202 2HG PRO 27 1HG PRO 27 -1.603 9.352 -2.021
203 1HD PRO 27 2HD PRO 27 -0.715 6.968 -1.069
204 2HD PRO 27 1HD PRO 27 -1.428 8.217 -0.030
205 H PHE 28 H PHE 28 -4.615 4.651 -1.199
206 HA PHE 28 HA PHE 28 -5.153 2.854 -2.449
207 1HB PHE 28 2HB PHE 28 -5.882 4.981 -4.482
208 2HB PHE 28 1HB PHE 28 -6.117 3.261 -4.779
209 HD1 PHE 28 1HD PHE 28 -6.853 5.736 -2.067
210 HD2 PHE 28 2HD PHE 28 -8.207 2.448 -4.404
211 HE1 PHE 28 1HE PHE 28 -9.032 5.828 -0.927
212 HE2 PHE 28 2HE PHE 28 -10.387 2.535 -3.269
213 HZ PHE 28 HZ PHE 28 -10.803 4.228 -1.529
214 H VAL 29 H VAL 29 -2.455 4.127 -2.501
215 HA VAL 29 HA VAL 29 -1.277 2.310 -4.424
216 HB VAL 29 HB VAL 29 0.321 4.038 -5.316
217 1HG1 VAL 29 1HG1 VAL 29 -2.360 3.582 -6.125
218 2HG1 VAL 29 2HG1 VAL 29 -0.967 4.025 -7.112
219 3HG1 VAL 29 3HG1 VAL 29 -1.985 5.282 -6.409
220 1HG2 VAL 29 1HG2 VAL 29 -1.596 6.191 -4.529
221 2HG2 VAL 29 2HG2 VAL 29 0.118 6.295 -4.928
222 3HG2 VAL 29 3HG2 VAL 29 -0.385 5.650 -3.366
223 H CYS 30 H CYS 30 1.332 3.236 -4.112
224 HA CYS 30 HA CYS 30 1.667 3.205 -1.189
225 1HB CYS 30 2HB CYS 30 2.178 1.007 -2.421
226 2HB CYS 30 1HB CYS 30 3.540 1.859 -3.136
227 H VAL 31 H VAL 31 3.673 4.263 -0.462
228 HA VAL 31 HA VAL 31 4.912 5.987 -2.485
229 HB VAL 31 HB VAL 31 4.823 7.931 -0.912
230 1HG1 VAL 31 1HG1 VAL 31 1.972 7.454 -1.286
231 2HG1 VAL 31 2HG1 VAL 31 2.937 7.096 -2.719
232 3HG1 VAL 31 3HG1 VAL 31 3.016 8.695 -1.979
233 1HG2 VAL 31 1HG2 VAL 31 3.799 7.902 1.097
234 2HG2 VAL 31 2HG2 VAL 31 4.096 6.167 0.993
235 3HG2 VAL 31 3HG2 VAL 31 2.518 6.819 0.550
Start of MODEL 3
1 1H ALA 1 1HT ALA 1 5.325 -10.157 1.504
2 2H ALA 1 2HT ALA 1 6.338 -11.320 0.808
3 3H ALA 1 3HT ALA 1 4.668 -11.577 0.858
4 HA ALA 1 HA ALA 1 6.182 -10.334 -1.138
5 1HB ALA 1 1HB ALA 1 4.009 -10.291 -2.308
6 2HB ALA 1 2HB ALA 1 3.210 -10.737 -0.801
7 3HB ALA 1 3HB ALA 1 4.342 -11.853 -1.562
8 H CYS 2 H CYS 2 6.227 -8.254 -1.923
9 HA CYS 2 HA CYS 2 4.742 -6.228 -0.371
10 1HB CYS 2 2HB CYS 2 6.642 -4.778 -0.424
11 2HB CYS 2 1HB CYS 2 7.130 -6.319 0.262
12 H SER 3 H SER 3 3.675 -4.764 -1.501
13 HA SER 3 HA SER 3 3.442 -5.094 -4.337
14 1HB SER 3 2HB SER 3 2.137 -3.086 -2.485
15 2HB SER 3 1HB SER 3 1.656 -3.421 -4.150
16 HG SER 3 HG SER 3 0.875 -5.345 -3.567
17 H LYS 4 H LYS 4 3.770 -3.535 -5.923
18 HA LYS 4 HA LYS 4 6.143 -2.009 -5.689
19 1HB LYS 4 2HB LYS 4 5.531 -2.940 -7.814
20 2HB LYS 4 1HB LYS 4 3.980 -2.118 -7.795
21 1HG LYS 4 2HG LYS 4 5.057 0.016 -8.092
22 2HG LYS 4 1HG LYS 4 6.647 -0.735 -7.969
23 1HD LYS 4 2HD LYS 4 6.024 -0.260 -10.301
24 2HD LYS 4 1HD LYS 4 6.252 -1.983 -10.013
25 1HE LYS 4 2HE LYS 4 3.507 -0.861 -9.748
26 2HE LYS 4 1HE LYS 4 4.176 -1.047 -11.369
27 1HZ LYS 4 1HZ LYS 4 3.259 -3.086 -11.125
28 2HZ LYS 4 2HZ LYS 4 3.372 -3.095 -9.436
29 3HZ LYS 4 3HZ LYS 4 4.737 -3.430 -10.383
30 H LYS 5 H LYS 5 6.446 0.232 -5.587
31 HA LYS 5 HA LYS 5 4.847 1.663 -3.894
32 1HB LYS 5 2HB LYS 5 7.051 2.444 -4.224
33 2HB LYS 5 1HB LYS 5 6.808 2.629 -5.957
34 1HG LYS 5 2HG LYS 5 5.621 4.594 -5.717
35 2HG LYS 5 1HG LYS 5 5.144 4.223 -4.075
36 1HD LYS 5 2HD LYS 5 7.361 4.689 -3.268
37 2HD LYS 5 1HD LYS 5 7.954 4.889 -4.919
38 1HE LYS 5 2HE LYS 5 6.913 6.920 -5.196
39 2HE LYS 5 1HE LYS 5 5.678 6.576 -3.987
40 1HZ LYS 5 1HZ LYS 5 8.539 7.095 -3.372
41 2HZ LYS 5 2HZ LYS 5 7.291 6.883 -2.245
42 3HZ LYS 5 3HZ LYS 5 7.306 8.246 -3.252
43 H TRP 6 H TRP 6 4.991 2.453 -7.356
44 HA TRP 6 HA TRP 6 2.537 3.916 -7.081
45 1HB TRP 6 2HB TRP 6 3.951 3.297 -9.675
46 2HB TRP 6 1HB TRP 6 2.892 4.655 -9.308
47 HD1 TRP 6 HD TRP 6 6.459 3.388 -8.620
48 HE1 TRP 6 1HE TRP 6 7.934 5.390 -7.978
49 HE3 TRP 6 3HE TRP 6 2.847 6.981 -8.275
50 HZ2 TRP 6 2HZ TRP 6 7.609 8.127 -7.383
51 HZ3 TRP 6 3HZ TRP 6 3.508 9.266 -7.655
52 HH2 TRP 6 HH TRP 6 5.842 9.824 -7.212
53 H GLU 7 H GLU 7 2.441 1.127 -6.488
54 HA GLU 7 HA GLU 7 0.713 0.127 -8.666
55 1HB GLU 7 2HB GLU 7 2.554 -1.346 -7.959
56 2HB GLU 7 1HB GLU 7 1.939 -1.324 -6.316
57 1HG GLU 7 2HG GLU 7 0.005 -2.556 -6.943
58 2HG GLU 7 1HG GLU 7 0.395 -2.398 -8.658
59 H TYR 8 H TYR 8 -1.418 -0.258 -8.300
60 HA TYR 8 HA TYR 8 -2.727 1.163 -6.254
61 1HB TYR 8 2HB TYR 8 -3.630 0.468 -8.547
62 2HB TYR 8 1HB TYR 8 -3.899 -1.125 -7.855
63 HD1 TYR 8 1HD TYR 8 -5.986 -1.590 -6.997
64 HD2 TYR 8 2HD TYR 8 -4.699 2.460 -7.152
65 HE1 TYR 8 1HE TYR 8 -8.197 -0.864 -6.206
66 HE2 TYR 8 2HE TYR 8 -6.904 3.197 -6.353
67 HH TYR 8 HH TYR 8 -8.970 2.579 -5.817
68 H CYS 9 H CYS 9 -2.882 0.639 -4.181
69 HA CYS 9 HA CYS 9 -2.156 -1.955 -3.222
70 1HB CYS 9 2HB CYS 9 -3.239 0.464 -1.773
71 2HB CYS 9 1HB CYS 9 -2.681 -1.003 -0.976
72 H ILE 10 H ILE 10 -4.119 -2.655 -4.761
73 HA ILE 10 HA ILE 10 -6.668 -2.682 -3.396
74 HB ILE 10 HB ILE 10 -6.646 -2.569 -5.822
75 1HG1 ILE 10 2HG1 ILE 10 -7.723 -5.241 -4.898
76 2HG1 ILE 10 1HG1 ILE 10 -8.541 -3.693 -4.705
77 1HG2 ILE 10 1HG2 ILE 10 -5.948 -4.545 -7.173
78 2HG2 ILE 10 2HG2 ILE 10 -5.211 -5.210 -5.715
79 3HG2 ILE 10 3HG2 ILE 10 -4.624 -3.687 -6.382
80 1HD1 ILE 10 1HD1 ILE 10 -8.922 -5.422 -6.763
81 2HD1 ILE 10 2HD1 ILE 10 -7.756 -4.293 -7.455
82 3HD1 ILE 10 3HD1 ILE 10 -9.285 -3.696 -6.809
83 H VAL 11 H VAL 11 -5.310 -3.581 -1.527
84 HA VAL 11 HA VAL 11 -4.478 -6.264 -1.519
85 HB VAL 11 HB VAL 11 -4.501 -6.082 0.950
86 1HG1 VAL 11 1HG1 VAL 11 -3.143 -4.230 -0.877
87 2HG1 VAL 11 2HG1 VAL 11 -2.478 -5.306 0.352
88 3HG1 VAL 11 3HG1 VAL 11 -3.133 -3.736 0.816
89 1HG2 VAL 11 1HG2 VAL 11 -5.883 -4.676 1.979
90 2HG2 VAL 11 2HG2 VAL 11 -6.392 -4.008 0.427
91 3HG2 VAL 11 3HG2 VAL 11 -5.009 -3.317 1.273
92 HA PRO 12 HA PRO 12 -8.384 -8.360 -1.508
93 1HB PRO 12 2HB PRO 12 -6.817 -10.649 -0.506
94 2HB PRO 12 1HB PRO 12 -7.761 -10.499 -1.992
95 1HG PRO 12 2HG PRO 12 -5.079 -10.539 -2.032
96 2HG PRO 12 1HG PRO 12 -6.014 -9.543 -3.162
97 1HD PRO 12 2HD PRO 12 -4.571 -8.733 -0.666
98 2HD PRO 12 1HD PRO 12 -4.665 -7.901 -2.233
99 H ILE 13 H ILE 13 -9.916 -8.646 0.005
100 HA ILE 13 HA ILE 13 -9.553 -7.903 2.651
101 HB ILE 13 HB ILE 13 -11.789 -8.941 3.085
102 1HG1 ILE 13 2HG1 ILE 13 -11.638 -9.666 0.148
103 2HG1 ILE 13 1HG1 ILE 13 -11.572 -10.817 1.478
104 1HG2 ILE 13 1HG2 ILE 13 -12.815 -7.516 1.033
105 2HG2 ILE 13 2HG2 ILE 13 -11.162 -6.904 1.058
106 3HG2 ILE 13 3HG2 ILE 13 -12.162 -6.799 2.506
107 1HD1 ILE 13 1HD1 ILE 13 -13.768 -11.006 1.172
108 2HD1 ILE 13 2HD1 ILE 13 -13.858 -9.512 0.238
109 3HD1 ILE 13 3HD1 ILE 13 -13.882 -9.453 2.001
110 H LEU 14 H LEU 14 -9.413 -11.109 1.206
111 HA LEU 14 HA LEU 14 -8.927 -12.273 3.850
112 1HB LEU 14 2HB LEU 14 -9.344 -14.424 2.872
113 2HB LEU 14 1HB LEU 14 -10.647 -13.342 2.432
114 HG LEU 14 HG LEU 14 -8.357 -13.930 0.559
115 1HD1 LEU 14 1HD1 LEU 14 -10.816 -15.511 1.147
116 2HD1 LEU 14 2HD1 LEU 14 -9.182 -16.062 0.780
117 3HD1 LEU 14 3HD1 LEU 14 -10.210 -15.434 -0.508
118 1HD2 LEU 14 1HD2 LEU 14 -9.375 -12.312 -0.599
119 2HD2 LEU 14 2HD2 LEU 14 -10.785 -12.328 0.459
120 3HD2 LEU 14 3HD2 LEU 14 -10.670 -13.475 -0.876
121 H GLY 15 H GLY 15 -6.947 -10.627 2.410
122 1HA GLY 15 2HA GLY 15 -4.644 -12.102 2.964
123 2HA GLY 15 1HA GLY 15 -4.970 -12.291 1.248
124 H PHE 16 H PHE 16 -5.084 -9.617 3.594
125 HA PHE 16 HA PHE 16 -4.429 -7.633 1.742
126 1HB PHE 16 2HB PHE 16 -3.789 -6.295 3.835
127 2HB PHE 16 1HB PHE 16 -5.444 -6.871 3.709
128 HD1 PHE 16 1HD PHE 16 -2.154 -7.723 5.236
129 HD2 PHE 16 2HD PHE 16 -6.390 -8.087 5.433
130 HE1 PHE 16 1HE PHE 16 -1.956 -8.797 7.440
131 HE2 PHE 16 2HE PHE 16 -6.198 -9.161 7.637
132 HZ PHE 16 HZ PHE 16 -3.980 -9.517 8.644
133 H VAL 17 H VAL 17 -2.594 -6.801 0.995
134 HA VAL 17 HA VAL 17 -0.124 -8.232 1.600
135 HB VAL 17 HB VAL 17 -0.263 -6.125 -0.514
136 1HG1 VAL 17 1HG1 VAL 17 1.528 -8.184 0.247
137 2HG1 VAL 17 2HG1 VAL 17 1.694 -7.013 -1.060
138 3HG1 VAL 17 3HG1 VAL 17 0.918 -8.566 -1.363
139 1HG2 VAL 17 1HG2 VAL 17 -1.346 -7.481 -2.105
140 2HG2 VAL 17 2HG2 VAL 17 -2.358 -7.557 -0.663
141 3HG2 VAL 17 3HG2 VAL 17 -1.284 -8.899 -1.058
142 H TYR 18 H TYR 18 1.783 -6.417 1.011
143 HA TYR 18 HA TYR 18 1.417 -3.951 2.445
144 1HB TYR 18 2HB TYR 18 3.218 -4.444 4.108
145 2HB TYR 18 1HB TYR 18 1.777 -5.427 4.345
146 HD1 TYR 18 1HD TYR 18 5.278 -5.466 3.177
147 HD2 TYR 18 2HD TYR 18 1.847 -7.810 4.094
148 HE1 TYR 18 1HE TYR 18 6.647 -7.505 3.062
149 HE2 TYR 18 2HE TYR 18 3.208 -9.854 3.986
150 HH TYR 18 HH TYR 18 6.168 -10.126 4.301
151 H CYS 19 H CYS 19 3.143 -2.491 2.056
152 HA CYS 19 HA CYS 19 4.522 -2.911 -0.398
153 1HB CYS 19 2HB CYS 19 4.694 -0.825 1.727
154 2HB CYS 19 1HB CYS 19 5.625 -0.717 0.240
155 H CYS 20 H CYS 20 6.874 -2.513 -0.646
156 HA CYS 20 HA CYS 20 8.396 -4.371 0.890
157 1HB CYS 20 2HB CYS 20 9.548 -2.232 -0.893
158 2HB CYS 20 1HB CYS 20 10.216 -3.815 -0.529
159 HA PRO 21 HA PRO 21 9.771 -1.932 4.279
160 1HB PRO 21 2HB PRO 21 12.559 -2.633 3.523
161 2HB PRO 21 1HB PRO 21 11.723 -2.786 5.073
162 1HG PRO 21 2HG PRO 21 12.166 -4.933 3.542
163 2HG PRO 21 1HG PRO 21 10.654 -4.755 4.453
164 1HD PRO 21 2HD PRO 21 11.168 -4.365 1.535
165 2HD PRO 21 1HD PRO 21 9.732 -5.015 2.347
166 H GLY 22 H GLY 22 9.628 0.124 4.100
167 1HA GLY 22 2HA GLY 22 10.999 2.187 3.903
168 2HA GLY 22 1HA GLY 22 11.476 1.582 2.321
169 H LEU 23 H LEU 23 8.772 0.579 1.716
170 HA LEU 23 HA LEU 23 7.538 3.167 1.071
171 1HB LEU 23 2HB LEU 23 7.126 0.471 -0.230
172 2HB LEU 23 1HB LEU 23 6.473 2.001 -0.782
173 HG LEU 23 HG LEU 23 9.415 1.332 -0.693
174 1HD1 LEU 23 1HD1 LEU 23 7.887 1.655 -3.222
175 2HD1 LEU 23 2HD1 LEU 23 7.773 0.123 -2.356
176 3HD1 LEU 23 3HD1 LEU 23 9.344 0.718 -2.891
177 1HD2 LEU 23 1HD2 LEU 23 8.863 3.406 -2.492
178 2HD2 LEU 23 2HD2 LEU 23 9.710 3.518 -0.950
179 3HD2 LEU 23 3HD2 LEU 23 7.969 3.792 -1.022
180 H ILE 24 H ILE 24 5.241 3.381 1.283
181 HA ILE 24 HA ILE 24 3.877 1.269 2.798
182 HB ILE 24 HB ILE 24 2.901 3.044 4.328
183 1HG1 ILE 24 2HG1 ILE 24 5.331 4.592 3.399
184 2HG1 ILE 24 1HG1 ILE 24 3.662 4.998 3.017
185 1HG2 ILE 24 1HG2 ILE 24 5.613 1.884 4.444
186 2HG2 ILE 24 2HG2 ILE 24 4.243 1.688 5.537
187 3HG2 ILE 24 3HG2 ILE 24 5.240 3.141 5.623
188 1HD1 ILE 24 1HD1 ILE 24 3.708 4.817 5.781
189 2HD1 ILE 24 2HD1 ILE 24 3.686 6.291 4.813
190 3HD1 ILE 24 3HD1 ILE 24 5.222 5.617 5.359
191 H CYS 25 H CYS 25 1.766 1.032 2.291
192 HA CYS 25 HA CYS 25 0.689 2.379 0.052
193 1HB CYS 25 2HB CYS 25 -0.494 0.528 2.105
194 2HB CYS 25 1HB CYS 25 -1.511 1.291 0.889
195 H GLY 26 H GLY 26 -0.596 4.121 -0.145
196 1HA GLY 26 2HA GLY 26 -1.680 5.349 2.302
197 2HA GLY 26 1HA GLY 26 -0.735 6.309 1.173
198 HA PRO 27 HA PRO 27 -4.615 7.292 -0.747
199 1HB PRO 27 2HB PRO 27 -3.123 8.173 -3.098
200 2HB PRO 27 1HB PRO 27 -4.027 9.137 -1.929
201 1HG PRO 27 2HG PRO 27 -1.327 9.204 -2.095
202 2HG PRO 27 1HG PRO 27 -2.199 9.446 -0.571
203 1HD PRO 27 2HD PRO 27 -0.815 6.991 -1.593
204 2HD PRO 27 1HD PRO 27 -0.815 7.685 0.043
205 H PHE 28 H PHE 28 -4.388 4.714 -0.908
206 HA PHE 28 HA PHE 28 -4.997 2.857 -2.029
207 1HB PHE 28 2HB PHE 28 -5.931 4.860 -4.112
208 2HB PHE 28 1HB PHE 28 -6.195 3.124 -4.252
209 HD1 PHE 28 1HD PHE 28 -8.249 2.372 -3.633
210 HD2 PHE 28 2HD PHE 28 -6.660 5.794 -1.665
211 HE1 PHE 28 1HE PHE 28 -10.318 2.573 -2.318
212 HE2 PHE 28 2HE PHE 28 -8.725 5.998 -0.344
213 HZ PHE 28 HZ PHE 28 -10.558 4.387 -0.670
214 H VAL 29 H VAL 29 -2.358 4.305 -2.447
215 HA VAL 29 HA VAL 29 -1.258 2.376 -4.310
216 HB VAL 29 HB VAL 29 0.153 4.095 -5.478
217 1HG1 VAL 29 1HG1 VAL 29 -2.832 4.213 -5.868
218 2HG1 VAL 29 2HG1 VAL 29 -1.650 3.241 -6.745
219 3HG1 VAL 29 3HG1 VAL 29 -1.687 4.991 -6.961
220 1HG2 VAL 29 1HG2 VAL 29 0.212 6.074 -4.394
221 2HG2 VAL 29 2HG2 VAL 29 -1.421 5.901 -3.750
222 3HG2 VAL 29 3HG2 VAL 29 -1.180 6.440 -5.412
223 H CYS 30 H CYS 30 1.177 2.429 -4.057
224 HA CYS 30 HA CYS 30 1.766 2.926 -1.257
225 1HB CYS 30 2HB CYS 30 2.366 0.789 -2.558
226 2HB CYS 30 1HB CYS 30 3.628 1.751 -3.311
227 H VAL 31 H VAL 31 3.599 4.155 -0.556
228 HA VAL 31 HA VAL 31 4.808 5.909 -2.563
229 HB VAL 31 HB VAL 31 4.535 7.887 -1.059
230 1HG1 VAL 31 1HG1 VAL 31 3.046 8.139 -2.743
231 2HG1 VAL 31 2HG1 VAL 31 1.887 7.930 -1.430
232 3HG1 VAL 31 3HG1 VAL 31 2.299 6.565 -2.468
233 1HG2 VAL 31 1HG2 VAL 31 3.321 5.888 0.657
234 2HG2 VAL 31 2HG2 VAL 31 2.281 7.294 0.429
235 3HG2 VAL 31 3HG2 VAL 31 3.920 7.500 1.047
Start of MODEL 4
1 1H ALA 1 1HT ALA 1 4.207 -10.639 1.209
2 2H ALA 1 2HT ALA 1 3.683 -11.874 0.174
3 3H ALA 1 3HT ALA 1 2.701 -10.523 0.443
4 HA ALA 1 HA ALA 1 5.358 -10.430 -0.853
5 1HB ALA 1 1HB ALA 1 3.037 -9.777 -2.491
6 2HB ALA 1 2HB ALA 1 3.054 -11.457 -1.952
7 3HB ALA 1 3HB ALA 1 4.424 -10.805 -2.850
8 H CYS 2 H CYS 2 6.052 -8.381 -1.350
9 HA CYS 2 HA CYS 2 4.566 -6.201 -0.084
10 1HB CYS 2 2HB CYS 2 6.606 -4.967 -0.152
11 2HB CYS 2 1HB CYS 2 6.970 -6.574 0.452
12 H SER 3 H SER 3 3.632 -4.604 -1.158
13 HA SER 3 HA SER 3 3.378 -4.821 -4.023
14 1HB SER 3 2HB SER 3 2.196 -2.751 -2.157
15 2HB SER 3 1HB SER 3 1.661 -3.130 -3.795
16 HG SER 3 HG SER 3 1.126 -5.233 -3.028
17 H LYS 4 H LYS 4 4.074 -3.339 -5.548
18 HA LYS 4 HA LYS 4 6.395 -1.820 -4.885
19 1HB LYS 4 2HB LYS 4 4.783 -1.820 -7.449
20 2HB LYS 4 1HB LYS 4 6.388 -1.128 -7.245
21 1HG LYS 4 2HG LYS 4 7.144 -3.463 -6.583
22 2HG LYS 4 1HG LYS 4 5.588 -4.023 -7.195
23 1HD LYS 4 2HD LYS 4 7.639 -2.479 -8.784
24 2HD LYS 4 1HD LYS 4 7.391 -4.222 -8.865
25 1HE LYS 4 2HE LYS 4 5.355 -2.111 -9.576
26 2HE LYS 4 1HE LYS 4 6.302 -3.054 -10.724
27 1HZ LYS 4 1HZ LYS 4 5.115 -4.926 -9.133
28 2HZ LYS 4 2HZ LYS 4 4.609 -4.477 -10.680
29 3HZ LYS 4 3HZ LYS 4 3.905 -3.753 -9.319
30 H LYS 5 H LYS 5 6.626 0.504 -5.239
31 HA LYS 5 HA LYS 5 4.887 1.975 -3.733
32 1HB LYS 5 2HB LYS 5 7.055 2.853 -4.117
33 2HB LYS 5 1HB LYS 5 6.814 2.877 -5.859
34 1HG LYS 5 2HG LYS 5 5.503 4.770 -5.784
35 2HG LYS 5 1HG LYS 5 5.032 4.501 -4.122
36 1HD LYS 5 2HD LYS 5 7.239 5.140 -3.358
37 2HD LYS 5 1HD LYS 5 7.781 5.323 -5.030
38 1HE LYS 5 2HE LYS 5 6.617 7.267 -5.343
39 2HE LYS 5 1HE LYS 5 5.376 6.844 -4.166
40 1HZ LYS 5 1HZ LYS 5 8.131 7.801 -3.601
41 2HZ LYS 5 2HZ LYS 5 7.090 7.194 -2.407
42 3HZ LYS 5 3HZ LYS 5 6.678 8.598 -3.262
43 H TRP 6 H TRP 6 5.058 2.418 -7.247
44 HA TRP 6 HA TRP 6 2.502 3.719 -7.153
45 1HB TRP 6 2HB TRP 6 4.015 2.997 -9.661
46 2HB TRP 6 1HB TRP 6 2.879 4.319 -9.408
47 HD1 TRP 6 HD TRP 6 6.488 3.295 -8.551
48 HE1 TRP 6 1HE TRP 6 7.849 5.413 -8.041
49 HE3 TRP 6 3HE TRP 6 2.699 6.721 -8.581
50 HZ2 TRP 6 2HZ TRP 6 7.377 8.169 -7.677
51 HZ3 TRP 6 3HZ TRP 6 3.236 9.076 -8.134
52 HH2 TRP 6 HH TRP 6 5.528 9.784 -7.684
53 H GLU 7 H GLU 7 2.596 0.944 -6.352
54 HA GLU 7 HA GLU 7 1.367 -0.589 -8.489
55 1HB GLU 7 2HB GLU 7 2.694 -1.389 -6.331
56 2HB GLU 7 1HB GLU 7 1.092 -1.360 -5.611
57 1HG GLU 7 2HG GLU 7 1.416 -3.563 -6.321
58 2HG GLU 7 1HG GLU 7 0.357 -2.840 -7.532
59 H TYR 8 H TYR 8 -0.432 -1.432 -5.947
60 HA TYR 8 HA TYR 8 -2.408 0.634 -5.876
61 1HB TYR 8 2HB TYR 8 -2.852 -0.477 -8.099
62 2HB TYR 8 1HB TYR 8 -3.159 -1.975 -7.230
63 HD1 TYR 8 1HD TYR 8 -4.250 1.599 -6.975
64 HD2 TYR 8 2HD TYR 8 -5.384 -2.501 -6.975
65 HE1 TYR 8 1HE TYR 8 -6.603 2.256 -6.696
66 HE2 TYR 8 2HE TYR 8 -7.740 -1.856 -6.698
67 HH TYR 8 HH TYR 8 -8.690 1.559 -6.422
68 H CYS 9 H CYS 9 -3.525 0.437 -3.986
69 HA CYS 9 HA CYS 9 -3.783 -2.173 -2.750
70 1HB CYS 9 2HB CYS 9 -2.795 -1.295 -0.586
71 2HB CYS 9 1HB CYS 9 -1.649 -1.632 -1.877
72 H ILE 10 H ILE 10 -5.611 -2.371 -1.700
73 HA ILE 10 HA ILE 10 -7.018 0.005 -0.709
74 HB ILE 10 HB ILE 10 -9.173 -1.087 -1.509
75 1HG1 ILE 10 2HG1 ILE 10 -7.255 -2.592 -3.306
76 2HG1 ILE 10 1HG1 ILE 10 -8.205 -3.308 -2.009
77 1HG2 ILE 10 1HG2 ILE 10 -8.234 0.919 -2.535
78 2HG2 ILE 10 2HG2 ILE 10 -9.022 -0.109 -3.732
79 3HG2 ILE 10 3HG2 ILE 10 -7.262 -0.084 -3.612
80 1HD1 ILE 10 1HD1 ILE 10 -9.973 -3.523 -3.327
81 2HD1 ILE 10 2HD1 ILE 10 -8.920 -3.082 -4.672
82 3HD1 ILE 10 3HD1 ILE 10 -9.872 -1.843 -3.854
83 H VAL 11 H VAL 11 -5.555 -1.529 0.894
84 HA VAL 11 HA VAL 11 -6.868 -3.783 1.982
85 HB VAL 11 HB VAL 11 -5.276 -3.589 3.849
86 1HG1 VAL 11 1HG1 VAL 11 -4.438 -4.778 2.018
87 2HG1 VAL 11 2HG1 VAL 11 -3.169 -3.616 2.400
88 3HG1 VAL 11 3HG1 VAL 11 -4.255 -3.322 1.041
89 1HG2 VAL 11 1HG2 VAL 11 -4.374 -1.044 2.497
90 2HG2 VAL 11 2HG2 VAL 11 -3.598 -1.817 3.880
91 3HG2 VAL 11 3HG2 VAL 11 -5.220 -1.145 4.041
92 HA PRO 12 HA PRO 12 -9.906 -1.709 4.449
93 1HB PRO 12 2HB PRO 12 -10.769 -3.825 5.876
94 2HB PRO 12 1HB PRO 12 -11.137 -3.637 4.157
95 1HG PRO 12 2HG PRO 12 -9.048 -5.325 5.476
96 2HG PRO 12 1HG PRO 12 -10.119 -5.724 4.121
97 1HD PRO 12 2HD PRO 12 -7.512 -4.965 3.814
98 2HD PRO 12 1HD PRO 12 -8.764 -4.692 2.587
99 H ILE 13 H ILE 13 -10.594 -2.365 7.007
100 HA ILE 13 HA ILE 13 -8.753 -0.969 8.562
101 HB ILE 13 HB ILE 13 -10.050 -1.790 10.531
102 1HG1 ILE 13 2HG1 ILE 13 -11.687 -3.236 8.432
103 2HG1 ILE 13 1HG1 ILE 13 -10.628 -4.020 9.599
104 1HG2 ILE 13 1HG2 ILE 13 -11.171 -0.389 8.185
105 2HG2 ILE 13 2HG2 ILE 13 -10.959 0.164 9.847
106 3HG2 ILE 13 3HG2 ILE 13 -12.317 -0.882 9.432
107 1HD1 ILE 13 1HD1 ILE 13 -12.015 -3.326 11.415
108 2HD1 ILE 13 2HD1 ILE 13 -13.036 -4.079 10.191
109 3HD1 ILE 13 3HD1 ILE 13 -12.996 -2.322 10.346
110 H LEU 14 H LEU 14 -9.095 -4.439 8.065
111 HA LEU 14 HA LEU 14 -7.002 -4.956 10.037
112 1HB LEU 14 2HB LEU 14 -8.689 -6.870 8.423
113 2HB LEU 14 1HB LEU 14 -7.532 -7.333 9.655
114 HG LEU 14 HG LEU 14 -10.041 -5.720 10.132
115 1HD1 LEU 14 1HD1 LEU 14 -11.069 -7.688 10.132
116 2HD1 LEU 14 2HD1 LEU 14 -10.129 -8.097 11.568
117 3HD1 LEU 14 3HD1 LEU 14 -9.545 -8.559 9.969
118 1HD2 LEU 14 1HD2 LEU 14 -8.307 -6.960 12.238
119 2HD2 LEU 14 2HD2 LEU 14 -9.514 -5.683 12.397
120 3HD2 LEU 14 3HD2 LEU 14 -7.968 -5.343 11.618
121 H GLY 15 H GLY 15 -6.759 -3.766 7.191
122 1HA GLY 15 2HA GLY 15 -5.165 -3.782 5.544
123 2HA GLY 15 1HA GLY 15 -4.204 -4.790 6.614
124 H PHE 16 H PHE 16 -3.469 -5.891 4.724
125 HA PHE 16 HA PHE 16 -4.632 -8.355 4.252
126 1HB PHE 16 2HB PHE 16 -6.389 -7.003 3.056
127 2HB PHE 16 1HB PHE 16 -5.143 -6.471 1.932
128 HD1 PHE 16 1HD PHE 16 -5.820 -9.829 3.398
129 HD2 PHE 16 2HD PHE 16 -5.638 -7.423 -0.109
130 HE1 PHE 16 1HE PHE 16 -6.222 -11.822 2.014
131 HE2 PHE 16 2HE PHE 16 -6.040 -9.413 -1.498
132 HZ PHE 16 HZ PHE 16 -6.333 -11.616 -0.437
133 H VAL 17 H VAL 17 -2.988 -5.752 2.501
134 HA VAL 17 HA VAL 17 -0.794 -7.623 1.901
135 HB VAL 17 HB VAL 17 -1.129 -5.190 0.218
136 1HG1 VAL 17 1HG1 VAL 17 -0.629 -7.705 -1.123
137 2HG1 VAL 17 2HG1 VAL 17 0.506 -7.424 0.197
138 3HG1 VAL 17 3HG1 VAL 17 0.337 -6.231 -1.090
139 1HG2 VAL 17 1HG2 VAL 17 -3.127 -5.683 -0.615
140 2HG2 VAL 17 2HG2 VAL 17 -3.264 -7.041 0.502
141 3HG2 VAL 17 3HG2 VAL 17 -2.540 -7.277 -1.089
142 H TYR 18 H TYR 18 1.162 -5.955 1.163
143 HA TYR 18 HA TYR 18 1.402 -3.654 2.848
144 1HB TYR 18 2HB TYR 18 3.321 -4.547 4.184
145 2HB TYR 18 1HB TYR 18 1.786 -5.315 4.572
146 HD1 TYR 18 1HD TYR 18 5.026 -5.788 2.852
147 HD2 TYR 18 2HD TYR 18 1.450 -7.651 4.211
148 HE1 TYR 18 1HE TYR 18 6.014 -7.995 2.413
149 HE2 TYR 18 2HE TYR 18 2.433 -9.861 3.780
150 HH TYR 18 HH TYR 18 5.318 -10.600 3.591
151 H CYS 19 H CYS 19 3.176 -2.383 2.281
152 HA CYS 19 HA CYS 19 4.281 -2.904 -0.319
153 1HB CYS 19 2HB CYS 19 4.681 -0.753 1.720
154 2HB CYS 19 1HB CYS 19 5.519 -0.737 0.174
155 H CYS 20 H CYS 20 6.656 -2.555 -0.699
156 HA CYS 20 HA CYS 20 8.168 -4.461 0.797
157 1HB CYS 20 2HB CYS 20 9.234 -2.400 -1.136
158 2HB CYS 20 1HB CYS 20 9.992 -3.915 -0.675
159 HA PRO 21 HA PRO 21 9.774 -2.039 4.080
160 1HB PRO 21 2HB PRO 21 12.502 -2.849 3.222
161 2HB PRO 21 1HB PRO 21 11.722 -2.957 4.805
162 1HG PRO 21 2HG PRO 21 12.022 -5.134 3.282
163 2HG PRO 21 1HG PRO 21 10.551 -4.888 4.245
164 1HD PRO 21 2HD PRO 21 10.976 -4.535 1.307
165 2HD PRO 21 1HD PRO 21 9.548 -5.131 2.171
166 H GLY 22 H GLY 22 9.680 0.015 3.877
167 1HA GLY 22 2HA GLY 22 11.134 2.019 3.627
168 2HA GLY 22 1HA GLY 22 11.509 1.400 2.025
169 H LEU 23 H LEU 23 8.743 0.521 1.530
170 HA LEU 23 HA LEU 23 7.613 3.168 0.940
171 1HB LEU 23 2HB LEU 23 7.007 0.491 -0.323
172 2HB LEU 23 1HB LEU 23 6.404 2.049 -0.854
173 HG LEU 23 HG LEU 23 9.324 1.286 -0.866
174 1HD1 LEU 23 1HD1 LEU 23 9.008 1.116 -3.331
175 2HD1 LEU 23 2HD1 LEU 23 7.266 1.192 -3.063
176 3HD1 LEU 23 3HD1 LEU 23 8.202 -0.152 -2.409
177 1HD2 LEU 23 1HD2 LEU 23 8.527 3.337 -2.709
178 2HD2 LEU 23 2HD2 LEU 23 9.728 3.397 -1.420
179 3HD2 LEU 23 3HD2 LEU 23 8.041 3.771 -1.070
180 H ILE 24 H ILE 24 5.369 3.541 1.290
181 HA ILE 24 HA ILE 24 4.001 1.520 2.932
182 HB ILE 24 HB ILE 24 3.090 3.274 4.422
183 1HG1 ILE 24 2HG1 ILE 24 3.642 5.186 2.805
184 2HG1 ILE 24 1HG1 ILE 24 3.910 5.480 4.516
185 1HG2 ILE 24 1HG2 ILE 24 6.087 2.996 4.464
186 2HG2 ILE 24 2HG2 ILE 24 4.918 1.874 5.159
187 3HG2 ILE 24 3HG2 ILE 24 5.081 3.500 5.822
188 1HD1 ILE 24 1HD1 ILE 24 6.176 5.580 4.281
189 2HD1 ILE 24 2HD1 ILE 24 5.670 6.188 2.705
190 3HD1 ILE 24 3HD1 ILE 24 6.191 4.511 2.877
191 H CYS 25 H CYS 25 1.931 1.186 2.427
192 HA CYS 25 HA CYS 25 0.792 2.378 0.129
193 1HB CYS 25 2HB CYS 25 0.163 0.133 0.722
194 2HB CYS 25 1HB CYS 25 -0.421 0.657 2.297
195 H GLY 26 H GLY 26 -0.755 3.954 -0.131
196 1HA GLY 26 2HA GLY 26 -1.841 5.235 2.274
197 2HA GLY 26 1HA GLY 26 -0.902 6.216 1.159
198 HA PRO 27 HA PRO 27 -4.812 7.102 -0.748
199 1HB PRO 27 2HB PRO 27 -3.898 8.396 -2.946
200 2HB PRO 27 1HB PRO 27 -3.883 9.116 -1.333
201 1HG PRO 27 2HG PRO 27 -1.657 7.798 -2.840
202 2HG PRO 27 1HG PRO 27 -1.629 9.288 -1.878
203 1HD PRO 27 2HD PRO 27 -0.725 6.913 -0.931
204 2HD PRO 27 1HD PRO 27 -1.453 8.149 0.114
205 H PHE 28 H PHE 28 -4.539 4.561 -1.058
206 HA PHE 28 HA PHE 28 -5.106 2.772 -2.309
207 1HB PHE 28 2HB PHE 28 -5.892 4.908 -4.317
208 2HB PHE 28 1HB PHE 28 -6.075 3.189 -4.651
209 HD1 PHE 28 1HD PHE 28 -8.389 3.025 -4.808
210 HD2 PHE 28 2HD PHE 28 -6.651 4.867 -1.388
211 HE1 PHE 28 1HE PHE 28 -10.585 3.034 -3.701
212 HE2 PHE 28 2HE PHE 28 -8.845 4.878 -0.275
213 HZ PHE 28 HZ PHE 28 -10.815 3.960 -1.431
214 H VAL 29 H VAL 29 -2.436 4.334 -2.541
215 HA VAL 29 HA VAL 29 -1.194 2.412 -4.314
216 HB VAL 29 HB VAL 29 0.203 4.127 -5.478
217 1HG1 VAL 29 1HG1 VAL 29 -1.493 4.871 -7.102
218 2HG1 VAL 29 2HG1 VAL 29 -2.763 4.362 -5.990
219 3HG1 VAL 29 3HG1 VAL 29 -1.663 3.167 -6.678
220 1HG2 VAL 29 1HG2 VAL 29 -1.762 6.081 -4.274
221 2HG2 VAL 29 2HG2 VAL 29 -0.599 6.468 -5.542
222 3HG2 VAL 29 3HG2 VAL 29 -0.033 5.978 -3.946
223 H CYS 30 H CYS 30 1.198 2.524 -3.999
224 HA CYS 30 HA CYS 30 1.725 3.108 -1.202
225 1HB CYS 30 2HB CYS 30 2.350 0.935 -2.469
226 2HB CYS 30 1HB CYS 30 3.662 1.886 -3.149
227 H VAL 31 H VAL 31 3.629 4.316 -0.552
228 HA VAL 31 HA VAL 31 4.749 6.064 -2.620
229 HB VAL 31 HB VAL 31 4.559 8.034 -1.097
230 1HG1 VAL 31 1HG1 VAL 31 1.737 7.446 -1.375
231 2HG1 VAL 31 2HG1 VAL 31 2.652 6.989 -2.812
232 3HG1 VAL 31 3HG1 VAL 31 2.729 8.645 -2.206
233 1HG2 VAL 31 1HG2 VAL 31 4.071 7.631 1.041
234 2HG2 VAL 31 2HG2 VAL 31 3.437 6.026 0.676
235 3HG2 VAL 31 3HG2 VAL 31 2.397 7.441 0.518
Start of MODEL 5
1 1H ALA 1 1HT ALA 1 5.638 -10.368 1.346
2 2H ALA 1 2HT ALA 1 6.540 -11.600 0.614
3 3H ALA 1 3HT ALA 1 4.851 -11.674 0.611
4 HA ALA 1 HA ALA 1 6.594 -10.411 -1.227
5 1HB ALA 1 1HB ALA 1 4.558 -11.942 -1.579
6 2HB ALA 1 2HB ALA 1 4.769 -10.575 -2.674
7 3HB ALA 1 3HB ALA 1 3.598 -10.479 -1.359
8 H CYS 2 H CYS 2 6.736 -8.294 -1.857
9 HA CYS 2 HA CYS 2 5.242 -6.349 -0.209
10 1HB CYS 2 2HB CYS 2 7.121 -4.891 -0.321
11 2HB CYS 2 1HB CYS 2 7.688 -6.466 0.209
12 H SER 3 H SER 3 4.057 -4.888 -1.181
13 HA SER 3 HA SER 3 3.541 -5.102 -3.977
14 1HB SER 3 2HB SER 3 2.530 -2.968 -2.096
15 2HB SER 3 1HB SER 3 1.765 -3.559 -3.571
16 HG SER 3 HG SER 3 0.809 -4.465 -1.702
17 H LYS 4 H LYS 4 3.934 -3.646 -5.605
18 HA LYS 4 HA LYS 4 6.291 -2.088 -5.475
19 1HB LYS 4 2HB LYS 4 5.520 -3.079 -7.565
20 2HB LYS 4 1HB LYS 4 4.040 -2.139 -7.503
21 1HG LYS 4 2HG LYS 4 5.316 -0.089 -7.807
22 2HG LYS 4 1HG LYS 4 6.814 -1.018 -7.834
23 1HD LYS 4 2HD LYS 4 6.142 -0.473 -10.099
24 2HD LYS 4 1HD LYS 4 6.013 -2.211 -9.837
25 1HE LYS 4 2HE LYS 4 3.589 -0.577 -9.337
26 2HE LYS 4 1HE LYS 4 4.092 -0.776 -11.014
27 1HZ LYS 4 1HZ LYS 4 4.036 -3.193 -10.667
28 2HZ LYS 4 2HZ LYS 4 2.523 -2.487 -10.395
29 3HZ LYS 4 3HZ LYS 4 3.477 -2.964 -9.084
30 H LYS 5 H LYS 5 6.543 0.187 -5.422
31 HA LYS 5 HA LYS 5 4.923 1.571 -3.683
32 1HB LYS 5 2HB LYS 5 7.062 2.474 -3.999
33 2HB LYS 5 1HB LYS 5 6.876 2.536 -5.748
34 1HG LYS 5 2HG LYS 5 5.593 4.457 -5.674
35 2HG LYS 5 1HG LYS 5 5.084 4.171 -4.027
36 1HD LYS 5 2HD LYS 5 7.274 4.770 -3.203
37 2HD LYS 5 1HD LYS 5 7.872 4.939 -4.857
38 1HE LYS 5 2HE LYS 5 6.747 6.904 -5.212
39 2HE LYS 5 1HE LYS 5 5.484 6.521 -4.044
40 1HZ LYS 5 1HZ LYS 5 7.162 6.854 -2.264
41 2HZ LYS 5 2HZ LYS 5 6.840 8.258 -3.160
42 3HZ LYS 5 3HZ LYS 5 8.261 7.388 -3.443
43 H TRP 6 H TRP 6 4.951 2.059 -7.199
44 HA TRP 6 HA TRP 6 2.577 3.652 -6.966
45 1HB TRP 6 2HB TRP 6 3.887 2.710 -9.519
46 2HB TRP 6 1HB TRP 6 2.841 4.111 -9.290
47 HD1 TRP 6 HD TRP 6 6.411 2.903 -8.520
48 HE1 TRP 6 1HE TRP 6 7.905 4.948 -8.096
49 HE3 TRP 6 3HE TRP 6 2.824 6.535 -8.472
50 HZ2 TRP 6 2HZ TRP 6 7.603 7.729 -7.759
51 HZ3 TRP 6 3HZ TRP 6 3.505 8.863 -8.080
52 HH2 TRP 6 HH TRP 6 5.848 9.446 -7.722
53 H GLU 7 H GLU 7 2.459 0.863 -6.137
54 HA GLU 7 HA GLU 7 0.723 -0.428 -8.094
55 1HB GLU 7 2HB GLU 7 2.306 -1.533 -6.253
56 2HB GLU 7 1HB GLU 7 0.872 -1.344 -5.253
57 1HG GLU 7 2HG GLU 7 0.684 -3.493 -6.101
58 2HG GLU 7 1HG GLU 7 -0.369 -2.537 -7.147
59 H TYR 8 H TYR 8 -1.511 -0.664 -7.839
60 HA TYR 8 HA TYR 8 -2.827 1.469 -6.442
61 1HB TYR 8 2HB TYR 8 -3.506 0.435 -8.686
62 2HB TYR 8 1HB TYR 8 -4.135 -0.922 -7.764
63 HD1 TYR 8 1HD TYR 8 -6.421 -0.909 -7.581
64 HD2 TYR 8 2HD TYR 8 -4.355 2.810 -7.507
65 HE1 TYR 8 1HE TYR 8 -8.563 0.269 -7.324
66 HE2 TYR 8 2HE TYR 8 -6.492 3.998 -7.244
67 HH TYR 8 HH TYR 8 -8.734 3.625 -6.549
68 H CYS 9 H CYS 9 -1.649 0.430 -4.441
69 HA CYS 9 HA CYS 9 -2.906 -1.795 -3.183
70 1HB CYS 9 2HB CYS 9 -0.585 -1.158 -2.695
71 2HB CYS 9 1HB CYS 9 -1.141 0.367 -2.012
72 H ILE 10 H ILE 10 -5.017 -1.623 -2.753
73 HA ILE 10 HA ILE 10 -5.947 0.758 -1.290
74 HB ILE 10 HB ILE 10 -8.233 0.114 -2.056
75 1HG1 ILE 10 2HG1 ILE 10 -6.736 -1.810 -3.855
76 2HG1 ILE 10 1HG1 ILE 10 -7.741 -2.280 -2.489
77 1HG2 ILE 10 1HG2 ILE 10 -6.042 0.966 -3.859
78 2HG2 ILE 10 2HG2 ILE 10 -7.481 1.837 -3.330
79 3HG2 ILE 10 3HG2 ILE 10 -7.607 0.609 -4.589
80 1HD1 ILE 10 1HD1 ILE 10 -8.668 -2.336 -4.930
81 2HD1 ILE 10 2HD1 ILE 10 -8.938 -0.617 -4.642
82 3HD1 ILE 10 3HD1 ILE 10 -9.689 -1.817 -3.590
83 H VAL 11 H VAL 11 -4.615 -1.596 -0.215
84 HA VAL 11 HA VAL 11 -4.826 -3.326 1.268
85 HB VAL 11 HB VAL 11 -5.725 -2.544 3.469
86 1HG1 VAL 11 1HG1 VAL 11 -4.050 -0.299 2.852
87 2HG1 VAL 11 2HG1 VAL 11 -3.465 -1.742 2.024
88 3HG1 VAL 11 3HG1 VAL 11 -3.676 -1.755 3.774
89 1HG2 VAL 11 1HG2 VAL 11 -6.910 -0.660 3.747
90 2HG2 VAL 11 2HG2 VAL 11 -7.240 -0.787 2.019
91 3HG2 VAL 11 3HG2 VAL 11 -5.926 0.240 2.592
92 HA PRO 12 HA PRO 12 -9.266 -4.529 0.339
93 1HB PRO 12 2HB PRO 12 -8.731 -6.664 -1.245
94 2HB PRO 12 1HB PRO 12 -8.912 -5.025 -1.878
95 1HG PRO 12 2HG PRO 12 -6.423 -6.574 -1.309
96 2HG PRO 12 1HG PRO 12 -6.791 -5.504 -2.674
97 1HD PRO 12 2HD PRO 12 -5.273 -4.748 -0.536
98 2HD PRO 12 1HD PRO 12 -6.241 -3.614 -1.499
99 H ILE 13 H ILE 13 -10.287 -6.017 1.593
100 HA ILE 13 HA ILE 13 -8.937 -7.338 3.636
101 HB ILE 13 HB ILE 13 -11.061 -8.578 4.034
102 1HG1 ILE 13 2HG1 ILE 13 -12.035 -7.050 1.607
103 2HG1 ILE 13 1HG1 ILE 13 -11.736 -8.783 1.653
104 1HG2 ILE 13 1HG2 ILE 13 -11.234 -6.696 5.244
105 2HG2 ILE 13 2HG2 ILE 13 -12.412 -6.222 4.019
106 3HG2 ILE 13 3HG2 ILE 13 -10.743 -5.666 3.899
107 1HD1 ILE 13 1HD1 ILE 13 -13.606 -9.209 2.899
108 2HD1 ILE 13 2HD1 ILE 13 -14.146 -7.823 1.951
109 3HD1 ILE 13 3HD1 ILE 13 -13.625 -7.600 3.622
110 H LEU 14 H LEU 14 -9.733 -8.426 0.434
111 HA LEU 14 HA LEU 14 -9.368 -11.204 0.865
112 1HB LEU 14 2HB LEU 14 -10.595 -10.246 -1.054
113 2HB LEU 14 1HB LEU 14 -9.090 -9.606 -1.682
114 HG LEU 14 HG LEU 14 -8.241 -11.936 -1.910
115 1HD1 LEU 14 1HD1 LEU 14 -10.777 -13.262 -1.880
116 2HD1 LEU 14 2HD1 LEU 14 -10.462 -12.540 -0.302
117 3HD1 LEU 14 3HD1 LEU 14 -9.298 -13.662 -1.007
118 1HD2 LEU 14 1HD2 LEU 14 -10.642 -10.933 -3.367
119 2HD2 LEU 14 2HD2 LEU 14 -10.011 -12.537 -3.739
120 3HD2 LEU 14 3HD2 LEU 14 -8.980 -11.118 -3.926
121 H GLY 15 H GLY 15 -7.174 -8.563 0.407
122 1HA GLY 15 2HA GLY 15 -4.905 -10.021 1.126
123 2HA GLY 15 1HA GLY 15 -4.963 -9.982 -0.631
124 H PHE 16 H PHE 16 -4.881 -7.973 2.257
125 HA PHE 16 HA PHE 16 -4.485 -5.531 0.878
126 1HB PHE 16 2HB PHE 16 -3.664 -4.771 3.217
127 2HB PHE 16 1HB PHE 16 -5.347 -5.236 3.012
128 HD1 PHE 16 1HD PHE 16 -6.290 -6.752 4.462
129 HD2 PHE 16 2HD PHE 16 -2.054 -6.644 4.064
130 HE1 PHE 16 1HE PHE 16 -6.079 -8.357 6.314
131 HE2 PHE 16 2HE PHE 16 -1.837 -8.253 5.912
132 HZ PHE 16 HZ PHE 16 -3.849 -9.111 7.039
133 H VAL 17 H VAL 17 -2.320 -7.989 2.058
134 HA VAL 17 HA VAL 17 -0.073 -8.318 1.886
135 HB VAL 17 HB VAL 17 0.119 -6.314 -0.334
136 1HG1 VAL 17 1HG1 VAL 17 1.185 -8.943 -0.841
137 2HG1 VAL 17 2HG1 VAL 17 1.784 -8.313 0.694
138 3HG1 VAL 17 3HG1 VAL 17 2.017 -7.389 -0.790
139 1HG2 VAL 17 1HG2 VAL 17 -1.320 -8.957 -0.481
140 2HG2 VAL 17 2HG2 VAL 17 -0.689 -8.115 -1.898
141 3HG2 VAL 17 3HG2 VAL 17 -1.938 -7.361 -0.906
142 H TYR 18 H TYR 18 1.838 -6.341 0.951
143 HA TYR 18 HA TYR 18 1.722 -4.019 2.576
144 1HB TYR 18 2HB TYR 18 3.572 -4.621 4.128
145 2HB TYR 18 1HB TYR 18 2.126 -5.586 4.399
146 HD1 TYR 18 1HD TYR 18 2.134 -7.961 4.032
147 HD2 TYR 18 2HD TYR 18 5.581 -5.641 3.109
148 HE1 TYR 18 1HE TYR 18 3.461 -10.021 3.829
149 HE2 TYR 18 2HE TYR 18 6.914 -7.696 2.899
150 HH TYR 18 HH TYR 18 6.395 -10.363 4.076
151 H CYS 19 H CYS 19 3.324 -2.562 2.004
152 HA CYS 19 HA CYS 19 4.645 -3.028 -0.471
153 1HB CYS 19 2HB CYS 19 4.866 -0.865 1.580
154 2HB CYS 19 1HB CYS 19 5.674 -0.778 0.021
155 H CYS 20 H CYS 20 6.991 -2.505 -0.769
156 HA CYS 20 HA CYS 20 8.605 -4.314 0.723
157 1HB CYS 20 2HB CYS 20 9.605 -2.106 -1.071
158 2HB CYS 20 1HB CYS 20 10.399 -3.626 -0.695
159 HA PRO 21 HA PRO 21 9.960 -1.922 4.140
160 1HB PRO 21 2HB PRO 21 12.759 -2.433 3.269
161 2HB PRO 21 1HB PRO 21 11.988 -2.679 4.841
162 1HG PRO 21 2HG PRO 21 12.494 -4.751 3.231
163 2HG PRO 21 1HG PRO 21 11.008 -4.685 4.197
164 1HD PRO 21 2HD PRO 21 11.395 -4.187 1.278
165 2HD PRO 21 1HD PRO 21 10.023 -4.932 2.120
166 H GLY 22 H GLY 22 9.670 0.119 4.026
167 1HA GLY 22 2HA GLY 22 10.864 2.279 3.882
168 2HA GLY 22 1HA GLY 22 11.400 1.759 2.290
169 H LEU 23 H LEU 23 8.780 0.576 1.621
170 HA LEU 23 HA LEU 23 7.412 3.081 0.958
171 1HB LEU 23 2HB LEU 23 7.013 0.326 -0.213
172 2HB LEU 23 1HB LEU 23 6.382 1.836 -0.839
173 HG LEU 23 HG LEU 23 9.320 1.158 -0.703
174 1HD1 LEU 23 1HD1 LEU 23 7.540 1.155 -3.130
175 2HD1 LEU 23 2HD1 LEU 23 7.980 -0.301 -2.237
176 3HD1 LEU 23 3HD1 LEU 23 9.230 0.661 -3.026
177 1HD2 LEU 23 1HD2 LEU 23 8.633 3.120 -2.645
178 2HD2 LEU 23 2HD2 LEU 23 9.673 3.282 -1.230
179 3HD2 LEU 23 3HD2 LEU 23 7.944 3.599 -1.094
180 H ILE 24 H ILE 24 5.163 3.289 1.285
181 HA ILE 24 HA ILE 24 3.844 1.180 2.843
182 HB ILE 24 HB ILE 24 2.886 2.961 4.374
183 1HG1 ILE 24 2HG1 ILE 24 5.286 4.523 3.391
184 2HG1 ILE 24 1HG1 ILE 24 3.608 4.906 3.017
185 1HG2 ILE 24 1HG2 ILE 24 5.841 2.423 4.621
186 2HG2 ILE 24 2HG2 ILE 24 4.560 1.298 5.073
187 3HG2 ILE 24 3HG2 ILE 24 4.731 2.830 5.930
188 1HD1 ILE 24 1HD1 ILE 24 5.090 5.195 5.586
189 2HD1 ILE 24 2HD1 ILE 24 3.336 5.005 5.596
190 3HD1 ILE 24 3HD1 ILE 24 4.072 6.357 4.735
191 H CYS 25 H CYS 25 1.752 0.893 2.325
192 HA CYS 25 HA CYS 25 0.615 2.158 0.085
193 1HB CYS 25 2HB CYS 25 -0.743 0.607 2.302
194 2HB CYS 25 1HB CYS 25 -1.502 1.045 0.778
195 H GLY 26 H GLY 26 -0.772 3.877 -0.165
196 1HA GLY 26 2HA GLY 26 -1.783 5.197 2.253
197 2HA GLY 26 1HA GLY 26 -0.764 6.118 1.160
198 HA PRO 27 HA PRO 27 -4.622 7.398 -0.652
199 1HB PRO 27 2HB PRO 27 -3.588 8.757 -2.765
200 2HB PRO 27 1HB PRO 27 -3.584 9.384 -1.112
201 1HG PRO 27 2HG PRO 27 -1.387 8.026 -2.629
202 2HG PRO 27 1HG PRO 27 -1.308 9.464 -1.594
203 1HD PRO 27 2HD PRO 27 -0.545 7.023 -0.730
204 2HD PRO 27 1HD PRO 27 -1.291 8.218 0.350
205 H PHE 28 H PHE 28 -4.574 4.886 -1.131
206 HA PHE 28 HA PHE 28 -5.264 3.237 -2.505
207 1HB PHE 28 2HB PHE 28 -5.793 5.541 -4.413
208 2HB PHE 28 1HB PHE 28 -6.158 3.866 -4.814
209 HD1 PHE 28 1HD PHE 28 -8.429 3.631 -4.841
210 HD2 PHE 28 2HD PHE 28 -6.637 5.808 -1.653
211 HE1 PHE 28 1HE PHE 28 -10.625 3.841 -3.754
212 HE2 PHE 28 2HE PHE 28 -8.829 6.020 -0.560
213 HZ PHE 28 HZ PHE 28 -10.827 5.036 -1.610
214 H VAL 29 H VAL 29 -2.465 4.558 -2.583
215 HA VAL 29 HA VAL 29 -1.343 2.633 -4.428
216 HB VAL 29 HB VAL 29 0.227 4.291 -5.464
217 1HG1 VAL 29 1HG1 VAL 29 -1.308 3.758 -7.045
218 2HG1 VAL 29 2HG1 VAL 29 -1.710 5.466 -6.864
219 3HG1 VAL 29 3HG1 VAL 29 -2.680 4.240 -6.047
220 1HG2 VAL 29 1HG2 VAL 29 -0.330 6.031 -3.626
221 2HG2 VAL 29 2HG2 VAL 29 -1.667 6.482 -4.685
222 3HG2 VAL 29 3HG2 VAL 29 -0.005 6.590 -5.268
223 H CYS 30 H CYS 30 1.071 2.552 -4.020
224 HA CYS 30 HA CYS 30 1.538 3.033 -1.182
225 1HB CYS 30 2HB CYS 30 2.064 0.825 -2.302
226 2HB CYS 30 1HB CYS 30 3.338 1.654 -3.183
227 H VAL 31 H VAL 31 3.532 4.124 -0.470
228 HA VAL 31 HA VAL 31 4.761 5.833 -2.512
229 HB VAL 31 HB VAL 31 4.638 7.803 -0.966
230 1HG1 VAL 31 1HG1 VAL 31 3.043 8.368 -2.403
231 2HG1 VAL 31 2HG1 VAL 31 1.869 7.701 -1.269
232 3HG1 VAL 31 3HG1 VAL 31 2.514 6.693 -2.566
233 1HG2 VAL 31 1HG2 VAL 31 2.313 7.021 0.507
234 2HG2 VAL 31 2HG2 VAL 31 3.856 7.628 1.104
235 3HG2 VAL 31 3HG2 VAL 31 3.630 5.899 0.844
Start of MODEL 6
1 1H ALA 1 1HT ALA 1 5.012 -11.655 0.547
2 2H ALA 1 2HT ALA 1 3.381 -11.226 0.657
3 3H ALA 1 3HT ALA 1 4.561 -10.247 1.374
4 HA ALA 1 HA ALA 1 5.425 -10.288 -1.148
5 1HB ALA 1 1HB ALA 1 2.881 -11.380 -1.322
6 2HB ALA 1 2HB ALA 1 3.828 -10.706 -2.648
7 3HB ALA 1 3HB ALA 1 2.662 -9.695 -1.793
8 H CYS 2 H CYS 2 5.806 -8.180 -1.727
9 HA CYS 2 HA CYS 2 4.538 -6.137 -0.019
10 1HB CYS 2 2HB CYS 2 6.551 -4.854 -0.212
11 2HB CYS 2 1HB CYS 2 6.963 -6.472 0.324
12 H SER 3 H SER 3 3.448 -4.554 -0.904
13 HA SER 3 HA SER 3 2.773 -4.625 -3.658
14 1HB SER 3 2HB SER 3 2.189 -2.396 -1.702
15 2HB SER 3 1HB SER 3 1.262 -2.846 -3.135
16 HG SER 3 HG SER 3 0.164 -4.068 -1.827
17 H LYS 4 H LYS 4 3.304 -3.268 -5.310
18 HA LYS 4 HA LYS 4 5.847 -1.974 -5.208
19 1HB LYS 4 2HB LYS 4 4.827 -3.163 -7.190
20 2HB LYS 4 1HB LYS 4 3.742 -1.795 -7.369
21 1HG LYS 4 2HG LYS 4 5.680 -0.332 -7.729
22 2HG LYS 4 1HG LYS 4 6.740 -1.738 -7.603
23 1HD LYS 4 2HD LYS 4 4.534 -1.417 -9.642
24 2HD LYS 4 1HD LYS 4 6.237 -1.088 -9.948
25 1HE LYS 4 2HE LYS 4 5.966 -3.238 -10.783
26 2HE LYS 4 1HE LYS 4 6.619 -3.522 -9.174
27 1HZ LYS 4 1HZ LYS 4 3.712 -3.624 -9.832
28 2HZ LYS 4 2HZ LYS 4 4.441 -4.071 -8.373
29 3HZ LYS 4 3HZ LYS 4 4.725 -4.979 -9.768
30 H LYS 5 H LYS 5 6.307 0.228 -5.210
31 HA LYS 5 HA LYS 5 4.801 1.906 -3.697
32 1HB LYS 5 2HB LYS 5 7.073 2.470 -4.079
33 2HB LYS 5 1HB LYS 5 6.819 2.603 -5.816
34 1HG LYS 5 2HG LYS 5 5.762 4.653 -5.635
35 2HG LYS 5 1HG LYS 5 5.314 4.385 -3.966
36 1HD LYS 5 2HD LYS 5 7.603 4.703 -3.258
37 2HD LYS 5 1HD LYS 5 8.123 4.852 -4.941
38 1HE LYS 5 2HE LYS 5 7.206 6.940 -5.187
39 2HE LYS 5 1HE LYS 5 5.981 6.670 -3.947
40 1HZ LYS 5 1HZ LYS 5 7.665 6.880 -2.245
41 2HZ LYS 5 2HZ LYS 5 7.696 8.252 -3.243
42 3HZ LYS 5 3HZ LYS 5 8.881 7.061 -3.415
43 H TRP 6 H TRP 6 5.033 2.508 -7.196
44 HA TRP 6 HA TRP 6 2.646 4.100 -6.999
45 1HB TRP 6 2HB TRP 6 4.079 3.354 -9.550
46 2HB TRP 6 1HB TRP 6 3.068 4.763 -9.241
47 HD1 TRP 6 HD TRP 6 6.579 3.390 -8.502
48 HE1 TRP 6 1HE TRP 6 8.119 5.350 -7.880
49 HE3 TRP 6 3HE TRP 6 3.086 7.103 -8.206
50 HZ2 TRP 6 2HZ TRP 6 7.883 8.103 -7.317
51 HZ3 TRP 6 3HZ TRP 6 3.821 9.372 -7.612
52 HH2 TRP 6 HH TRP 6 6.172 9.860 -7.170
53 H GLU 7 H GLU 7 2.373 1.392 -6.295
54 HA GLU 7 HA GLU 7 0.433 0.544 -8.365
55 1HB GLU 7 2HB GLU 7 2.602 -0.825 -8.156
56 2HB GLU 7 1HB GLU 7 1.962 -1.366 -6.614
57 1HG GLU 7 2HG GLU 7 0.143 -2.464 -7.651
58 2HG GLU 7 1HG GLU 7 0.486 -1.700 -9.207
59 H TYR 8 H TYR 8 -1.453 -0.487 -7.546
60 HA TYR 8 HA TYR 8 -2.475 0.658 -5.204
61 1HB TYR 8 2HB TYR 8 -3.428 -1.653 -6.893
62 2HB TYR 8 1HB TYR 8 -4.318 -1.092 -5.484
63 HD1 TYR 8 1HD TYR 8 -6.187 0.090 -6.093
64 HD2 TYR 8 2HD TYR 8 -2.621 0.640 -8.347
65 HE1 TYR 8 1HE TYR 8 -7.324 1.779 -7.470
66 HE2 TYR 8 2HE TYR 8 -3.747 2.332 -9.728
67 HH TYR 8 HH TYR 8 -6.064 3.978 -9.093
68 H CYS 9 H CYS 9 -2.298 0.127 -3.147
69 HA CYS 9 HA CYS 9 -0.603 -1.890 -2.214
70 1HB CYS 9 2HB CYS 9 -1.139 0.116 -0.912
71 2HB CYS 9 1HB CYS 9 -2.807 -0.416 -0.751
72 H ILE 10 H ILE 10 -4.118 -1.771 -2.510
73 HA ILE 10 HA ILE 10 -5.704 -3.377 -2.675
74 HB ILE 10 HB ILE 10 -3.361 -5.279 -2.817
75 1HG1 ILE 10 2HG1 ILE 10 -3.471 -3.717 -4.695
76 2HG1 ILE 10 1HG1 ILE 10 -3.881 -5.345 -5.224
77 1HG2 ILE 10 1HG2 ILE 10 -4.754 -7.001 -2.713
78 2HG2 ILE 10 2HG2 ILE 10 -5.741 -6.322 -4.007
79 3HG2 ILE 10 3HG2 ILE 10 -6.066 -5.886 -2.329
80 1HD1 ILE 10 1HD1 ILE 10 -5.288 -3.472 -6.148
81 2HD1 ILE 10 2HD1 ILE 10 -5.962 -3.298 -4.528
82 3HD1 ILE 10 3HD1 ILE 10 -6.167 -4.811 -5.410
83 H VAL 11 H VAL 11 -7.019 -4.234 -1.184
84 HA VAL 11 HA VAL 11 -5.851 -5.395 1.228
85 HB VAL 11 HB VAL 11 -7.544 -4.192 2.641
86 1HG1 VAL 11 1HG1 VAL 11 -5.117 -3.141 1.481
87 2HG1 VAL 11 2HG1 VAL 11 -5.695 -3.071 3.145
88 3HG1 VAL 11 3HG1 VAL 11 -6.211 -1.851 1.981
89 1HG2 VAL 11 1HG2 VAL 11 -8.417 -2.031 1.721
90 2HG2 VAL 11 2HG2 VAL 11 -9.145 -3.473 1.012
91 3HG2 VAL 11 3HG2 VAL 11 -7.915 -2.577 0.120
92 HA PRO 12 HA PRO 12 -9.001 -8.300 -0.136
93 1HB PRO 12 2HB PRO 12 -7.774 -10.097 1.811
94 2HB PRO 12 1HB PRO 12 -7.848 -10.245 0.054
95 1HG PRO 12 2HG PRO 12 -5.544 -9.736 1.385
96 2HG PRO 12 1HG PRO 12 -5.859 -9.140 -0.255
97 1HD PRO 12 2HD PRO 12 -6.053 -7.691 2.360
98 2HD PRO 12 1HD PRO 12 -5.406 -7.127 0.803
99 H ILE 13 H ILE 13 -10.881 -9.118 0.787
100 HA ILE 13 HA ILE 13 -11.770 -7.882 3.200
101 HB ILE 13 HB ILE 13 -13.172 -10.133 1.754
102 1HG1 ILE 13 2HG1 ILE 13 -13.325 -7.165 1.163
103 2HG1 ILE 13 1HG1 ILE 13 -12.514 -8.356 0.151
104 1HG2 ILE 13 1HG2 ILE 13 -14.747 -7.938 2.850
105 2HG2 ILE 13 2HG2 ILE 13 -13.806 -8.791 4.074
106 3HG2 ILE 13 3HG2 ILE 13 -14.938 -9.679 3.054
107 1HD1 ILE 13 1HD1 ILE 13 -14.462 -8.331 -0.959
108 2HD1 ILE 13 2HD1 ILE 13 -15.372 -7.742 0.434
109 3HD1 ILE 13 3HD1 ILE 13 -14.965 -9.454 0.306
110 H LEU 14 H LEU 14 -9.834 -8.893 4.302
111 HA LEU 14 HA LEU 14 -10.664 -10.747 6.226
112 1HB LEU 14 2HB LEU 14 -9.082 -12.612 5.664
113 2HB LEU 14 1HB LEU 14 -10.469 -12.483 4.604
114 HG LEU 14 HG LEU 14 -8.784 -11.110 3.099
115 1HD1 LEU 14 1HD1 LEU 14 -7.061 -11.638 5.105
116 2HD1 LEU 14 2HD1 LEU 14 -6.576 -11.381 3.429
117 3HD1 LEU 14 3HD1 LEU 14 -6.760 -13.021 4.052
118 1HD2 LEU 14 1HD2 LEU 14 -9.476 -13.933 3.330
119 2HD2 LEU 14 2HD2 LEU 14 -7.979 -13.642 2.443
120 3HD2 LEU 14 3HD2 LEU 14 -9.478 -12.874 1.921
121 H GLY 15 H GLY 15 -8.329 -8.850 4.609
122 1HA GLY 15 2HA GLY 15 -7.064 -8.030 6.997
123 2HA GLY 15 1HA GLY 15 -6.041 -9.184 6.149
124 H PHE 16 H PHE 16 -4.449 -7.962 5.294
125 HA PHE 16 HA PHE 16 -5.033 -6.290 3.084
126 1HB PHE 16 2HB PHE 16 -4.064 -4.181 4.003
127 2HB PHE 16 1HB PHE 16 -5.598 -4.625 4.732
128 HD1 PHE 16 1HD PHE 16 -1.921 -4.861 5.318
129 HD2 PHE 16 2HD PHE 16 -5.816 -4.685 7.023
130 HE1 PHE 16 1HE PHE 16 -0.927 -4.681 7.561
131 HE2 PHE 16 2HE PHE 16 -4.827 -4.505 9.269
132 HZ PHE 16 HZ PHE 16 -2.380 -4.502 9.540
133 H VAL 17 H VAL 17 -3.108 -5.607 1.962
134 HA VAL 17 HA VAL 17 -0.894 -7.419 2.463
135 HB VAL 17 HB VAL 17 -0.919 -5.409 0.231
136 1HG1 VAL 17 1HG1 VAL 17 0.895 -6.561 -0.348
137 2HG1 VAL 17 2HG1 VAL 17 -0.138 -7.960 -0.640
138 3HG1 VAL 17 3HG1 VAL 17 0.615 -7.734 0.939
139 1HG2 VAL 17 1HG2 VAL 17 -2.354 -8.053 0.075
140 2HG2 VAL 17 2HG2 VAL 17 -2.284 -6.785 -1.150
141 3HG2 VAL 17 3HG2 VAL 17 -3.171 -6.514 0.350
142 H TYR 18 H TYR 18 1.246 -5.944 1.514
143 HA TYR 18 HA TYR 18 1.484 -3.494 3.014
144 1HB TYR 18 2HB TYR 18 3.391 -4.316 4.389
145 2HB TYR 18 1HB TYR 18 1.873 -5.107 4.798
146 HD1 TYR 18 1HD TYR 18 5.166 -5.556 3.209
147 HD2 TYR 18 2HD TYR 18 1.554 -7.465 4.401
148 HE1 TYR 18 1HE TYR 18 6.209 -7.750 2.835
149 HE2 TYR 18 2HE TYR 18 2.590 -9.664 4.033
150 HH TYR 18 HH TYR 18 5.465 -10.372 4.004
151 H CYS 19 H CYS 19 3.187 -2.237 2.310
152 HA CYS 19 HA CYS 19 4.277 -2.880 -0.254
153 1HB CYS 19 2HB CYS 19 4.659 -0.638 1.680
154 2HB CYS 19 1HB CYS 19 5.548 -0.693 0.163
155 H CYS 20 H CYS 20 6.645 -2.534 -0.689
156 HA CYS 20 HA CYS 20 8.179 -4.429 0.770
157 1HB CYS 20 2HB CYS 20 9.279 -2.338 -1.101
158 2HB CYS 20 1HB CYS 20 9.950 -3.921 -0.741
159 HA PRO 21 HA PRO 21 9.869 -2.100 4.081
160 1HB PRO 21 2HB PRO 21 12.573 -2.877 3.118
161 2HB PRO 21 1HB PRO 21 11.847 -3.022 4.723
162 1HG PRO 21 2HG PRO 21 12.101 -5.164 3.146
163 2HG PRO 21 1HG PRO 21 10.663 -4.943 4.160
164 1HD PRO 21 2HD PRO 21 10.988 -4.536 1.218
165 2HD PRO 21 1HD PRO 21 9.588 -5.143 2.122
166 H GLY 22 H GLY 22 9.761 -0.042 3.933
167 1HA GLY 22 2HA GLY 22 11.147 1.996 3.694
168 2HA GLY 22 1HA GLY 22 11.559 1.399 2.092
169 H LEU 23 H LEU 23 8.801 0.450 1.588
170 HA LEU 23 HA LEU 23 7.654 3.058 0.904
171 1HB LEU 23 2HB LEU 23 6.952 0.319 -0.154
172 2HB LEU 23 1HB LEU 23 6.404 1.860 -0.789
173 HG LEU 23 HG LEU 23 9.276 0.926 -0.807
174 1HD1 LEU 23 1HD1 LEU 23 7.588 -0.343 -2.253
175 2HD1 LEU 23 2HD1 LEU 23 9.020 0.315 -3.044
176 3HD1 LEU 23 3HD1 LEU 23 7.471 1.145 -3.192
177 1HD2 LEU 23 1HD2 LEU 23 9.591 3.145 -1.036
178 2HD2 LEU 23 2HD2 LEU 23 7.917 3.443 -1.504
179 3HD2 LEU 23 3HD2 LEU 23 9.074 2.846 -2.695
180 H ILE 24 H ILE 24 5.483 3.529 1.356
181 HA ILE 24 HA ILE 24 4.124 1.646 3.173
182 HB ILE 24 HB ILE 24 3.245 3.640 4.436
183 1HG1 ILE 24 2HG1 ILE 24 5.542 5.055 3.058
184 2HG1 ILE 24 1HG1 ILE 24 3.837 5.347 2.737
185 1HG2 ILE 24 1HG2 ILE 24 5.714 2.261 4.652
186 2HG2 ILE 24 2HG2 ILE 24 4.723 2.954 5.936
187 3HG2 ILE 24 3HG2 ILE 24 5.972 3.930 5.162
188 1HD1 ILE 24 1HD1 ILE 24 4.024 6.978 4.237
189 2HD1 ILE 24 2HD1 ILE 24 5.538 6.338 4.877
190 3HD1 ILE 24 3HD1 ILE 24 3.998 5.696 5.447
191 H CYS 25 H CYS 25 2.034 1.293 2.772
192 HA CYS 25 HA CYS 25 0.834 2.095 0.381
193 1HB CYS 25 2HB CYS 25 -0.442 1.019 2.904
194 2HB CYS 25 1HB CYS 25 -1.260 1.153 1.352
195 H GLY 26 H GLY 26 -0.620 3.668 -0.174
196 1HA GLY 26 2HA GLY 26 -1.494 5.529 1.928
197 2HA GLY 26 1HA GLY 26 -0.639 6.155 0.527
198 HA PRO 27 HA PRO 27 -4.913 6.782 -0.803
199 1HB PRO 27 2HB PRO 27 -4.258 8.251 -3.003
200 2HB PRO 27 1HB PRO 27 -4.333 8.917 -1.368
201 1HG PRO 27 2HG PRO 27 -1.951 7.995 -2.932
202 2HG PRO 27 1HG PRO 27 -2.139 9.448 -1.933
203 1HD PRO 27 2HD PRO 27 -0.853 7.262 -1.034
204 2HD PRO 27 1HD PRO 27 -1.828 8.286 0.041
205 H PHE 28 H PHE 28 -4.642 4.350 -1.249
206 HA PHE 28 HA PHE 28 -5.075 2.582 -2.579
207 1HB PHE 28 2HB PHE 28 -5.850 4.755 -4.545
208 2HB PHE 28 1HB PHE 28 -5.991 3.040 -4.921
209 HD1 PHE 28 1HD PHE 28 -6.858 5.198 -1.983
210 HD2 PHE 28 2HD PHE 28 -8.124 2.274 -4.804
211 HE1 PHE 28 1HE PHE 28 -9.076 5.140 -0.922
212 HE2 PHE 28 2HE PHE 28 -10.344 2.212 -3.748
213 HZ PHE 28 HZ PHE 28 -10.824 3.647 -1.805
214 H VAL 29 H VAL 29 -2.437 3.970 -2.495
215 HA VAL 29 HA VAL 29 -1.126 2.328 -4.495
216 HB VAL 29 HB VAL 29 0.379 4.183 -5.257
217 1HG1 VAL 29 1HG1 VAL 29 -2.386 5.027 -5.991
218 2HG1 VAL 29 2HG1 VAL 29 -1.809 3.422 -6.440
219 3HG1 VAL 29 3HG1 VAL 29 -0.949 4.856 -7.001
220 1HG2 VAL 29 1HG2 VAL 29 0.200 6.329 -4.582
221 2HG2 VAL 29 2HG2 VAL 29 -0.586 5.609 -3.176
222 3HG2 VAL 29 3HG2 VAL 29 -1.560 6.270 -4.489
223 H CYS 30 H CYS 30 1.389 3.631 -4.030
224 HA CYS 30 HA CYS 30 1.771 3.392 -1.144
225 1HB CYS 30 2HB CYS 30 2.209 1.178 -2.379
226 2HB CYS 30 1HB CYS 30 3.572 1.998 -3.124
227 H VAL 31 H VAL 31 3.795 4.413 -0.447
228 HA VAL 31 HA VAL 31 5.097 6.057 -2.494
229 HB VAL 31 HB VAL 31 5.069 8.030 -0.945
230 1HG1 VAL 31 1HG1 VAL 31 3.218 8.879 -1.927
231 2HG1 VAL 31 2HG1 VAL 31 2.208 7.510 -1.459
232 3HG1 VAL 31 3HG1 VAL 31 3.296 7.373 -2.841
233 1HG2 VAL 31 1HG2 VAL 31 3.840 6.144 0.809
234 2HG2 VAL 31 2HG2 VAL 31 2.727 7.483 0.530
235 3HG2 VAL 31 3HG2 VAL 31 4.351 7.800 1.141
Start of MODEL 7
1 1H ALA 1 1HT ALA 1 2.223 -10.728 0.357
2 2H ALA 1 2HT ALA 1 1.692 -11.023 -1.221
3 3H ALA 1 3HT ALA 1 1.415 -9.514 -0.503
4 HA ALA 1 HA ALA 1 4.189 -10.326 -0.603
5 1HB ALA 1 1HB ALA 1 4.410 -9.659 -2.983
6 2HB ALA 1 2HB ALA 1 2.651 -9.667 -3.114
7 3HB ALA 1 3HB ALA 1 3.516 -11.164 -2.763
8 H CYS 2 H CYS 2 5.431 -8.312 -1.372
9 HA CYS 2 HA CYS 2 4.199 -6.032 -0.037
10 1HB CYS 2 2HB CYS 2 6.374 -5.019 -0.086
11 2HB CYS 2 1HB CYS 2 6.539 -6.666 0.487
12 H SER 3 H SER 3 3.280 -4.424 -1.038
13 HA SER 3 HA SER 3 3.008 -4.458 -3.873
14 1HB SER 3 2HB SER 3 1.665 -2.323 -3.373
15 2HB SER 3 1HB SER 3 1.078 -3.837 -2.684
16 HG SER 3 HG SER 3 2.327 -1.663 -1.422
17 H LYS 4 H LYS 4 3.727 -3.058 -5.378
18 HA LYS 4 HA LYS 4 6.196 -1.686 -4.831
19 1HB LYS 4 2HB LYS 4 4.577 -2.370 -7.212
20 2HB LYS 4 1HB LYS 4 5.541 -0.908 -7.348
21 1HG LYS 4 2HG LYS 4 6.613 -3.003 -8.209
22 2HG LYS 4 1HG LYS 4 7.561 -2.092 -7.039
23 1HD LYS 4 2HD LYS 4 7.684 -4.508 -6.638
24 2HD LYS 4 1HD LYS 4 6.944 -3.658 -5.284
25 1HE LYS 4 2HE LYS 4 5.822 -5.795 -5.876
26 2HE LYS 4 1HE LYS 4 4.761 -4.391 -5.929
27 1HZ LYS 4 1HZ LYS 4 5.269 -6.239 -7.953
28 2HZ LYS 4 2HZ LYS 4 5.880 -4.752 -8.470
29 3HZ LYS 4 3HZ LYS 4 4.253 -4.883 -8.007
30 H LYS 5 H LYS 5 6.540 0.618 -5.275
31 HA LYS 5 HA LYS 5 4.911 2.244 -3.821
32 1HB LYS 5 2HB LYS 5 7.108 3.000 -4.318
33 2HB LYS 5 1HB LYS 5 6.786 3.000 -6.048
34 1HG LYS 5 2HG LYS 5 5.611 4.959 -5.969
35 2HG LYS 5 1HG LYS 5 5.091 4.704 -4.318
36 1HD LYS 5 2HD LYS 5 7.324 5.248 -3.515
37 2HD LYS 5 1HD LYS 5 7.875 5.461 -5.180
38 1HE LYS 5 2HE LYS 5 6.705 7.421 -5.462
39 2HE LYS 5 1HE LYS 5 5.510 7.011 -4.234
40 1HZ LYS 5 1HZ LYS 5 8.319 7.847 -3.744
41 2HZ LYS 5 2HZ LYS 5 7.238 7.349 -2.533
42 3HZ LYS 5 3HZ LYS 5 6.927 8.756 -3.428
43 H TRP 6 H TRP 6 5.018 2.690 -7.349
44 HA TRP 6 HA TRP 6 2.453 3.976 -7.182
45 1HB TRP 6 2HB TRP 6 3.889 3.266 -9.738
46 2HB TRP 6 1HB TRP 6 2.764 4.589 -9.444
47 HD1 TRP 6 HD TRP 6 6.408 3.572 -8.800
48 HE1 TRP 6 1HE TRP 6 7.782 5.684 -8.301
49 HE3 TRP 6 3HE TRP 6 2.603 6.964 -8.489
50 HZ2 TRP 6 2HZ TRP 6 7.318 8.420 -7.820
51 HZ3 TRP 6 3HZ TRP 6 3.150 9.310 -7.997
52 HH2 TRP 6 HH TRP 6 5.462 10.021 -7.663
53 H GLU 7 H GLU 7 2.607 1.228 -6.391
54 HA GLU 7 HA GLU 7 0.894 -0.035 -8.445
55 1HB GLU 7 2HB GLU 7 3.052 -1.165 -7.655
56 2HB GLU 7 1HB GLU 7 2.229 -1.421 -6.127
57 1HG GLU 7 2HG GLU 7 0.566 -2.791 -7.201
58 2HG GLU 7 1HG GLU 7 1.267 -2.448 -8.785
59 H TYR 8 H TYR 8 -1.121 -0.781 -7.849
60 HA TYR 8 HA TYR 8 -2.515 0.617 -5.874
61 1HB TYR 8 2HB TYR 8 -3.686 -0.293 -7.771
62 2HB TYR 8 1HB TYR 8 -3.183 -1.929 -7.370
63 HD1 TYR 8 1HD TYR 8 -4.841 -3.276 -6.534
64 HD2 TYR 8 2HD TYR 8 -4.966 0.882 -5.648
65 HE1 TYR 8 1HE TYR 8 -6.926 -3.612 -5.277
66 HE2 TYR 8 2HE TYR 8 -7.049 0.556 -4.386
67 HH TYR 8 HH TYR 8 -8.993 -1.256 -4.477
68 H CYS 9 H CYS 9 -2.987 0.245 -3.792
69 HA CYS 9 HA CYS 9 -2.573 -2.370 -2.614
70 1HB CYS 9 2HB CYS 9 -1.046 -1.565 -0.881
71 2HB CYS 9 1HB CYS 9 -0.337 -1.343 -2.476
72 H ILE 10 H ILE 10 -3.390 -2.496 -0.430
73 HA ILE 10 HA ILE 10 -5.009 -0.282 0.518
74 HB ILE 10 HB ILE 10 -6.879 -2.087 0.958
75 1HG1 ILE 10 2HG1 ILE 10 -7.091 -3.448 -1.250
76 2HG1 ILE 10 1HG1 ILE 10 -5.354 -3.210 -1.377
77 1HG2 ILE 10 1HG2 ILE 10 -7.533 -0.182 -0.154
78 2HG2 ILE 10 2HG2 ILE 10 -7.850 -1.435 -1.355
79 3HG2 ILE 10 3HG2 ILE 10 -6.400 -0.438 -1.481
80 1HD1 ILE 10 1HD1 ILE 10 -5.512 -5.265 -0.356
81 2HD1 ILE 10 2HD1 ILE 10 -6.907 -4.794 0.614
82 3HD1 ILE 10 3HD1 ILE 10 -5.303 -4.185 1.021
83 H VAL 11 H VAL 11 -5.375 -0.354 2.743
84 HA VAL 11 HA VAL 11 -3.469 -1.896 4.194
85 HB VAL 11 HB VAL 11 -4.085 -0.672 6.135
86 1HG1 VAL 11 1HG1 VAL 11 -3.935 1.591 5.430
87 2HG1 VAL 11 2HG1 VAL 11 -4.647 1.222 3.859
88 3HG1 VAL 11 3HG1 VAL 11 -3.041 0.616 4.262
89 1HG2 VAL 11 1HG2 VAL 11 -6.749 -0.616 4.897
90 2HG2 VAL 11 2HG2 VAL 11 -6.273 0.908 5.647
91 3HG2 VAL 11 3HG2 VAL 11 -6.285 -0.577 6.599
92 HA PRO 12 HA PRO 12 -6.029 -5.491 4.701
93 1HB PRO 12 2HB PRO 12 -4.404 -6.816 6.438
94 2HB PRO 12 1HB PRO 12 -4.103 -6.711 4.700
95 1HG PRO 12 2HG PRO 12 -2.904 -5.123 6.931
96 2HG PRO 12 1HG PRO 12 -2.119 -5.811 5.497
97 1HD PRO 12 2HD PRO 12 -2.790 -3.195 5.681
98 2HD PRO 12 1HD PRO 12 -2.795 -4.078 4.141
99 H ILE 13 H ILE 13 -7.171 -3.494 6.074
100 HA ILE 13 HA ILE 13 -8.451 -2.924 7.851
101 HB ILE 13 HB ILE 13 -8.452 -5.879 8.450
102 1HG1 ILE 13 2HG1 ILE 13 -9.043 -5.459 6.106
103 2HG1 ILE 13 1HG1 ILE 13 -10.451 -5.986 7.020
104 1HG2 ILE 13 1HG2 ILE 13 -10.150 -5.542 9.890
105 2HG2 ILE 13 2HG2 ILE 13 -10.860 -4.256 8.914
106 3HG2 ILE 13 3HG2 ILE 13 -9.497 -3.905 9.978
107 1HD1 ILE 13 1HD1 ILE 13 -11.481 -3.947 6.865
108 2HD1 ILE 13 2HD1 ILE 13 -10.609 -4.000 5.333
109 3HD1 ILE 13 3HD1 ILE 13 -9.961 -3.070 6.684
110 H LEU 14 H LEU 14 -7.107 -5.660 9.604
111 HA LEU 14 HA LEU 14 -6.546 -4.085 11.895
112 1HB LEU 14 2HB LEU 14 -5.361 -6.191 12.678
113 2HB LEU 14 1HB LEU 14 -7.069 -6.332 12.320
114 HG LEU 14 HG LEU 14 -6.284 -7.199 10.003
115 1HD1 LEU 14 1HD1 LEU 14 -4.146 -8.255 9.923
116 2HD1 LEU 14 2HD1 LEU 14 -3.814 -7.833 11.603
117 3HD1 LEU 14 3HD1 LEU 14 -3.902 -6.569 10.376
118 1HD2 LEU 14 1HD2 LEU 14 -5.557 -9.317 11.803
119 2HD2 LEU 14 2HD2 LEU 14 -7.003 -9.133 10.813
120 3HD2 LEU 14 3HD2 LEU 14 -6.941 -8.421 12.425
121 H GLY 15 H GLY 15 -4.980 -4.494 9.008
122 1HA GLY 15 2HA GLY 15 -2.464 -3.445 10.151
123 2HA GLY 15 1HA GLY 15 -2.461 -4.633 8.850
124 H PHE 16 H PHE 16 -1.289 -2.036 8.680
125 HA PHE 16 HA PHE 16 -3.056 -0.864 6.645
126 1HB PHE 16 2HB PHE 16 -1.320 0.498 8.657
127 2HB PHE 16 1HB PHE 16 -1.759 1.312 7.170
128 HD1 PHE 16 1HD PHE 16 -3.513 -0.709 9.792
129 HD2 PHE 16 2HD PHE 16 -3.474 2.797 7.381
130 HE1 PHE 16 1HE PHE 16 -5.628 0.016 10.819
131 HE2 PHE 16 2HE PHE 16 -5.589 3.527 8.403
132 HZ PHE 16 HZ PHE 16 -6.669 2.137 10.123
133 H VAL 17 H VAL 17 0.217 -1.764 7.512
134 HA VAL 17 HA VAL 17 1.370 -0.728 5.097
135 HB VAL 17 HB VAL 17 2.756 -2.937 6.487
136 1HG1 VAL 17 1HG1 VAL 17 4.214 -0.475 6.208
137 2HG1 VAL 17 2HG1 VAL 17 3.430 -0.927 4.695
138 3HG1 VAL 17 3HG1 VAL 17 4.523 -2.058 5.494
139 1HG2 VAL 17 1HG2 VAL 17 2.560 -2.128 8.555
140 2HG2 VAL 17 2HG2 VAL 17 1.663 -0.726 7.973
141 3HG2 VAL 17 3HG2 VAL 17 3.426 -0.690 8.016
142 H TYR 18 H TYR 18 2.687 -2.391 3.768
143 HA TYR 18 HA TYR 18 1.890 -5.020 3.374
144 1HB TYR 18 2HB TYR 18 -0.295 -3.821 2.731
145 2HB TYR 18 1HB TYR 18 0.574 -3.238 1.315
146 HD1 TYR 18 1HD TYR 18 0.441 -6.547 3.046
147 HD2 TYR 18 2HD TYR 18 -0.131 -4.381 -0.572
148 HE1 TYR 18 1HE TYR 18 -0.063 -8.649 1.877
149 HE2 TYR 18 2HE TYR 18 -0.641 -6.480 -1.751
150 HH TYR 18 HH TYR 18 -1.527 -8.825 -1.063
151 H CYS 19 H CYS 19 2.940 -2.008 1.993
152 HA CYS 19 HA CYS 19 4.276 -2.863 -0.299
153 1HB CYS 19 2HB CYS 19 4.894 -0.609 1.581
154 2HB CYS 19 1HB CYS 19 5.564 -0.748 -0.038
155 H CYS 20 H CYS 20 6.622 -2.834 -0.669
156 HA CYS 20 HA CYS 20 7.983 -4.673 1.003
157 1HB CYS 20 2HB CYS 20 9.339 -2.794 -0.928
158 2HB CYS 20 1HB CYS 20 9.832 -4.415 -0.466
159 HA PRO 21 HA PRO 21 9.596 -2.136 4.215
160 1HB PRO 21 2HB PRO 21 12.296 -3.173 3.527
161 2HB PRO 21 1HB PRO 21 11.457 -3.108 5.083
162 1HG PRO 21 2HG PRO 21 11.661 -5.410 3.740
163 2HG PRO 21 1HG PRO 21 10.178 -4.995 4.622
164 1HD PRO 21 2HD PRO 21 10.726 -4.910 1.686
165 2HD PRO 21 1HD PRO 21 9.228 -5.327 2.537
166 H GLY 22 H GLY 22 9.619 -0.100 3.853
167 1HA GLY 22 2HA GLY 22 11.294 1.756 3.523
168 2HA GLY 22 1HA GLY 22 11.547 1.040 1.939
169 H LEU 23 H LEU 23 8.756 0.413 1.461
170 HA LEU 23 HA LEU 23 7.832 3.132 0.857
171 1HB LEU 23 2HB LEU 23 7.007 0.477 -0.321
172 2HB LEU 23 1HB LEU 23 6.440 2.049 -0.850
173 HG LEU 23 HG LEU 23 9.319 1.154 -0.990
174 1HD1 LEU 23 1HD1 LEU 23 7.119 1.105 -3.039
175 2HD1 LEU 23 2HD1 LEU 23 8.129 -0.232 -2.489
176 3HD1 LEU 23 3HD1 LEU 23 8.831 1.061 -3.462
177 1HD2 LEU 23 1HD2 LEU 23 9.772 3.125 -2.116
178 2HD2 LEU 23 2HD2 LEU 23 8.640 3.654 -0.872
179 3HD2 LEU 23 3HD2 LEU 23 8.080 3.402 -2.526
180 H ILE 24 H ILE 24 5.646 3.732 1.242
181 HA ILE 24 HA ILE 24 4.216 1.943 3.107
182 HB ILE 24 HB ILE 24 3.331 4.011 4.232
183 1HG1 ILE 24 2HG1 ILE 24 5.658 5.326 2.804
184 2HG1 ILE 24 1HG1 ILE 24 3.957 5.615 2.451
185 1HG2 ILE 24 1HG2 ILE 24 5.235 4.230 5.697
186 2HG2 ILE 24 2HG2 ILE 24 6.306 3.581 4.457
187 3HG2 ILE 24 3HG2 ILE 24 5.078 2.549 5.188
188 1HD1 ILE 24 1HD1 ILE 24 4.764 6.028 5.249
189 2HD1 ILE 24 2HD1 ILE 24 3.690 6.976 4.218
190 3HD1 ILE 24 3HD1 ILE 24 5.439 7.155 4.073
191 H CYS 25 H CYS 25 2.149 1.553 2.667
192 HA CYS 25 HA CYS 25 1.012 2.442 0.220
193 1HB CYS 25 2HB CYS 25 0.563 0.217 1.252
194 2HB CYS 25 1HB CYS 25 -0.356 1.023 2.518
195 H GLY 26 H GLY 26 -0.622 3.901 -0.184
196 1HA GLY 26 2HA GLY 26 -1.654 5.437 2.105
197 2HA GLY 26 1HA GLY 26 -0.883 6.280 0.771
198 HA PRO 27 HA PRO 27 -5.097 6.619 -0.689
199 1HB PRO 27 2HB PRO 27 -4.544 8.038 -2.932
200 2HB PRO 27 1HB PRO 27 -4.552 8.754 -1.317
201 1HG PRO 27 2HG PRO 27 -2.233 7.818 -2.962
202 2HG PRO 27 1HG PRO 27 -2.393 9.294 -1.992
203 1HD PRO 27 2HD PRO 27 -1.053 7.110 -1.116
204 2HD PRO 27 1HD PRO 27 -1.925 8.201 -0.021
205 H PHE 28 H PHE 28 -4.519 4.160 -1.038
206 HA PHE 28 HA PHE 28 -4.884 2.309 -2.268
207 1HB PHE 28 2HB PHE 28 -6.024 4.298 -4.257
208 2HB PHE 28 1HB PHE 28 -6.018 2.560 -4.542
209 HD1 PHE 28 1HD PHE 28 -8.112 1.700 -4.306
210 HD2 PHE 28 2HD PHE 28 -6.813 4.674 -1.552
211 HE1 PHE 28 1HE PHE 28 -10.231 1.484 -3.078
212 HE2 PHE 28 2HE PHE 28 -8.930 4.461 -0.318
213 HZ PHE 28 HZ PHE 28 -10.642 2.864 -1.081
214 H VAL 29 H VAL 29 -2.440 4.113 -2.532
215 HA VAL 29 HA VAL 29 -1.057 2.413 -4.418
216 HB VAL 29 HB VAL 29 0.139 4.320 -5.520
217 1HG1 VAL 29 1HG1 VAL 29 -2.080 5.116 -6.805
218 2HG1 VAL 29 2HG1 VAL 29 -2.706 3.683 -5.989
219 3HG1 VAL 29 3HG1 VAL 29 -1.313 3.548 -7.062
220 1HG2 VAL 29 1HG2 VAL 29 -0.899 6.556 -5.488
221 2HG2 VAL 29 2HG2 VAL 29 -0.309 6.066 -3.898
222 3HG2 VAL 29 3HG2 VAL 29 -2.034 5.999 -4.258
223 H CYS 30 H CYS 30 1.253 2.549 -4.025
224 HA CYS 30 HA CYS 30 1.785 3.236 -1.255
225 1HB CYS 30 2HB CYS 30 2.445 1.052 -2.504
226 2HB CYS 30 1HB CYS 30 3.755 2.019 -3.166
227 H VAL 31 H VAL 31 3.785 4.403 -0.673
228 HA VAL 31 HA VAL 31 4.846 6.150 -2.764
229 HB VAL 31 HB VAL 31 4.671 8.141 -1.244
230 1HG1 VAL 31 1HG1 VAL 31 2.552 6.912 -2.778
231 2HG1 VAL 31 2HG1 VAL 31 3.051 8.602 -2.695
232 3HG1 VAL 31 3HG1 VAL 31 1.914 7.959 -1.510
233 1HG2 VAL 31 1HG2 VAL 31 2.597 7.812 0.387
234 2HG2 VAL 31 2HG2 VAL 31 4.257 7.512 0.900
235 3HG2 VAL 31 3HG2 VAL 31 3.223 6.165 0.424
Start of MODEL 8
1 1H ALA 1 1HT ALA 1 4.965 -11.663 0.916
2 2H ALA 1 2HT ALA 1 5.360 -10.141 1.545
3 3H ALA 1 3HT ALA 1 6.536 -11.061 0.748
4 HA ALA 1 HA ALA 1 5.946 -10.339 -1.243
5 1HB ALA 1 1HB ALA 1 3.670 -11.718 -0.545
6 2HB ALA 1 2HB ALA 1 4.004 -11.017 -2.128
7 3HB ALA 1 3HB ALA 1 3.053 -10.116 -0.948
8 H CYS 2 H CYS 2 5.847 -8.276 -2.082
9 HA CYS 2 HA CYS 2 4.555 -6.201 -0.447
10 1HB CYS 2 2HB CYS 2 6.526 -4.783 -0.624
11 2HB CYS 2 1HB CYS 2 6.902 -6.272 0.228
12 H SER 3 H SER 3 3.563 -4.674 -1.583
13 HA SER 3 HA SER 3 3.371 -4.986 -4.436
14 1HB SER 3 2HB SER 3 2.072 -2.933 -2.626
15 2HB SER 3 1HB SER 3 1.602 -3.317 -4.283
16 HG SER 3 HG SER 3 0.668 -5.111 -3.622
17 H LYS 4 H LYS 4 3.849 -3.412 -5.988
18 HA LYS 4 HA LYS 4 6.231 -1.941 -5.581
19 1HB LYS 4 2HB LYS 4 4.195 -1.858 -7.818
20 2HB LYS 4 1HB LYS 4 5.739 -1.019 -7.861
21 1HG LYS 4 2HG LYS 4 6.945 -2.961 -8.104
22 2HG LYS 4 1HG LYS 4 5.697 -3.956 -7.351
23 1HD LYS 4 2HD LYS 4 5.841 -4.379 -9.755
24 2HD LYS 4 1HD LYS 4 4.280 -3.684 -9.320
25 1HE LYS 4 2HE LYS 4 5.561 -1.428 -9.893
26 2HE LYS 4 1HE LYS 4 6.514 -2.522 -10.896
27 1HZ LYS 4 1HZ LYS 4 3.589 -2.022 -11.020
28 2HZ LYS 4 2HZ LYS 4 4.337 -3.310 -11.829
29 3HZ LYS 4 3HZ LYS 4 4.745 -1.718 -12.225
30 H LYS 5 H LYS 5 6.526 0.352 -5.585
31 HA LYS 5 HA LYS 5 4.907 1.735 -3.858
32 1HB LYS 5 2HB LYS 5 7.091 2.566 -4.168
33 2HB LYS 5 1HB LYS 5 6.861 2.748 -5.903
34 1HG LYS 5 2HG LYS 5 5.612 4.683 -5.665
35 2HG LYS 5 1HG LYS 5 5.159 4.305 -4.020
36 1HD LYS 5 2HD LYS 5 7.376 4.821 -3.235
37 2HD LYS 5 1HD LYS 5 7.940 5.049 -4.894
38 1HE LYS 5 2HE LYS 5 6.843 7.053 -5.140
39 2HE LYS 5 1HE LYS 5 5.622 6.658 -3.930
40 1HZ LYS 5 1HZ LYS 5 7.225 8.376 -3.206
41 2HZ LYS 5 2HZ LYS 5 8.466 7.234 -3.295
42 3HZ LYS 5 3HZ LYS 5 7.201 7.021 -2.186
43 H TRP 6 H TRP 6 5.028 2.517 -7.326
44 HA TRP 6 HA TRP 6 2.567 3.961 -7.021
45 1HB TRP 6 2HB TRP 6 3.980 3.349 -9.618
46 2HB TRP 6 1HB TRP 6 2.881 4.679 -9.269
47 HD1 TRP 6 HD TRP 6 6.484 3.531 -8.586
48 HE1 TRP 6 1HE TRP 6 7.897 5.575 -7.936
49 HE3 TRP 6 3HE TRP 6 2.759 7.001 -8.200
50 HZ2 TRP 6 2HZ TRP 6 7.485 8.296 -7.317
51 HZ3 TRP 6 3HZ TRP 6 3.349 9.301 -7.564
52 HH2 TRP 6 HH TRP 6 5.665 9.932 -7.126
53 H GLU 7 H GLU 7 2.586 1.074 -6.509
54 HA GLU 7 HA GLU 7 0.851 0.088 -8.669
55 1HB GLU 7 2HB GLU 7 2.741 -1.216 -7.199
56 2HB GLU 7 1HB GLU 7 1.287 -1.606 -6.292
57 1HG GLU 7 2HG GLU 7 1.583 -3.357 -7.826
58 2HG GLU 7 1HG GLU 7 0.276 -2.368 -8.473
59 H TYR 8 H TYR 8 -1.306 -0.241 -8.391
60 HA TYR 8 HA TYR 8 -2.658 1.244 -6.407
61 1HB TYR 8 2HB TYR 8 -3.668 0.812 -8.589
62 2HB TYR 8 1HB TYR 8 -3.653 -0.920 -8.288
63 HD1 TYR 8 1HD TYR 8 -5.698 -1.840 -7.801
64 HD2 TYR 8 2HD TYR 8 -4.918 2.150 -6.549
65 HE1 TYR 8 1HE TYR 8 -7.964 -1.699 -6.858
66 HE2 TYR 8 2HE TYR 8 -7.180 2.299 -5.598
67 HH TYR 8 HH TYR 8 -9.072 -0.256 -4.935
68 H CYS 9 H CYS 9 -3.325 0.715 -4.429
69 HA CYS 9 HA CYS 9 -2.475 -1.738 -3.241
70 1HB CYS 9 2HB CYS 9 -4.193 0.493 -2.148
71 2HB CYS 9 1HB CYS 9 -3.587 -0.857 -1.197
72 H ILE 10 H ILE 10 -3.878 -2.883 -5.014
73 HA ILE 10 HA ILE 10 -6.675 -3.162 -4.355
74 HB ILE 10 HB ILE 10 -5.936 -3.332 -6.682
75 1HG1 ILE 10 2HG1 ILE 10 -7.031 -5.968 -5.675
76 2HG1 ILE 10 1HG1 ILE 10 -7.983 -4.518 -5.976
77 1HG2 ILE 10 1HG2 ILE 10 -4.176 -5.453 -5.599
78 2HG2 ILE 10 2HG2 ILE 10 -3.873 -4.250 -6.853
79 3HG2 ILE 10 3HG2 ILE 10 -4.833 -5.684 -7.220
80 1HD1 ILE 10 1HD1 ILE 10 -8.165 -6.155 -7.785
81 2HD1 ILE 10 2HD1 ILE 10 -6.427 -6.033 -8.057
82 3HD1 ILE 10 3HD1 ILE 10 -7.462 -4.633 -8.335
83 H VAL 11 H VAL 11 -5.481 -3.601 -2.097
84 HA VAL 11 HA VAL 11 -4.765 -6.342 -1.644
85 HB VAL 11 HB VAL 11 -4.603 -5.697 0.726
86 1HG1 VAL 11 1HG1 VAL 11 -3.168 -4.441 -1.467
87 2HG1 VAL 11 2HG1 VAL 11 -2.553 -5.184 0.009
88 3HG1 VAL 11 3HG1 VAL 11 -3.085 -3.503 0.023
89 1HG2 VAL 11 1HG2 VAL 11 -5.106 -3.530 1.529
90 2HG2 VAL 11 2HG2 VAL 11 -6.516 -4.033 0.595
91 3HG2 VAL 11 3HG2 VAL 11 -5.355 -2.902 -0.101
92 HA PRO 12 HA PRO 12 -8.854 -7.912 -1.015
93 1HB PRO 12 2HB PRO 12 -7.556 -9.993 0.618
94 2HB PRO 12 1HB PRO 12 -8.485 -10.158 -0.874
95 1HG PRO 12 2HG PRO 12 -5.824 -10.515 -0.823
96 2HG PRO 12 1HG PRO 12 -6.645 -9.788 -2.217
97 1HD PRO 12 2HD PRO 12 -5.099 -8.462 -0.022
98 2HD PRO 12 1HD PRO 12 -5.111 -8.110 -1.764
99 H ILE 13 H ILE 13 -10.374 -7.529 0.494
100 HA ILE 13 HA ILE 13 -9.855 -6.130 2.826
101 HB ILE 13 HB ILE 13 -12.032 -6.046 1.799
102 1HG1 ILE 13 2HG1 ILE 13 -12.248 -7.289 4.551
103 2HG1 ILE 13 1HG1 ILE 13 -11.878 -5.599 4.227
104 1HG2 ILE 13 1HG2 ILE 13 -12.012 -8.468 1.088
105 2HG2 ILE 13 2HG2 ILE 13 -13.558 -7.842 1.662
106 3HG2 ILE 13 3HG2 ILE 13 -12.574 -8.858 2.715
107 1HD1 ILE 13 1HD1 ILE 13 -14.290 -6.292 4.846
108 2HD1 ILE 13 2HD1 ILE 13 -14.389 -6.806 3.161
109 3HD1 ILE 13 3HD1 ILE 13 -14.028 -5.124 3.551
110 H LEU 14 H LEU 14 -10.229 -9.614 2.380
111 HA LEU 14 HA LEU 14 -9.786 -10.018 5.243
112 1HB LEU 14 2HB LEU 14 -10.513 -12.283 4.935
113 2HB LEU 14 1HB LEU 14 -11.677 -11.211 4.188
114 HG LEU 14 HG LEU 14 -9.548 -12.626 2.587
115 1HD1 LEU 14 1HD1 LEU 14 -10.747 -14.522 2.466
116 2HD1 LEU 14 2HD1 LEU 14 -12.293 -13.674 2.523
117 3HD1 LEU 14 3HD1 LEU 14 -11.401 -13.983 4.013
118 1HD2 LEU 14 1HD2 LEU 14 -11.453 -10.654 1.957
119 2HD2 LEU 14 2HD2 LEU 14 -12.046 -12.162 1.261
120 3HD2 LEU 14 3HD2 LEU 14 -10.438 -11.572 0.845
121 H GLY 15 H GLY 15 -7.649 -9.133 3.426
122 1HA GLY 15 2HA GLY 15 -5.548 -10.695 4.391
123 2HA GLY 15 1HA GLY 15 -5.946 -11.311 2.794
124 H PHE 16 H PHE 16 -5.677 -8.081 4.264
125 HA PHE 16 HA PHE 16 -4.766 -6.850 1.918
126 1HB PHE 16 2HB PHE 16 -4.083 -4.970 3.452
127 2HB PHE 16 1HB PHE 16 -5.762 -5.477 3.585
128 HD1 PHE 16 1HD PHE 16 -2.438 -5.749 5.208
129 HD2 PHE 16 2HD PHE 16 -6.651 -6.175 5.630
130 HE1 PHE 16 1HE PHE 16 -2.161 -6.033 7.635
131 HE2 PHE 16 2HE PHE 16 -6.382 -6.458 8.058
132 HZ PHE 16 HZ PHE 16 -4.135 -6.387 9.064
133 H VAL 17 H VAL 17 -2.807 -6.397 1.109
134 HA VAL 17 HA VAL 17 -0.576 -7.962 2.103
135 HB VAL 17 HB VAL 17 -0.348 -6.152 -0.271
136 1HG1 VAL 17 1HG1 VAL 17 1.121 -8.338 0.855
137 2HG1 VAL 17 2HG1 VAL 17 1.554 -7.277 -0.486
138 3HG1 VAL 17 3HG1 VAL 17 0.619 -8.742 -0.786
139 1HG2 VAL 17 1HG2 VAL 17 -1.231 -8.539 -1.346
140 2HG2 VAL 17 2HG2 VAL 17 -2.147 -7.034 -1.253
141 3HG2 VAL 17 3HG2 VAL 17 -2.329 -8.257 0.004
142 H TYR 18 H TYR 18 1.588 -6.463 1.396
143 HA TYR 18 HA TYR 18 1.414 -3.865 2.675
144 1HB TYR 18 2HB TYR 18 3.209 -4.407 4.300
145 2HB TYR 18 1HB TYR 18 1.756 -5.358 4.584
146 HD1 TYR 18 1HD TYR 18 5.253 -5.465 3.467
147 HD2 TYR 18 2HD TYR 18 1.743 -7.758 4.201
148 HE1 TYR 18 1HE TYR 18 6.577 -7.530 3.316
149 HE2 TYR 18 2HE TYR 18 3.059 -9.828 4.058
150 HH TYR 18 HH TYR 18 6.034 -10.164 4.432
151 H CYS 19 H CYS 19 3.159 -2.508 2.153
152 HA CYS 19 HA CYS 19 4.536 -3.186 -0.273
153 1HB CYS 19 2HB CYS 19 4.635 -0.833 1.575
154 2HB CYS 19 1HB CYS 19 5.614 -0.912 0.117
155 H CYS 20 H CYS 20 6.906 -2.925 -0.501
156 HA CYS 20 HA CYS 20 8.281 -4.547 1.390
157 1HB CYS 20 2HB CYS 20 8.876 -3.341 -1.195
158 2HB CYS 20 1HB CYS 20 10.257 -3.331 -0.112
159 HA PRO 21 HA PRO 21 9.774 -1.717 4.358
160 1HB PRO 21 2HB PRO 21 12.536 -2.609 3.718
161 2HB PRO 21 1HB PRO 21 11.688 -2.536 5.268
162 1HG PRO 21 2HG PRO 21 12.055 -4.877 4.032
163 2HG PRO 21 1HG PRO 21 10.539 -4.527 4.884
164 1HD PRO 21 2HD PRO 21 11.115 -4.495 1.947
165 2HD PRO 21 1HD PRO 21 9.651 -5.025 2.790
166 H GLY 22 H GLY 22 9.664 0.283 3.878
167 1HA GLY 22 2HA GLY 22 11.212 2.221 3.403
168 2HA GLY 22 1HA GLY 22 11.470 1.430 1.854
169 H LEU 23 H LEU 23 8.716 0.578 1.517
170 HA LEU 23 HA LEU 23 7.508 3.205 0.962
171 1HB LEU 23 2HB LEU 23 7.147 0.579 -0.493
172 2HB LEU 23 1HB LEU 23 6.270 2.049 -0.857
173 HG LEU 23 HG LEU 23 7.902 1.954 -2.506
174 1HD1 LEU 23 1HD1 LEU 23 8.725 4.003 -2.290
175 2HD1 LEU 23 2HD1 LEU 23 9.685 3.564 -0.878
176 3HD1 LEU 23 3HD1 LEU 23 7.988 4.009 -0.688
177 1HD2 LEU 23 1HD2 LEU 23 9.467 0.388 -2.171
178 2HD2 LEU 23 2HD2 LEU 23 9.519 0.664 -0.430
179 3HD2 LEU 23 3HD2 LEU 23 10.417 1.722 -1.517
180 H ILE 24 H ILE 24 5.253 3.441 1.286
181 HA ILE 24 HA ILE 24 3.919 1.269 2.754
182 HB ILE 24 HB ILE 24 2.964 2.994 4.340
183 1HG1 ILE 24 2HG1 ILE 24 5.327 4.624 3.376
184 2HG1 ILE 24 1HG1 ILE 24 3.641 4.985 3.023
185 1HG2 ILE 24 1HG2 ILE 24 5.900 2.336 4.456
186 2HG2 ILE 24 2HG2 ILE 24 4.564 1.400 5.127
187 3HG2 ILE 24 3HG2 ILE 24 4.970 2.974 5.811
188 1HD1 ILE 24 1HD1 ILE 24 3.190 5.454 5.314
189 2HD1 ILE 24 2HD1 ILE 24 4.642 6.341 4.851
190 3HD1 ILE 24 3HD1 ILE 24 4.778 4.862 5.803
191 H CYS 25 H CYS 25 1.811 1.013 2.233
192 HA CYS 25 HA CYS 25 0.733 2.425 0.029
193 1HB CYS 25 2HB CYS 25 0.041 0.147 0.416
194 2HB CYS 25 1HB CYS 25 -0.597 0.565 2.003
195 H GLY 26 H GLY 26 -0.746 4.050 -0.124
196 1HA GLY 26 2HA GLY 26 -1.868 5.149 2.355
197 2HA GLY 26 1HA GLY 26 -0.889 6.198 1.343
198 HA PRO 27 HA PRO 27 -4.667 7.259 -0.708
199 1HB PRO 27 2HB PRO 27 -3.669 8.484 -2.902
200 2HB PRO 27 1HB PRO 27 -3.596 9.208 -1.291
201 1HG PRO 27 2HG PRO 27 -1.472 7.746 -2.811
202 2HG PRO 27 1HG PRO 27 -1.338 9.221 -1.838
203 1HD PRO 27 2HD PRO 27 -0.610 6.759 -0.927
204 2HD PRO 27 1HD PRO 27 -1.191 8.057 0.134
205 H PHE 28 H PHE 28 -4.461 4.687 -0.982
206 HA PHE 28 HA PHE 28 -5.072 2.895 -2.206
207 1HB PHE 28 2HB PHE 28 -5.903 5.023 -4.206
208 2HB PHE 28 1HB PHE 28 -6.146 3.301 -4.490
209 HD1 PHE 28 1HD PHE 28 -8.286 2.621 -4.156
210 HD2 PHE 28 2HD PHE 28 -6.693 5.640 -1.615
211 HE1 PHE 28 1HE PHE 28 -10.419 2.715 -2.935
212 HE2 PHE 28 2HE PHE 28 -8.823 5.737 -0.388
213 HZ PHE 28 HZ PHE 28 -10.689 4.272 -1.049
214 H VAL 29 H VAL 29 -2.391 4.348 -2.495
215 HA VAL 29 HA VAL 29 -1.257 2.443 -4.360
216 HB VAL 29 HB VAL 29 0.189 4.174 -5.470
217 1HG1 VAL 29 1HG1 VAL 29 -2.544 5.010 -6.231
218 2HG1 VAL 29 2HG1 VAL 29 -2.199 3.281 -6.283
219 3HG1 VAL 29 3HG1 VAL 29 -1.218 4.404 -7.224
220 1HG2 VAL 29 1HG2 VAL 29 -0.736 5.881 -3.559
221 2HG2 VAL 29 2HG2 VAL 29 -1.695 6.365 -4.958
222 3HG2 VAL 29 3HG2 VAL 29 0.065 6.374 -5.051
223 H CYS 30 H CYS 30 1.184 2.506 -4.067
224 HA CYS 30 HA CYS 30 1.726 2.982 -1.251
225 1HB CYS 30 2HB CYS 30 2.345 0.853 -2.617
226 2HB CYS 30 1HB CYS 30 3.680 1.827 -3.214
227 H VAL 31 H VAL 31 3.518 4.238 -0.513
228 HA VAL 31 HA VAL 31 4.729 6.000 -2.520
229 HB VAL 31 HB VAL 31 4.421 7.969 -1.022
230 1HG1 VAL 31 1HG1 VAL 31 2.685 8.499 -2.298
231 2HG1 VAL 31 2HG1 VAL 31 1.631 7.429 -1.373
232 3HG1 VAL 31 3HG1 VAL 31 2.538 6.800 -2.748
233 1HG2 VAL 31 1HG2 VAL 31 3.295 5.951 0.724
234 2HG2 VAL 31 2HG2 VAL 31 2.202 7.316 0.502
235 3HG2 VAL 31 3HG2 VAL 31 3.842 7.587 1.094
Start of MODEL 9
1 1H ALA 1 1HT ALA 1 4.645 -11.515 0.654
2 2H ALA 1 2HT ALA 1 3.033 -11.010 0.643
3 3H ALA 1 3HT ALA 1 4.221 -10.026 1.338
4 HA ALA 1 HA ALA 1 5.218 -10.288 -1.107
5 1HB ALA 1 1HB ALA 1 3.114 -11.594 -1.686
6 2HB ALA 1 2HB ALA 1 3.541 -10.261 -2.759
7 3HB ALA 1 3HB ALA 1 2.257 -10.057 -1.569
8 H CYS 2 H CYS 2 5.676 -8.262 -1.851
9 HA CYS 2 HA CYS 2 4.263 -6.016 -0.550
10 1HB CYS 2 2HB CYS 2 6.377 -4.790 -0.641
11 2HB CYS 2 1HB CYS 2 6.532 -6.258 0.310
12 H SER 3 H SER 3 3.363 -4.578 -1.855
13 HA SER 3 HA SER 3 3.537 -4.949 -4.710
14 1HB SER 3 2HB SER 3 1.978 -2.874 -3.153
15 2HB SER 3 1HB SER 3 1.711 -3.364 -4.827
16 HG SER 3 HG SER 3 0.515 -4.916 -4.102
17 H LYS 4 H LYS 4 4.134 -3.322 -6.215
18 HA LYS 4 HA LYS 4 6.415 -1.800 -5.496
19 1HB LYS 4 2HB LYS 4 4.686 -1.687 -7.977
20 2HB LYS 4 1HB LYS 4 6.198 -0.816 -7.790
21 1HG LYS 4 2HG LYS 4 7.457 -2.819 -7.762
22 2HG LYS 4 1HG LYS 4 6.006 -3.808 -7.577
23 1HD LYS 4 2HD LYS 4 6.410 -2.040 -9.974
24 2HD LYS 4 1HD LYS 4 7.076 -3.673 -9.910
25 1HE LYS 4 2HE LYS 4 5.024 -4.664 -10.019
26 2HE LYS 4 1HE LYS 4 4.216 -3.330 -9.200
27 1HZ LYS 4 1HZ LYS 4 3.756 -2.315 -11.120
28 2HZ LYS 4 2HZ LYS 4 4.061 -3.824 -11.835
29 3HZ LYS 4 3HZ LYS 4 5.277 -2.653 -11.796
30 H LYS 5 H LYS 5 6.607 0.542 -5.634
31 HA LYS 5 HA LYS 5 4.943 1.872 -3.945
32 1HB LYS 5 2HB LYS 5 7.059 2.816 -4.331
33 2HB LYS 5 1HB LYS 5 6.788 2.918 -6.067
34 1HG LYS 5 2HG LYS 5 5.464 4.800 -5.882
35 2HG LYS 5 1HG LYS 5 5.038 4.461 -4.220
36 1HD LYS 5 2HD LYS 5 7.241 5.099 -3.478
37 2HD LYS 5 1HD LYS 5 7.774 5.300 -5.150
38 1HE LYS 5 2HE LYS 5 6.593 7.249 -5.438
39 2HE LYS 5 1HE LYS 5 5.397 6.833 -4.210
40 1HZ LYS 5 1HZ LYS 5 8.188 7.736 -3.744
41 2HZ LYS 5 2HZ LYS 5 7.163 7.171 -2.517
42 3HZ LYS 5 3HZ LYS 5 6.770 8.581 -3.376
43 H TRP 6 H TRP 6 4.862 2.479 -7.454
44 HA TRP 6 HA TRP 6 2.418 3.930 -7.076
45 1HB TRP 6 2HB TRP 6 3.687 3.182 -9.710
46 2HB TRP 6 1HB TRP 6 2.586 4.517 -9.379
47 HD1 TRP 6 HD TRP 6 6.233 3.449 -8.783
48 HE1 TRP 6 1HE TRP 6 7.643 5.545 -8.313
49 HE3 TRP 6 3HE TRP 6 2.480 6.895 -8.461
50 HZ2 TRP 6 2HZ TRP 6 7.218 8.292 -7.846
51 HZ3 TRP 6 3HZ TRP 6 3.062 9.235 -7.989
52 HH2 TRP 6 HH TRP 6 5.385 9.918 -7.682
53 H GLU 7 H GLU 7 2.475 1.027 -6.461
54 HA GLU 7 HA GLU 7 0.510 0.050 -8.438
55 1HB GLU 7 2HB GLU 7 1.846 -1.391 -6.142
56 2HB GLU 7 1HB GLU 7 0.660 -2.109 -7.221
57 1HG GLU 7 2HG GLU 7 3.325 -1.013 -8.064
58 2HG GLU 7 1HG GLU 7 2.973 -2.711 -7.762
59 H TYR 8 H TYR 8 -1.574 -0.517 -7.855
60 HA TYR 8 HA TYR 8 -2.690 0.969 -5.681
61 1HB TYR 8 2HB TYR 8 -3.859 -0.963 -7.681
62 2HB TYR 8 1HB TYR 8 -4.822 -0.305 -6.363
63 HD1 TYR 8 1HD TYR 8 -2.367 1.134 -8.807
64 HD2 TYR 8 2HD TYR 8 -6.246 1.352 -7.071
65 HE1 TYR 8 1HE TYR 8 -2.851 3.132 -10.153
66 HE2 TYR 8 2HE TYR 8 -6.741 3.350 -8.415
67 HH TYR 8 HH TYR 8 -4.823 5.265 -9.634
68 H CYS 9 H CYS 9 -1.890 0.224 -3.779
69 HA CYS 9 HA CYS 9 -1.777 -2.551 -3.107
70 1HB CYS 9 2HB CYS 9 -1.309 -1.530 -0.767
71 2HB CYS 9 1HB CYS 9 -0.133 -1.290 -2.057
72 H ILE 10 H ILE 10 -4.327 -2.211 -3.861
73 HA ILE 10 HA ILE 10 -6.087 -1.608 -1.694
74 HB ILE 10 HB ILE 10 -7.830 -2.719 -3.122
75 1HG1 ILE 10 2HG1 ILE 10 -5.556 -2.945 -5.110
76 2HG1 ILE 10 1HG1 ILE 10 -6.303 -4.302 -4.275
77 1HG2 ILE 10 1HG2 ILE 10 -7.919 -0.502 -3.524
78 2HG2 ILE 10 2HG2 ILE 10 -7.289 -0.980 -5.101
79 3HG2 ILE 10 3HG2 ILE 10 -6.192 -0.382 -3.856
80 1HD1 ILE 10 1HD1 ILE 10 -8.380 -2.857 -5.509
81 2HD1 ILE 10 2HD1 ILE 10 -7.769 -4.461 -5.917
82 3HD1 ILE 10 3HD1 ILE 10 -7.087 -3.033 -6.696
83 H VAL 11 H VAL 11 -6.699 -2.866 -0.065
84 HA VAL 11 HA VAL 11 -5.536 -5.456 0.238
85 HB VAL 11 HB VAL 11 -6.778 -5.522 2.402
86 1HG1 VAL 11 1HG1 VAL 11 -5.547 -3.563 3.401
87 2HG1 VAL 11 2HG1 VAL 11 -5.073 -3.127 1.759
88 3HG1 VAL 11 3HG1 VAL 11 -4.566 -4.671 2.442
89 1HG2 VAL 11 1HG2 VAL 11 -7.511 -2.790 2.605
90 2HG2 VAL 11 2HG2 VAL 11 -8.543 -4.214 2.743
91 3HG2 VAL 11 3HG2 VAL 11 -8.295 -3.452 1.171
92 HA PRO 12 HA PRO 12 -8.839 -7.760 -1.614
93 1HB PRO 12 2HB PRO 12 -7.690 -10.100 -0.283
94 2HB PRO 12 1HB PRO 12 -7.788 -9.736 -2.007
95 1HG PRO 12 2HG PRO 12 -5.451 -9.717 -0.653
96 2HG PRO 12 1HG PRO 12 -5.768 -8.641 -2.026
97 1HD PRO 12 2HD PRO 12 -5.863 -8.050 0.909
98 2HD PRO 12 1HD PRO 12 -5.219 -7.061 -0.419
99 H ILE 13 H ILE 13 -10.795 -8.546 -0.963
100 HA ILE 13 HA ILE 13 -11.783 -7.980 1.556
101 HB ILE 13 HB ILE 13 -13.222 -8.277 -0.398
102 1HG1 ILE 13 2HG1 ILE 13 -15.031 -9.624 0.676
103 2HG1 ILE 13 1HG1 ILE 13 -13.869 -10.144 1.892
104 1HG2 ILE 13 1HG2 ILE 13 -12.488 -10.021 -1.672
105 2HG2 ILE 13 2HG2 ILE 13 -13.846 -10.791 -0.850
106 3HG2 ILE 13 3HG2 ILE 13 -12.200 -11.064 -0.279
107 1HD1 ILE 13 1HD1 ILE 13 -14.526 -8.395 3.082
108 2HD1 ILE 13 2HD1 ILE 13 -15.392 -7.697 1.713
109 3HD1 ILE 13 3HD1 ILE 13 -13.668 -7.389 1.915
110 H LEU 14 H LEU 14 -10.203 -10.891 0.431
111 HA LEU 14 HA LEU 14 -10.750 -12.180 3.008
112 1HB LEU 14 2HB LEU 14 -9.728 -13.360 0.425
113 2HB LEU 14 1HB LEU 14 -9.991 -14.259 1.906
114 HG LEU 14 HG LEU 14 -12.141 -12.865 0.307
115 1HD1 LEU 14 1HD1 LEU 14 -12.636 -15.595 0.412
116 2HD1 LEU 14 2HD1 LEU 14 -10.910 -15.466 0.071
117 3HD1 LEU 14 3HD1 LEU 14 -12.078 -14.672 -0.983
118 1HD2 LEU 14 1HD2 LEU 14 -12.314 -13.189 2.905
119 2HD2 LEU 14 2HD2 LEU 14 -12.665 -14.858 2.459
120 3HD2 LEU 14 3HD2 LEU 14 -13.686 -13.551 1.859
121 H GLY 15 H GLY 15 -8.773 -10.046 2.765
122 1HA GLY 15 2HA GLY 15 -6.710 -11.123 4.272
123 2HA GLY 15 1HA GLY 15 -6.168 -11.202 2.603
124 H PHE 16 H PHE 16 -4.539 -9.737 2.780
125 HA PHE 16 HA PHE 16 -5.182 -7.011 2.467
126 1HB PHE 16 2HB PHE 16 -4.020 -6.116 4.476
127 2HB PHE 16 1HB PHE 16 -5.494 -6.987 4.874
128 HD1 PHE 16 1HD PHE 16 -5.461 -8.744 6.402
129 HD2 PHE 16 2HD PHE 16 -1.793 -7.321 4.778
130 HE1 PHE 16 1HE PHE 16 -4.216 -10.111 8.024
131 HE2 PHE 16 2HE PHE 16 -0.542 -8.691 6.392
132 HZ PHE 16 HZ PHE 16 -1.753 -10.089 8.018
133 H VAL 17 H VAL 17 -3.336 -5.764 1.856
134 HA VAL 17 HA VAL 17 -0.985 -7.435 1.253
135 HB VAL 17 HB VAL 17 -1.400 -4.895 -0.236
136 1HG1 VAL 17 1HG1 VAL 17 0.153 -5.756 -1.567
137 2HG1 VAL 17 2HG1 VAL 17 -0.760 -7.252 -1.775
138 3HG1 VAL 17 3HG1 VAL 17 0.323 -7.064 -0.396
139 1HG2 VAL 17 1HG2 VAL 17 -2.961 -5.770 -1.792
140 2HG2 VAL 17 2HG2 VAL 17 -3.646 -6.044 -0.190
141 3HG2 VAL 17 3HG2 VAL 17 -2.889 -7.375 -1.066
142 H TYR 18 H TYR 18 0.922 -5.692 0.722
143 HA TYR 18 HA TYR 18 1.072 -3.413 2.381
144 1HB TYR 18 2HB TYR 18 2.725 -4.239 4.025
145 2HB TYR 18 1HB TYR 18 1.173 -5.044 4.203
146 HD1 TYR 18 1HD TYR 18 4.642 -5.464 2.988
147 HD2 TYR 18 2HD TYR 18 0.970 -7.399 3.927
148 HE1 TYR 18 1HE TYR 18 5.755 -7.646 2.816
149 HE2 TYR 18 2HE TYR 18 2.077 -9.588 3.760
150 HH TYR 18 HH TYR 18 4.971 -10.218 4.029
151 H CYS 19 H CYS 19 3.061 -2.297 2.124
152 HA CYS 19 HA CYS 19 4.426 -2.976 -0.337
153 1HB CYS 19 2HB CYS 19 4.729 -0.701 1.593
154 2HB CYS 19 1HB CYS 19 5.580 -0.794 0.057
155 H CYS 20 H CYS 20 6.809 -2.890 -0.458
156 HA CYS 20 HA CYS 20 7.987 -4.615 1.494
157 1HB CYS 20 2HB CYS 20 8.716 -3.572 -1.113
158 2HB CYS 20 1HB CYS 20 10.077 -3.539 -0.004
159 HA PRO 21 HA PRO 21 9.612 -1.830 4.439
160 1HB PRO 21 2HB PRO 21 12.323 -2.913 3.877
161 2HB PRO 21 1HB PRO 21 11.451 -2.745 5.407
162 1HG PRO 21 2HG PRO 21 11.686 -5.137 4.238
163 2HG PRO 21 1HG PRO 21 10.178 -4.663 5.043
164 1HD PRO 21 2HD PRO 21 10.819 -4.744 2.121
165 2HD PRO 21 1HD PRO 21 9.306 -5.156 2.940
166 H GLY 22 H GLY 22 9.628 0.158 3.905
167 1HA GLY 22 2HA GLY 22 11.318 1.984 3.429
168 2HA GLY 22 1HA GLY 22 11.539 1.151 1.897
169 H LEU 23 H LEU 23 8.754 0.475 1.524
170 HA LEU 23 HA LEU 23 7.737 3.153 0.854
171 1HB LEU 23 2HB LEU 23 7.075 0.475 -0.380
172 2HB LEU 23 1HB LEU 23 6.452 2.027 -0.905
173 HG LEU 23 HG LEU 23 9.367 1.247 -0.993
174 1HD1 LEU 23 1HD1 LEU 23 9.136 0.572 -3.157
175 2HD1 LEU 23 2HD1 LEU 23 7.716 1.580 -3.438
176 3HD1 LEU 23 3HD1 LEU 23 7.564 0.076 -2.530
177 1HD2 LEU 23 1HD2 LEU 23 7.912 3.572 -2.246
178 2HD2 LEU 23 2HD2 LEU 23 9.639 3.228 -2.350
179 3HD2 LEU 23 3HD2 LEU 23 8.918 3.666 -0.802
180 H ILE 24 H ILE 24 5.532 3.631 1.253
181 HA ILE 24 HA ILE 24 4.148 1.686 2.986
182 HB ILE 24 HB ILE 24 3.230 3.638 4.283
183 1HG1 ILE 24 2HG1 ILE 24 5.548 5.103 2.996
184 2HG1 ILE 24 1HG1 ILE 24 3.850 5.392 2.639
185 1HG2 ILE 24 1HG2 ILE 24 5.841 2.398 4.437
186 2HG2 ILE 24 2HG2 ILE 24 4.672 2.732 5.713
187 3HG2 ILE 24 3HG2 ILE 24 5.815 3.979 5.216
188 1HD1 ILE 24 1HD1 ILE 24 4.639 7.084 4.132
189 2HD1 ILE 24 2HD1 ILE 24 5.257 5.871 5.253
190 3HD1 ILE 24 3HD1 ILE 24 3.519 6.039 5.006
191 H CYS 25 H CYS 25 2.082 1.308 2.522
192 HA CYS 25 HA CYS 25 0.915 2.351 0.156
193 1HB CYS 25 2HB CYS 25 0.422 0.092 0.989
194 2HB CYS 25 1HB CYS 25 -0.353 0.778 2.412
195 H GLY 26 H GLY 26 -0.619 3.915 -0.159
196 1HA GLY 26 2HA GLY 26 -1.658 5.307 2.219
197 2HA GLY 26 1HA GLY 26 -0.853 6.219 0.953
198 HA PRO 27 HA PRO 27 -5.036 6.765 -0.532
199 1HB PRO 27 2HB PRO 27 -4.407 8.275 -2.698
200 2HB PRO 27 1HB PRO 27 -4.419 8.911 -1.049
201 1HG PRO 27 2HG PRO 27 -2.105 7.989 -2.709
202 2HG PRO 27 1HG PRO 27 -2.235 9.417 -1.666
203 1HD PRO 27 2HD PRO 27 -0.973 7.151 -0.889
204 2HD PRO 27 1HD PRO 27 -1.830 8.208 0.252
205 H PHE 28 H PHE 28 -4.536 4.309 -1.000
206 HA PHE 28 HA PHE 28 -4.933 2.535 -2.330
207 1HB PHE 28 2HB PHE 28 -6.004 4.662 -4.207
208 2HB PHE 28 1HB PHE 28 -6.025 2.948 -4.609
209 HD1 PHE 28 1HD PHE 28 -8.101 2.045 -4.408
210 HD2 PHE 28 2HD PHE 28 -6.856 4.937 -1.544
211 HE1 PHE 28 1HE PHE 28 -10.239 1.785 -3.220
212 HE2 PHE 28 2HE PHE 28 -8.991 4.680 -0.351
213 HZ PHE 28 HZ PHE 28 -10.686 3.101 -1.188
214 H VAL 29 H VAL 29 -2.430 4.256 -2.456
215 HA VAL 29 HA VAL 29 -1.079 2.638 -4.431
216 HB VAL 29 HB VAL 29 0.177 4.559 -5.419
217 1HG1 VAL 29 1HG1 VAL 29 -2.290 3.586 -6.180
218 2HG1 VAL 29 2HG1 VAL 29 -1.199 4.558 -7.167
219 3HG1 VAL 29 3HG1 VAL 29 -2.495 5.336 -6.256
220 1HG2 VAL 29 1HG2 VAL 29 -0.959 6.819 -5.287
221 2HG2 VAL 29 2HG2 VAL 29 -0.111 6.288 -3.835
222 3HG2 VAL 29 3HG2 VAL 29 -1.870 6.182 -3.917
223 H CYS 30 H CYS 30 1.214 2.640 -4.024
224 HA CYS 30 HA CYS 30 1.784 3.186 -1.227
225 1HB CYS 30 2HB CYS 30 2.371 1.024 -2.553
226 2HB CYS 30 1HB CYS 30 3.695 1.974 -3.209
227 H VAL 31 H VAL 31 3.735 4.354 -0.593
228 HA VAL 31 HA VAL 31 4.848 6.102 -2.663
229 HB VAL 31 HB VAL 31 4.692 8.073 -1.131
230 1HG1 VAL 31 1HG1 VAL 31 1.946 7.948 -1.323
231 2HG1 VAL 31 2HG1 VAL 31 2.495 6.835 -2.576
232 3HG1 VAL 31 3HG1 VAL 31 3.053 8.508 -2.578
233 1HG2 VAL 31 1HG2 VAL 31 3.511 6.072 0.626
234 2HG2 VAL 31 2HG2 VAL 31 2.544 7.541 0.495
235 3HG2 VAL 31 3HG2 VAL 31 4.228 7.637 1.009
Start of MODEL 10
1 1H ALA 1 1HT ALA 1 5.498 -9.932 2.358
2 2H ALA 1 2HT ALA 1 6.531 -10.933 1.466
3 3H ALA 1 3HT ALA 1 5.009 -11.498 1.942
4 HA ALA 1 HA ALA 1 5.614 -10.384 -0.452
5 1HB ALA 1 1HB ALA 1 3.645 -11.347 -0.821
6 2HB ALA 1 2HB ALA 1 2.846 -10.016 0.016
7 3HB ALA 1 3HB ALA 1 3.350 -11.448 0.914
8 H CYS 2 H CYS 2 5.069 -8.437 -1.510
9 HA CYS 2 HA CYS 2 4.102 -6.200 0.060
10 1HB CYS 2 2HB CYS 2 6.032 -4.799 -0.349
11 2HB CYS 2 1HB CYS 2 6.496 -6.223 0.564
12 H SER 3 H SER 3 5.266 -4.340 -2.035
13 HA SER 3 HA SER 3 4.275 -5.182 -4.557
14 1HB SER 3 2HB SER 3 2.139 -4.859 -3.217
15 2HB SER 3 1HB SER 3 2.543 -3.146 -3.136
16 HG SER 3 HG SER 3 1.313 -3.279 -4.907
17 H LYS 4 H LYS 4 4.236 -3.347 -6.132
18 HA LYS 4 HA LYS 4 6.553 -1.725 -5.784
19 1HB LYS 4 2HB LYS 4 4.429 -1.559 -7.936
20 2HB LYS 4 1HB LYS 4 6.006 -0.785 -7.988
21 1HG LYS 4 2HG LYS 4 6.890 -3.230 -7.702
22 2HG LYS 4 1HG LYS 4 5.292 -3.660 -8.312
23 1HD LYS 4 2HD LYS 4 7.306 -1.872 -9.678
24 2HD LYS 4 1HD LYS 4 6.904 -3.526 -10.134
25 1HE LYS 4 2HE LYS 4 4.915 -1.261 -10.105
26 2HE LYS 4 1HE LYS 4 5.830 -1.741 -11.532
27 1HZ LYS 4 1HZ LYS 4 4.790 -3.888 -11.475
28 2HZ LYS 4 2HZ LYS 4 3.581 -2.705 -11.423
29 3HZ LYS 4 3HZ LYS 4 4.005 -3.536 -10.014
30 H LYS 5 H LYS 5 6.663 0.578 -5.742
31 HA LYS 5 HA LYS 5 5.019 1.782 -3.886
32 1HB LYS 5 2HB LYS 5 7.105 2.798 -4.198
33 2HB LYS 5 1HB LYS 5 6.884 2.925 -5.938
34 1HG LYS 5 2HG LYS 5 5.529 4.788 -5.761
35 2HG LYS 5 1HG LYS 5 5.066 4.419 -4.114
36 1HD LYS 5 2HD LYS 5 7.245 5.071 -3.309
37 2HD LYS 5 1HD LYS 5 7.815 5.306 -4.964
38 1HE LYS 5 2HE LYS 5 6.615 7.244 -5.252
39 2HE LYS 5 1HE LYS 5 5.398 6.797 -4.056
40 1HZ LYS 5 1HZ LYS 5 8.166 7.728 -3.515
41 2HZ LYS 5 2HZ LYS 5 7.120 7.132 -2.321
42 3HZ LYS 5 3HZ LYS 5 6.729 8.548 -3.168
43 H TRP 6 H TRP 6 4.963 2.536 -7.362
44 HA TRP 6 HA TRP 6 2.470 3.909 -6.993
45 1HB TRP 6 2HB TRP 6 3.783 3.263 -9.632
46 2HB TRP 6 1HB TRP 6 2.665 4.574 -9.267
47 HD1 TRP 6 HD TRP 6 6.320 3.531 -8.688
48 HE1 TRP 6 1HE TRP 6 7.709 5.630 -8.172
49 HE3 TRP 6 3HE TRP 6 2.534 6.936 -8.315
50 HZ2 TRP 6 2HZ TRP 6 7.258 8.364 -7.652
51 HZ3 TRP 6 3HZ TRP 6 3.094 9.272 -7.795
52 HH2 TRP 6 HH TRP 6 5.410 9.970 -7.466
53 H GLU 7 H GLU 7 2.645 1.015 -6.437
54 HA GLU 7 HA GLU 7 0.863 -0.110 -8.480
55 1HB GLU 7 2HB GLU 7 2.841 -1.323 -7.194
56 2HB GLU 7 1HB GLU 7 1.598 -1.565 -5.976
57 1HG GLU 7 2HG GLU 7 1.303 -3.471 -7.144
58 2HG GLU 7 1HG GLU 7 0.244 -2.424 -8.091
59 H TYR 8 H TYR 8 -1.261 -0.713 -8.018
60 HA TYR 8 HA TYR 8 -2.631 0.887 -6.117
61 1HB TYR 8 2HB TYR 8 -3.779 0.251 -8.133
62 2HB TYR 8 1HB TYR 8 -3.498 -1.458 -7.828
63 HD1 TYR 8 1HD TYR 8 -5.434 -2.590 -7.352
64 HD2 TYR 8 2HD TYR 8 -4.985 1.366 -5.859
65 HE1 TYR 8 1HE TYR 8 -7.627 -2.762 -6.256
66 HE2 TYR 8 2HE TYR 8 -7.175 1.204 -4.755
67 HH TYR 8 HH TYR 8 -8.852 -1.751 -4.419
68 H CYS 9 H CYS 9 -2.702 0.564 -4.014
69 HA CYS 9 HA CYS 9 -1.942 -1.932 -2.829
70 1HB CYS 9 2HB CYS 9 -2.901 0.677 -1.663
71 2HB CYS 9 1HB CYS 9 -2.546 -0.731 -0.669
72 H ILE 10 H ILE 10 -3.608 -3.251 -3.806
73 HA ILE 10 HA ILE 10 -6.352 -2.881 -3.129
74 HB ILE 10 HB ILE 10 -5.859 -4.083 -5.132
75 1HG1 ILE 10 2HG1 ILE 10 -7.088 -6.223 -4.773
76 2HG1 ILE 10 1HG1 ILE 10 -6.969 -5.960 -3.036
77 1HG2 ILE 10 1HG2 ILE 10 -4.784 -6.385 -4.992
78 2HG2 ILE 10 2HG2 ILE 10 -4.223 -5.895 -3.393
79 3HG2 ILE 10 3HG2 ILE 10 -3.727 -4.983 -4.819
80 1HD1 ILE 10 1HD1 ILE 10 -8.364 -4.132 -4.976
81 2HD1 ILE 10 2HD1 ILE 10 -8.297 -3.947 -3.224
82 3HD1 ILE 10 3HD1 ILE 10 -9.150 -5.318 -3.934
83 H VAL 11 H VAL 11 -6.341 -2.604 -0.896
84 HA VAL 11 HA VAL 11 -5.301 -4.578 0.879
85 HB VAL 11 HB VAL 11 -6.460 -3.297 2.659
86 1HG1 VAL 11 1HG1 VAL 11 -4.321 -2.517 2.347
87 2HG1 VAL 11 2HG1 VAL 11 -5.260 -1.053 2.051
88 3HG1 VAL 11 3HG1 VAL 11 -4.638 -1.990 0.693
89 1HG2 VAL 11 1HG2 VAL 11 -7.248 -1.266 0.604
90 2HG2 VAL 11 2HG2 VAL 11 -7.823 -1.462 2.260
91 3HG2 VAL 11 3HG2 VAL 11 -8.337 -2.594 1.009
92 HA PRO 12 HA PRO 12 -8.683 -7.419 0.805
93 1HB PRO 12 2HB PRO 12 -8.177 -8.689 3.161
94 2HB PRO 12 1HB PRO 12 -7.249 -8.980 1.686
95 1HG PRO 12 2HG PRO 12 -6.579 -7.260 4.039
96 2HG PRO 12 1HG PRO 12 -5.530 -8.348 3.111
97 1HD PRO 12 2HD PRO 12 -5.534 -5.667 2.745
98 2HD PRO 12 1HD PRO 12 -5.214 -6.809 1.425
99 H ILE 13 H ILE 13 -10.705 -7.711 1.739
100 HA ILE 13 HA ILE 13 -11.852 -5.543 3.036
101 HB ILE 13 HB ILE 13 -13.822 -6.926 3.456
102 1HG1 ILE 13 2HG1 ILE 13 -12.521 -9.033 4.039
103 2HG1 ILE 13 1HG1 ILE 13 -13.950 -9.261 3.041
104 1HG2 ILE 13 1HG2 ILE 13 -14.289 -7.566 1.118
105 2HG2 ILE 13 2HG2 ILE 13 -12.584 -7.324 0.742
106 3HG2 ILE 13 3HG2 ILE 13 -13.570 -5.963 1.276
107 1HD1 ILE 13 1HD1 ILE 13 -12.741 -10.307 1.517
108 2HD1 ILE 13 2HD1 ILE 13 -11.326 -10.140 2.557
109 3HD1 ILE 13 3HD1 ILE 13 -11.682 -8.907 1.348
110 H LEU 14 H LEU 14 -11.959 -4.893 5.040
111 HA LEU 14 HA LEU 14 -11.714 -4.731 7.279
112 1HB LEU 14 2HB LEU 14 -12.015 -7.733 7.216
113 2HB LEU 14 1HB LEU 14 -12.043 -6.751 8.668
114 HG LEU 14 HG LEU 14 -14.049 -6.595 6.415
115 1HD1 LEU 14 1HD1 LEU 14 -14.739 -7.459 9.171
116 2HD1 LEU 14 2HD1 LEU 14 -13.932 -8.616 8.113
117 3HD1 LEU 14 3HD1 LEU 14 -15.469 -7.901 7.628
118 1HD2 LEU 14 1HD2 LEU 14 -13.844 -4.443 7.427
119 2HD2 LEU 14 2HD2 LEU 14 -13.848 -5.142 9.046
120 3HD2 LEU 14 3HD2 LEU 14 -15.309 -5.195 8.061
121 H GLY 15 H GLY 15 -9.386 -5.100 5.496
122 1HA GLY 15 2HA GLY 15 -7.434 -5.442 7.602
123 2HA GLY 15 1HA GLY 15 -7.351 -6.661 6.337
124 H PHE 16 H PHE 16 -5.207 -5.835 5.906
125 HA PHE 16 HA PHE 16 -5.188 -3.993 3.756
126 1HB PHE 16 2HB PHE 16 -3.649 -2.312 4.811
127 2HB PHE 16 1HB PHE 16 -5.299 -2.266 5.415
128 HD1 PHE 16 1HD PHE 16 -1.933 -3.656 6.226
129 HD2 PHE 16 2HD PHE 16 -5.693 -2.297 7.687
130 HE1 PHE 16 1HE PHE 16 -1.099 -3.837 8.533
131 HE2 PHE 16 2HE PHE 16 -4.864 -2.477 9.996
132 HZ PHE 16 HZ PHE 16 -2.564 -3.247 10.421
133 H VAL 17 H VAL 17 -3.137 -3.880 2.709
134 HA VAL 17 HA VAL 17 -1.457 -6.192 3.326
135 HB VAL 17 HB VAL 17 -0.935 -4.483 0.937
136 1HG1 VAL 17 1HG1 VAL 17 -0.462 -7.235 1.807
137 2HG1 VAL 17 2HG1 VAL 17 0.451 -6.222 0.688
138 3HG1 VAL 17 3HG1 VAL 17 -0.979 -7.088 0.127
139 1HG2 VAL 17 1HG2 VAL 17 -2.754 -6.241 -0.079
140 2HG2 VAL 17 2HG2 VAL 17 -3.080 -4.548 0.289
141 3HG2 VAL 17 3HG2 VAL 17 -3.495 -5.800 1.459
142 H TYR 18 H TYR 18 0.962 -5.508 2.370
143 HA TYR 18 HA TYR 18 1.782 -2.985 3.556
144 1HB TYR 18 2HB TYR 18 1.959 -4.542 5.432
145 2HB TYR 18 1HB TYR 18 2.903 -5.654 4.448
146 HD1 TYR 18 1HD TYR 18 3.142 -1.957 4.988
147 HD2 TYR 18 2HD TYR 18 5.058 -5.746 5.277
148 HE1 TYR 18 1HE TYR 18 5.217 -0.847 5.703
149 HE2 TYR 18 2HE TYR 18 7.136 -4.646 5.995
150 HH TYR 18 HH TYR 18 7.415 -1.855 7.227
151 H CYS 19 H CYS 19 3.355 -2.060 2.432
152 HA CYS 19 HA CYS 19 4.288 -3.267 0.014
153 1HB CYS 19 2HB CYS 19 4.780 -0.680 1.412
154 2HB CYS 19 1HB CYS 19 5.679 -1.089 -0.042
155 H CYS 20 H CYS 20 6.739 -2.824 -0.487
156 HA CYS 20 HA CYS 20 8.211 -4.617 1.163
157 1HB CYS 20 2HB CYS 20 9.511 -2.773 -0.811
158 2HB CYS 20 1HB CYS 20 9.914 -4.441 -0.428
159 HA PRO 21 HA PRO 21 9.797 -1.959 4.277
160 1HB PRO 21 2HB PRO 21 12.520 -2.856 3.472
161 2HB PRO 21 1HB PRO 21 11.764 -2.783 5.069
162 1HG PRO 21 2HG PRO 21 12.010 -5.115 3.793
163 2HG PRO 21 1HG PRO 21 10.552 -4.741 4.732
164 1HD PRO 21 2HD PRO 21 10.954 -4.741 1.773
165 2HD PRO 21 1HD PRO 21 9.515 -5.180 2.713
166 H GLY 22 H GLY 22 9.644 0.053 3.867
167 1HA GLY 22 2HA GLY 22 11.136 2.039 3.476
168 2HA GLY 22 1HA GLY 22 11.452 1.310 1.909
169 H LEU 23 H LEU 23 8.695 0.416 1.514
170 HA LEU 23 HA LEU 23 7.541 3.031 0.831
171 1HB LEU 23 2HB LEU 23 6.919 0.301 -0.298
172 2HB LEU 23 1HB LEU 23 6.288 1.830 -0.878
173 HG LEU 23 HG LEU 23 9.208 1.068 -0.943
174 1HD1 LEU 23 1HD1 LEU 23 8.898 0.023 -2.880
175 2HD1 LEU 23 2HD1 LEU 23 7.872 1.318 -3.497
176 3HD1 LEU 23 3HD1 LEU 23 7.173 0.032 -2.512
177 1HD2 LEU 23 1HD2 LEU 23 8.056 3.166 -2.679
178 2HD2 LEU 23 2HD2 LEU 23 9.636 3.075 -1.901
179 3HD2 LEU 23 3HD2 LEU 23 8.220 3.554 -0.967
180 H ILE 24 H ILE 24 5.376 3.489 1.281
181 HA ILE 24 HA ILE 24 3.961 1.546 2.988
182 HB ILE 24 HB ILE 24 3.125 3.485 4.371
183 1HG1 ILE 24 2HG1 ILE 24 5.494 4.900 3.123
184 2HG1 ILE 24 1HG1 ILE 24 3.805 5.278 2.802
185 1HG2 ILE 24 1HG2 ILE 24 5.739 2.192 4.448
186 2HG2 ILE 24 2HG2 ILE 24 4.529 2.387 5.717
187 3HG2 ILE 24 3HG2 ILE 24 5.665 3.693 5.371
188 1HD1 ILE 24 1HD1 ILE 24 5.065 5.448 5.526
189 2HD1 ILE 24 2HD1 ILE 24 3.479 6.040 5.034
190 3HD1 ILE 24 3HD1 ILE 24 4.939 6.805 4.408
191 H CYS 25 H CYS 25 1.843 1.311 2.544
192 HA CYS 25 HA CYS 25 0.759 2.468 0.202
193 1HB CYS 25 2HB CYS 25 -0.423 0.781 2.392
194 2HB CYS 25 1HB CYS 25 -1.421 1.418 1.091
195 H GLY 26 H GLY 26 -0.699 4.063 -0.130
196 1HA GLY 26 2HA GLY 26 -1.706 5.538 2.206
197 2HA GLY 26 1HA GLY 26 -0.846 6.396 0.937
198 HA PRO 27 HA PRO 27 -4.941 7.031 -0.727
199 1HB PRO 27 2HB PRO 27 -4.200 8.328 -2.989
200 2HB PRO 27 1HB PRO 27 -4.186 9.090 -1.395
201 1HG PRO 27 2HG PRO 27 -1.919 7.901 -2.948
202 2HG PRO 27 1HG PRO 27 -1.970 9.412 -2.022
203 1HD PRO 27 2HD PRO 27 -0.859 7.137 -1.054
204 2HD PRO 27 1HD PRO 27 -1.647 8.338 -0.011
205 H PHE 28 H PHE 28 -4.552 4.516 -0.988
206 HA PHE 28 HA PHE 28 -5.029 2.660 -2.173
207 1HB PHE 28 2HB PHE 28 -6.012 4.670 -4.223
208 2HB PHE 28 1HB PHE 28 -6.139 2.929 -4.453
209 HD1 PHE 28 1HD PHE 28 -8.229 2.119 -4.088
210 HD2 PHE 28 2HD PHE 28 -6.834 5.312 -1.643
211 HE1 PHE 28 1HE PHE 28 -10.360 2.106 -2.861
212 HE2 PHE 28 2HE PHE 28 -8.962 5.301 -0.409
213 HZ PHE 28 HZ PHE 28 -10.728 3.697 -1.017
214 H VAL 29 H VAL 29 -2.452 4.260 -2.475
215 HA VAL 29 HA VAL 29 -1.215 2.418 -4.342
216 HB VAL 29 HB VAL 29 0.135 4.228 -5.443
217 1HG1 VAL 29 1HG1 VAL 29 -2.057 3.170 -6.369
218 2HG1 VAL 29 2HG1 VAL 29 -1.338 4.562 -7.181
219 3HG1 VAL 29 3HG1 VAL 29 -2.724 4.783 -6.112
220 1HG2 VAL 29 1HG2 VAL 29 -0.081 6.065 -3.979
221 2HG2 VAL 29 2HG2 VAL 29 -1.843 6.010 -4.037
222 3HG2 VAL 29 3HG2 VAL 29 -0.929 6.532 -5.453
223 H CYS 30 H CYS 30 1.181 2.506 -4.008
224 HA CYS 30 HA CYS 30 1.704 3.072 -1.205
225 1HB CYS 30 2HB CYS 30 2.356 0.931 -2.586
226 2HB CYS 30 1HB CYS 30 3.727 1.914 -3.084
227 H VAL 31 H VAL 31 3.629 4.250 -0.536
228 HA VAL 31 HA VAL 31 4.760 6.026 -2.567
229 HB VAL 31 HB VAL 31 4.555 7.986 -1.039
230 1HG1 VAL 31 1HG1 VAL 31 1.804 7.805 -1.257
231 2HG1 VAL 31 2HG1 VAL 31 2.404 6.737 -2.526
232 3HG1 VAL 31 3HG1 VAL 31 2.916 8.424 -2.479
233 1HG2 VAL 31 1HG2 VAL 31 3.040 6.012 0.607
234 2HG2 VAL 31 2HG2 VAL 31 2.592 7.717 0.659
235 3HG2 VAL 31 3HG2 VAL 31 4.224 7.220 1.106
Start of MODEL 11
1 1H ALA 1 1HT ALA 1 4.614 -10.001 1.655
2 2H ALA 1 2HT ALA 1 5.798 -11.031 1.019
3 3H ALA 1 3HT ALA 1 4.168 -11.482 0.967
4 HA ALA 1 HA ALA 1 5.552 -10.257 -1.019
5 1HB ALA 1 1HB ALA 1 3.668 -11.472 -1.613
6 2HB ALA 1 2HB ALA 1 3.150 -9.810 -1.893
7 3HB ALA 1 3HB ALA 1 2.644 -10.657 -0.432
8 H CYS 2 H CYS 2 5.309 -8.197 -2.070
9 HA CYS 2 HA CYS 2 4.169 -6.000 -0.536
10 1HB CYS 2 2HB CYS 2 6.225 -4.721 -0.495
11 2HB CYS 2 1HB CYS 2 6.440 -6.219 0.391
12 H SER 3 H SER 3 3.309 -4.559 -1.872
13 HA SER 3 HA SER 3 3.576 -4.956 -4.716
14 1HB SER 3 2HB SER 3 1.888 -2.973 -3.171
15 2HB SER 3 1HB SER 3 1.733 -3.357 -4.887
16 HG SER 3 HG SER 3 1.094 -5.427 -4.345
17 H LYS 4 H LYS 4 4.073 -3.283 -6.217
18 HA LYS 4 HA LYS 4 6.341 -1.736 -5.500
19 1HB LYS 4 2HB LYS 4 4.690 -2.064 -7.960
20 2HB LYS 4 1HB LYS 4 5.703 -0.631 -7.846
21 1HG LYS 4 2HG LYS 4 6.893 -2.344 -9.026
22 2HG LYS 4 1HG LYS 4 7.663 -2.085 -7.462
23 1HD LYS 4 2HD LYS 4 7.577 -4.318 -7.271
24 2HD LYS 4 1HD LYS 4 5.872 -4.071 -6.891
25 1HE LYS 4 2HE LYS 4 6.972 -4.571 -9.656
26 2HE LYS 4 1HE LYS 4 6.255 -5.803 -8.621
27 1HZ LYS 4 1HZ LYS 4 4.890 -3.423 -9.755
28 2HZ LYS 4 2HZ LYS 4 4.188 -4.462 -8.623
29 3HZ LYS 4 3HZ LYS 4 4.618 -5.043 -10.154
30 H LYS 5 H LYS 5 6.516 0.623 -5.740
31 HA LYS 5 HA LYS 5 4.855 1.958 -4.016
32 1HB LYS 5 2HB LYS 5 6.971 2.913 -4.453
33 2HB LYS 5 1HB LYS 5 6.661 2.999 -6.183
34 1HG LYS 5 2HG LYS 5 5.330 4.868 -5.985
35 2HG LYS 5 1HG LYS 5 4.926 4.528 -4.318
36 1HD LYS 5 2HD LYS 5 7.139 5.180 -3.605
37 2HD LYS 5 1HD LYS 5 7.634 5.412 -5.284
38 1HE LYS 5 2HE LYS 5 6.424 7.345 -5.520
39 2HE LYS 5 1HE LYS 5 5.245 6.887 -4.294
40 1HZ LYS 5 1HZ LYS 5 7.035 7.221 -2.611
41 2HZ LYS 5 2HZ LYS 5 6.572 8.639 -3.419
42 3HZ LYS 5 3HZ LYS 5 8.013 7.862 -3.840
43 H TRP 6 H TRP 6 4.811 2.537 -7.516
44 HA TRP 6 HA TRP 6 2.268 3.836 -7.237
45 1HB TRP 6 2HB TRP 6 3.643 3.189 -9.840
46 2HB TRP 6 1HB TRP 6 2.511 4.494 -9.494
47 HD1 TRP 6 HD TRP 6 6.169 3.483 -8.860
48 HE1 TRP 6 1HE TRP 6 7.538 5.598 -8.364
49 HE3 TRP 6 3HE TRP 6 2.356 6.870 -8.580
50 HZ2 TRP 6 2HZ TRP 6 7.065 8.337 -7.895
51 HZ3 TRP 6 3HZ TRP 6 2.897 9.218 -8.095
52 HH2 TRP 6 HH TRP 6 5.205 9.935 -7.753
53 H GLU 7 H GLU 7 2.404 1.041 -6.515
54 HA GLU 7 HA GLU 7 1.054 -0.436 -8.624
55 1HB GLU 7 2HB GLU 7 2.523 -1.256 -6.546
56 2HB GLU 7 1HB GLU 7 0.942 -1.333 -5.785
57 1HG GLU 7 2HG GLU 7 0.934 -3.416 -6.595
58 2HG GLU 7 1HG GLU 7 0.436 -2.629 -8.095
59 H TYR 8 H TYR 8 -0.534 -1.395 -5.986
60 HA TYR 8 HA TYR 8 -2.560 0.613 -5.719
61 1HB TYR 8 2HB TYR 8 -3.259 -0.378 -7.862
62 2HB TYR 8 1HB TYR 8 -3.221 -1.984 -7.146
63 HD1 TYR 8 1HD TYR 8 -4.759 1.329 -6.307
64 HD2 TYR 8 2HD TYR 8 -5.291 -2.874 -6.689
65 HE1 TYR 8 1HE TYR 8 -7.111 1.572 -5.638
66 HE2 TYR 8 2HE TYR 8 -7.646 -2.641 -6.021
67 HH TYR 8 HH TYR 8 -9.163 0.474 -5.689
68 H CYS 9 H CYS 9 -3.533 0.366 -3.766
69 HA CYS 9 HA CYS 9 -3.755 -2.209 -2.503
70 1HB CYS 9 2HB CYS 9 -2.389 -1.482 -0.493
71 2HB CYS 9 1HB CYS 9 -1.468 -1.875 -1.940
72 H ILE 10 H ILE 10 -5.292 -2.232 -0.939
73 HA ILE 10 HA ILE 10 -6.451 0.356 -0.172
74 HB ILE 10 HB ILE 10 -7.959 -0.646 -1.740
75 1HG1 ILE 10 2HG1 ILE 10 -9.999 -0.934 -0.370
76 2HG1 ILE 10 1HG1 ILE 10 -8.997 -1.058 1.072
77 1HG2 ILE 10 1HG2 ILE 10 -7.393 -2.899 -1.852
78 2HG2 ILE 10 2HG2 ILE 10 -9.019 -2.901 -1.170
79 3HG2 ILE 10 3HG2 ILE 10 -7.622 -3.142 -0.120
80 1HD1 ILE 10 1HD1 ILE 10 -10.142 1.219 0.185
81 2HD1 ILE 10 2HD1 ILE 10 -8.541 1.345 -0.543
82 3HD1 ILE 10 3HD1 ILE 10 -8.702 1.156 1.203
83 H VAL 11 H VAL 11 -4.948 0.131 1.618
84 HA VAL 11 HA VAL 11 -5.391 -1.957 3.547
85 HB VAL 11 HB VAL 11 -3.764 -0.728 4.951
86 1HG1 VAL 11 1HG1 VAL 11 -3.280 -1.803 2.295
87 2HG1 VAL 11 2HG1 VAL 11 -2.418 -2.090 3.808
88 3HG1 VAL 11 3HG1 VAL 11 -2.016 -0.688 2.816
89 1HG2 VAL 11 1HG2 VAL 11 -3.709 1.234 2.656
90 2HG2 VAL 11 2HG2 VAL 11 -2.586 1.217 4.016
91 3HG2 VAL 11 3HG2 VAL 11 -4.296 1.553 4.289
92 HA PRO 12 HA PRO 12 -8.698 -0.109 5.804
93 1HB PRO 12 2HB PRO 12 -8.070 -1.061 8.316
94 2HB PRO 12 1HB PRO 12 -8.922 -1.988 7.078
95 1HG PRO 12 2HG PRO 12 -6.034 -2.046 7.839
96 2HG PRO 12 1HG PRO 12 -7.109 -3.388 7.404
97 1HD PRO 12 2HD PRO 12 -5.316 -2.386 5.667
98 2HD PRO 12 1HD PRO 12 -6.902 -2.982 5.135
99 H ILE 13 H ILE 13 -9.057 1.757 6.853
100 HA ILE 13 HA ILE 13 -7.092 3.668 7.222
101 HB ILE 13 HB ILE 13 -9.761 3.592 8.639
102 1HG1 ILE 13 2HG1 ILE 13 -9.067 4.719 5.915
103 2HG1 ILE 13 1HG1 ILE 13 -9.963 3.230 6.194
104 1HG2 ILE 13 1HG2 ILE 13 -8.153 5.989 7.776
105 2HG2 ILE 13 2HG2 ILE 13 -8.089 5.303 9.399
106 3HG2 ILE 13 3HG2 ILE 13 -9.601 5.965 8.780
107 1HD1 ILE 13 1HD1 ILE 13 -10.821 6.050 6.505
108 2HD1 ILE 13 2HD1 ILE 13 -11.528 4.837 7.573
109 3HD1 ILE 13 3HD1 ILE 13 -11.682 4.669 5.825
110 H LEU 14 H LEU 14 -8.235 1.248 9.440
111 HA LEU 14 HA LEU 14 -7.377 2.320 11.871
112 1HB LEU 14 2HB LEU 14 -7.615 -0.546 10.963
113 2HB LEU 14 1HB LEU 14 -7.220 -0.094 12.608
114 HG LEU 14 HG LEU 14 -9.520 -0.599 12.611
115 1HD1 LEU 14 1HD1 LEU 14 -8.618 1.863 13.361
116 2HD1 LEU 14 2HD1 LEU 14 -10.203 1.192 13.746
117 3HD1 LEU 14 3HD1 LEU 14 -10.012 2.263 12.358
118 1HD2 LEU 14 1HD2 LEU 14 -9.543 -0.097 9.972
119 2HD2 LEU 14 2HD2 LEU 14 -10.353 1.352 10.565
120 3HD2 LEU 14 3HD2 LEU 14 -11.003 -0.240 10.952
121 H GLY 15 H GLY 15 -5.601 0.779 9.298
122 1HA GLY 15 2HA GLY 15 -3.206 1.541 9.291
123 2HA GLY 15 1HA GLY 15 -3.152 0.936 10.941
124 H PHE 16 H PHE 16 -2.086 0.236 8.023
125 HA PHE 16 HA PHE 16 -1.532 -2.474 8.584
126 1HB PHE 16 2HB PHE 16 -3.928 -2.709 7.919
127 2HB PHE 16 1HB PHE 16 -3.529 -2.020 6.351
128 HD1 PHE 16 1HD PHE 16 -1.851 -4.601 8.463
129 HD2 PHE 16 2HD PHE 16 -3.709 -3.655 4.752
130 HE1 PHE 16 1HE PHE 16 -1.308 -6.849 7.622
131 HE2 PHE 16 2HE PHE 16 -3.170 -5.900 3.905
132 HZ PHE 16 HZ PHE 16 -1.968 -7.500 5.340
133 H VAL 17 H VAL 17 0.196 -3.123 7.387
134 HA VAL 17 HA VAL 17 1.078 -1.291 5.259
135 HB VAL 17 HB VAL 17 2.967 -3.294 6.384
136 1HG1 VAL 17 1HG1 VAL 17 4.267 -2.069 5.061
137 2HG1 VAL 17 2HG1 VAL 17 4.172 -0.811 6.293
138 3HG1 VAL 17 3HG1 VAL 17 3.057 -0.793 4.927
139 1HG2 VAL 17 1HG2 VAL 17 3.501 -1.370 8.131
140 2HG2 VAL 17 2HG2 VAL 17 2.367 -2.671 8.495
141 3HG2 VAL 17 3HG2 VAL 17 1.765 -1.096 7.979
142 H TYR 18 H TYR 18 2.760 -2.730 3.813
143 HA TYR 18 HA TYR 18 2.192 -5.389 3.243
144 1HB TYR 18 2HB TYR 18 -0.061 -4.435 2.595
145 2HB TYR 18 1HB TYR 18 0.758 -3.554 1.308
146 HD1 TYR 18 1HD TYR 18 1.093 -7.053 2.572
147 HD2 TYR 18 2HD TYR 18 0.218 -4.518 -0.729
148 HE1 TYR 18 1HE TYR 18 0.921 -9.025 1.114
149 HE2 TYR 18 2HE TYR 18 0.040 -6.484 -2.197
150 HH TYR 18 HH TYR 18 -0.393 -8.888 -2.017
151 H CYS 19 H CYS 19 3.012 -2.229 1.959
152 HA CYS 19 HA CYS 19 4.497 -2.973 -0.283
153 1HB CYS 19 2HB CYS 19 4.764 -0.670 1.603
154 2HB CYS 19 1HB CYS 19 5.648 -0.758 0.087
155 H CYS 20 H CYS 20 6.827 -2.859 -0.586
156 HA CYS 20 HA CYS 20 8.228 -4.598 1.124
157 1HB CYS 20 2HB CYS 20 9.589 -2.640 -0.715
158 2HB CYS 20 1HB CYS 20 10.089 -4.270 -0.294
159 HA PRO 21 HA PRO 21 9.670 -2.048 4.415
160 1HB PRO 21 2HB PRO 21 12.430 -2.925 3.735
161 2HB PRO 21 1HB PRO 21 11.578 -2.932 5.284
162 1HG PRO 21 2HG PRO 21 11.913 -5.196 3.905
163 2HG PRO 21 1HG PRO 21 10.404 -4.876 4.782
164 1HD PRO 21 2HD PRO 21 10.967 -4.719 1.853
165 2HD PRO 21 1HD PRO 21 9.485 -5.220 2.689
166 H GLY 22 H GLY 22 9.596 -0.005 4.101
167 1HA GLY 22 2HA GLY 22 11.101 1.972 3.832
168 2HA GLY 22 1HA GLY 22 11.517 1.281 2.270
169 H LEU 23 H LEU 23 8.826 0.420 1.624
170 HA LEU 23 HA LEU 23 7.733 3.034 0.889
171 1HB LEU 23 2HB LEU 23 7.159 0.269 -0.190
172 2HB LEU 23 1HB LEU 23 6.412 1.743 -0.769
173 HG LEU 23 HG LEU 23 8.801 2.512 -1.341
174 1HD1 LEU 23 1HD1 LEU 23 9.851 0.630 -0.016
175 2HD1 LEU 23 2HD1 LEU 23 10.473 0.876 -1.648
176 3HD1 LEU 23 3HD1 LEU 23 9.349 -0.443 -1.323
177 1HD2 LEU 23 1HD2 LEU 23 7.448 2.120 -3.160
178 2HD2 LEU 23 2HD2 LEU 23 7.198 0.425 -2.743
179 3HD2 LEU 23 3HD2 LEU 23 8.740 0.949 -3.418
180 H ILE 24 H ILE 24 5.526 3.530 1.232
181 HA ILE 24 HA ILE 24 4.094 1.668 3.012
182 HB ILE 24 HB ILE 24 3.213 3.672 4.266
183 1HG1 ILE 24 2HG1 ILE 24 5.604 5.030 2.998
184 2HG1 ILE 24 1HG1 ILE 24 3.922 5.381 2.618
185 1HG2 ILE 24 1HG2 ILE 24 5.828 2.396 4.468
186 2HG2 ILE 24 2HG2 ILE 24 4.591 2.655 5.698
187 3HG2 ILE 24 3HG2 ILE 24 5.730 3.945 5.308
188 1HD1 ILE 24 1HD1 ILE 24 5.357 6.797 4.359
189 2HD1 ILE 24 2HD1 ILE 24 4.699 5.582 5.456
190 3HD1 ILE 24 3HD1 ILE 24 3.611 6.586 4.498
191 H CYS 25 H CYS 25 2.015 1.353 2.540
192 HA CYS 25 HA CYS 25 0.906 2.438 0.159
193 1HB CYS 25 2HB CYS 25 0.336 0.183 0.948
194 2HB CYS 25 1HB CYS 25 -0.428 0.868 2.377
195 H GLY 26 H GLY 26 -0.740 3.943 -0.127
196 1HA GLY 26 2HA GLY 26 -1.746 5.337 2.248
197 2HA GLY 26 1HA GLY 26 -0.867 6.272 1.048
198 HA PRO 27 HA PRO 27 -4.894 7.007 -0.701
199 1HB PRO 27 2HB PRO 27 -3.479 8.119 -3.011
200 2HB PRO 27 1HB PRO 27 -4.510 8.934 -1.832
201 1HG PRO 27 2HG PRO 27 -1.843 9.323 -1.919
202 2HG PRO 27 1HG PRO 27 -2.758 9.368 -0.402
203 1HD PRO 27 2HD PRO 27 -1.080 7.157 -1.537
204 2HD PRO 27 1HD PRO 27 -1.177 7.752 0.135
205 H PHE 28 H PHE 28 -4.545 4.482 -0.986
206 HA PHE 28 HA PHE 28 -5.055 2.653 -2.202
207 1HB PHE 28 2HB PHE 28 -5.943 4.699 -4.267
208 2HB PHE 28 1HB PHE 28 -6.116 2.963 -4.494
209 HD1 PHE 28 1HD PHE 28 -8.275 2.301 -4.264
210 HD2 PHE 28 2HD PHE 28 -6.776 5.293 -1.635
211 HE1 PHE 28 1HE PHE 28 -10.444 2.366 -3.107
212 HE2 PHE 28 2HE PHE 28 -8.941 5.360 -0.470
213 HZ PHE 28 HZ PHE 28 -10.779 3.895 -1.206
214 H VAL 29 H VAL 29 -2.448 4.271 -2.469
215 HA VAL 29 HA VAL 29 -1.197 2.424 -4.320
216 HB VAL 29 HB VAL 29 0.129 4.221 -5.448
217 1HG1 VAL 29 1HG1 VAL 29 -2.735 3.749 -5.899
218 2HG1 VAL 29 2HG1 VAL 29 -1.367 3.606 -7.002
219 3HG1 VAL 29 3HG1 VAL 29 -2.079 5.187 -6.681
220 1HG2 VAL 29 1HG2 VAL 29 -0.853 5.880 -3.519
221 2HG2 VAL 29 2HG2 VAL 29 -1.844 6.323 -4.908
222 3HG2 VAL 29 3HG2 VAL 29 -0.085 6.412 -5.015
223 H CYS 30 H CYS 30 1.183 2.536 -4.042
224 HA CYS 30 HA CYS 30 1.793 3.091 -1.255
225 1HB CYS 30 2HB CYS 30 2.415 0.945 -2.603
226 2HB CYS 30 1HB CYS 30 3.715 1.935 -3.253
227 H VAL 31 H VAL 31 3.721 4.297 -0.655
228 HA VAL 31 HA VAL 31 4.755 6.078 -2.737
229 HB VAL 31 HB VAL 31 4.611 8.030 -1.177
230 1HG1 VAL 31 1HG1 VAL 31 1.869 7.889 -1.317
231 2HG1 VAL 31 2HG1 VAL 31 2.392 6.775 -2.581
232 3HG1 VAL 31 3HG1 VAL 31 2.944 8.450 -2.598
233 1HG2 VAL 31 1HG2 VAL 31 3.000 7.940 0.684
234 2HG2 VAL 31 2HG2 VAL 31 4.371 6.858 0.929
235 3HG2 VAL 31 3HG2 VAL 31 2.815 6.207 0.418
Start of MODEL 12
1 1H ALA 1 1HT ALA 1 5.505 -11.799 0.531
2 2H ALA 1 2HT ALA 1 5.902 -10.311 1.235
3 3H ALA 1 3HT ALA 1 6.980 -11.055 0.164
4 HA ALA 1 HA ALA 1 5.967 -10.271 -1.630
5 1HB ALA 1 1HB ALA 1 3.201 -10.189 -0.618
6 2HB ALA 1 2HB ALA 1 3.937 -11.790 -0.687
7 3HB ALA 1 3HB ALA 1 3.835 -10.804 -2.145
8 H CYS 2 H CYS 2 5.554 -8.175 -2.305
9 HA CYS 2 HA CYS 2 4.524 -6.222 -0.416
10 1HB CYS 2 2HB CYS 2 6.483 -4.786 -0.564
11 2HB CYS 2 1HB CYS 2 6.913 -6.328 0.150
12 H SER 3 H SER 3 3.475 -4.622 -1.437
13 HA SER 3 HA SER 3 3.083 -4.836 -4.257
14 1HB SER 3 2HB SER 3 2.084 -2.716 -2.341
15 2HB SER 3 1HB SER 3 1.453 -3.051 -3.953
16 HG SER 3 HG SER 3 0.579 -4.910 -3.246
17 H LYS 4 H LYS 4 3.568 -3.336 -5.856
18 HA LYS 4 HA LYS 4 6.041 -1.961 -5.613
19 1HB LYS 4 2HB LYS 4 3.912 -1.688 -7.750
20 2HB LYS 4 1HB LYS 4 5.578 -1.149 -7.884
21 1HG LYS 4 2HG LYS 4 6.369 -3.236 -8.274
22 2HG LYS 4 1HG LYS 4 5.144 -4.010 -7.265
23 1HD LYS 4 2HD LYS 4 4.848 -4.543 -9.647
24 2HD LYS 4 1HD LYS 4 3.468 -3.661 -8.992
25 1HE LYS 4 2HE LYS 4 4.521 -1.564 -9.920
26 2HE LYS 4 1HE LYS 4 5.671 -2.607 -10.756
27 1HZ LYS 4 1HZ LYS 4 3.789 -3.687 -11.862
28 2HZ LYS 4 2HZ LYS 4 3.838 -2.032 -12.201
29 3HZ LYS 4 3HZ LYS 4 2.711 -2.633 -11.084
30 H LYS 5 H LYS 5 6.414 0.312 -5.593
31 HA LYS 5 HA LYS 5 4.868 1.782 -3.871
32 1HB LYS 5 2HB LYS 5 7.081 2.530 -4.247
33 2HB LYS 5 1HB LYS 5 6.810 2.699 -5.977
34 1HG LYS 5 2HG LYS 5 5.645 4.678 -5.737
35 2HG LYS 5 1HG LYS 5 5.203 4.333 -4.080
36 1HD LYS 5 2HD LYS 5 7.453 4.774 -3.338
37 2HD LYS 5 1HD LYS 5 7.994 4.974 -5.007
38 1HE LYS 5 2HE LYS 5 6.969 7.015 -5.242
39 2HE LYS 5 1HE LYS 5 5.749 6.667 -4.018
40 1HZ LYS 5 1HZ LYS 5 7.400 6.945 -2.297
41 2HZ LYS 5 2HZ LYS 5 7.380 8.325 -3.283
42 3HZ LYS 5 3HZ LYS 5 8.621 7.190 -3.450
43 H TRP 6 H TRP 6 4.985 2.517 -7.344
44 HA TRP 6 HA TRP 6 2.546 4.012 -7.075
45 1HB TRP 6 2HB TRP 6 3.942 3.334 -9.664
46 2HB TRP 6 1HB TRP 6 2.895 4.709 -9.316
47 HD1 TRP 6 HD TRP 6 6.458 3.428 -8.644
48 HE1 TRP 6 1HE TRP 6 7.953 5.427 -8.033
49 HE3 TRP 6 3HE TRP 6 2.871 7.045 -8.282
50 HZ2 TRP 6 2HZ TRP 6 7.649 8.169 -7.450
51 HZ3 TRP 6 3HZ TRP 6 3.551 9.329 -7.683
52 HH2 TRP 6 HH TRP 6 5.894 9.877 -7.269
53 H GLU 7 H GLU 7 2.495 1.172 -6.498
54 HA GLU 7 HA GLU 7 0.590 0.264 -8.573
55 1HB GLU 7 2HB GLU 7 2.582 -1.208 -8.157
56 2HB GLU 7 1HB GLU 7 2.022 -1.417 -6.505
57 1HG GLU 7 2HG GLU 7 1.368 -3.324 -7.762
58 2HG GLU 7 1HG GLU 7 -0.082 -2.382 -7.406
59 H TYR 8 H TYR 8 -1.437 -0.525 -7.876
60 HA TYR 8 HA TYR 8 -2.511 0.787 -5.613
61 1HB TYR 8 2HB TYR 8 -4.012 0.305 -7.405
62 2HB TYR 8 1HB TYR 8 -3.591 -1.404 -7.393
63 HD1 TYR 8 1HD TYR 8 -4.792 1.062 -4.836
64 HD2 TYR 8 2HD TYR 8 -5.301 -2.753 -6.649
65 HE1 TYR 8 1HE TYR 8 -6.662 0.594 -3.312
66 HE2 TYR 8 2HE TYR 8 -7.177 -3.229 -5.133
67 HH TYR 8 HH TYR 8 -8.176 -0.882 -2.654
68 H CYS 9 H CYS 9 -2.096 0.269 -3.574
69 HA CYS 9 HA CYS 9 -1.284 -2.412 -2.878
70 1HB CYS 9 2HB CYS 9 -1.270 -1.343 -0.510
71 2HB CYS 9 1HB CYS 9 -0.054 -0.842 -1.679
72 H ILE 10 H ILE 10 -2.697 -3.940 -2.501
73 HA ILE 10 HA ILE 10 -5.471 -3.461 -2.200
74 HB ILE 10 HB ILE 10 -4.049 -6.043 -1.545
75 1HG1 ILE 10 2HG1 ILE 10 -5.013 -5.087 -4.253
76 2HG1 ILE 10 1HG1 ILE 10 -3.325 -5.168 -3.759
77 1HG2 ILE 10 1HG2 ILE 10 -6.817 -5.502 -2.617
78 2HG2 ILE 10 2HG2 ILE 10 -6.432 -5.883 -0.938
79 3HG2 ILE 10 3HG2 ILE 10 -6.142 -7.078 -2.202
80 1HD1 ILE 10 1HD1 ILE 10 -5.210 -7.358 -4.453
81 2HD1 ILE 10 2HD1 ILE 10 -3.907 -7.681 -3.308
82 3HD1 ILE 10 3HD1 ILE 10 -3.531 -7.112 -4.934
83 H VAL 11 H VAL 11 -6.681 -3.196 -0.424
84 HA VAL 11 HA VAL 11 -5.446 -3.743 2.189
85 HB VAL 11 HB VAL 11 -6.811 -1.745 3.031
86 1HG1 VAL 11 1HG1 VAL 11 -4.523 -1.436 3.098
87 2HG1 VAL 11 2HG1 VAL 11 -5.030 -0.128 2.030
88 3HG1 VAL 11 3HG1 VAL 11 -4.343 -1.605 1.351
89 1HG2 VAL 11 1HG2 VAL 11 -6.683 -0.135 0.759
90 2HG2 VAL 11 2HG2 VAL 11 -8.139 -0.738 1.550
91 3HG2 VAL 11 3HG2 VAL 11 -7.427 -1.637 0.210
92 HA PRO 12 HA PRO 12 -9.594 -5.924 1.770
93 1HB PRO 12 2HB PRO 12 -8.051 -8.092 3.052
94 2HB PRO 12 1HB PRO 12 -9.114 -8.151 1.643
95 1HG PRO 12 2HG PRO 12 -6.460 -8.343 1.382
96 2HG PRO 12 1HG PRO 12 -7.446 -7.477 0.188
97 1HD PRO 12 2HD PRO 12 -5.757 -6.380 2.409
98 2HD PRO 12 1HD PRO 12 -5.936 -5.801 0.739
99 H ILE 13 H ILE 13 -11.036 -6.243 3.422
100 HA ILE 13 HA ILE 13 -10.664 -4.906 5.829
101 HB ILE 13 HB ILE 13 -12.659 -7.107 5.259
102 1HG1 ILE 13 2HG1 ILE 13 -12.793 -5.337 3.582
103 2HG1 ILE 13 1HG1 ILE 13 -14.194 -5.274 4.646
104 1HG2 ILE 13 1HG2 ILE 13 -13.778 -6.572 7.154
105 2HG2 ILE 13 2HG2 ILE 13 -13.295 -4.877 7.092
106 3HG2 ILE 13 3HG2 ILE 13 -12.164 -6.095 7.681
107 1HD1 ILE 13 1HD1 ILE 13 -12.063 -3.589 5.617
108 2HD1 ILE 13 2HD1 ILE 13 -13.738 -3.188 5.237
109 3HD1 ILE 13 3HD1 ILE 13 -12.519 -3.178 3.963
110 H LEU 14 H LEU 14 -9.430 -5.400 7.476
111 HA LEU 14 HA LEU 14 -8.248 -6.498 9.055
112 1HB LEU 14 2HB LEU 14 -10.577 -8.309 8.643
113 2HB LEU 14 1HB LEU 14 -9.233 -8.896 9.602
114 HG LEU 14 HG LEU 14 -9.498 -6.937 11.111
115 1HD1 LEU 14 1HD1 LEU 14 -10.663 -5.184 10.417
116 2HD1 LEU 14 2HD1 LEU 14 -12.126 -6.154 10.586
117 3HD1 LEU 14 3HD1 LEU 14 -11.291 -6.081 9.034
118 1HD2 LEU 14 1HD2 LEU 14 -11.376 -9.135 10.753
119 2HD2 LEU 14 2HD2 LEU 14 -12.050 -7.781 11.658
120 3HD2 LEU 14 3HD2 LEU 14 -10.567 -8.558 12.210
121 H GLY 15 H GLY 15 -7.436 -6.768 6.285
122 1HA GLY 15 2HA GLY 15 -5.462 -8.804 6.655
123 2HA GLY 15 1HA GLY 15 -6.675 -9.286 5.477
124 H PHE 16 H PHE 16 -5.351 -6.076 6.096
125 HA PHE 16 HA PHE 16 -4.950 -5.586 3.327
126 1HB PHE 16 2HB PHE 16 -3.827 -3.470 4.170
127 2HB PHE 16 1HB PHE 16 -5.505 -3.701 4.642
128 HD1 PHE 16 1HD PHE 16 -2.024 -4.170 5.886
129 HD2 PHE 16 2HD PHE 16 -6.118 -3.543 6.862
130 HE1 PHE 16 1HE PHE 16 -1.408 -3.858 8.246
131 HE2 PHE 16 2HE PHE 16 -5.509 -3.229 9.225
132 HZ PHE 16 HZ PHE 16 -3.152 -3.386 9.919
133 H VAL 17 H VAL 17 -3.041 -5.339 2.168
134 HA VAL 17 HA VAL 17 -0.884 -7.048 3.079
135 HB VAL 17 HB VAL 17 -0.697 -5.489 0.536
136 1HG1 VAL 17 1HG1 VAL 17 0.549 -7.796 1.713
137 2HG1 VAL 17 2HG1 VAL 17 1.021 -6.872 0.287
138 3HG1 VAL 17 3HG1 VAL 17 -0.132 -8.198 0.137
139 1HG2 VAL 17 1HG2 VAL 17 -2.563 -7.817 0.968
140 2HG2 VAL 17 2HG2 VAL 17 -2.046 -7.243 -0.618
141 3HG2 VAL 17 3HG2 VAL 17 -2.987 -6.189 0.439
142 H TYR 18 H TYR 18 1.366 -5.953 2.080
143 HA TYR 18 HA TYR 18 1.646 -3.221 2.994
144 1HB TYR 18 2HB TYR 18 1.880 -4.508 5.078
145 2HB TYR 18 1HB TYR 18 3.131 -5.496 4.337
146 HD1 TYR 18 1HD TYR 18 2.599 -1.790 4.396
147 HD2 TYR 18 2HD TYR 18 5.127 -5.060 5.407
148 HE1 TYR 18 1HE TYR 18 4.315 -0.213 5.184
149 HE2 TYR 18 2HE TYR 18 6.848 -3.492 6.198
150 HH TYR 18 HH TYR 18 6.792 -1.009 7.123
151 H CYS 19 H CYS 19 3.362 -2.190 2.079
152 HA CYS 19 HA CYS 19 4.565 -3.411 -0.210
153 1HB CYS 19 2HB CYS 19 4.913 -0.773 1.167
154 2HB CYS 19 1HB CYS 19 5.819 -1.187 -0.280
155 H CYS 20 H CYS 20 7.023 -3.019 -0.526
156 HA CYS 20 HA CYS 20 8.365 -4.632 1.383
157 1HB CYS 20 2HB CYS 20 9.069 -3.328 -1.159
158 2HB CYS 20 1HB CYS 20 10.406 -3.532 -0.042
159 HA PRO 21 HA PRO 21 9.790 -1.794 4.379
160 1HB PRO 21 2HB PRO 21 12.576 -2.618 3.745
161 2HB PRO 21 1HB PRO 21 11.726 -2.550 5.294
162 1HG PRO 21 2HG PRO 21 12.136 -4.895 4.080
163 2HG PRO 21 1HG PRO 21 10.610 -4.563 4.920
164 1HD PRO 21 2HD PRO 21 11.197 -4.551 1.987
165 2HD PRO 21 1HD PRO 21 9.736 -5.089 2.828
166 H GLY 22 H GLY 22 9.588 0.189 3.871
167 1HA GLY 22 2HA GLY 22 11.058 2.194 3.435
168 2HA GLY 22 1HA GLY 22 11.405 1.413 1.901
169 H LEU 23 H LEU 23 8.691 0.440 1.481
170 HA LEU 23 HA LEU 23 7.471 3.002 0.720
171 1HB LEU 23 2HB LEU 23 6.895 0.230 -0.328
172 2HB LEU 23 1HB LEU 23 6.281 1.739 -0.976
173 HG LEU 23 HG LEU 23 9.189 0.931 -0.967
174 1HD1 LEU 23 1HD1 LEU 23 7.221 0.969 -3.248
175 2HD1 LEU 23 2HD1 LEU 23 7.799 -0.482 -2.429
176 3HD1 LEU 23 3HD1 LEU 23 8.928 0.529 -3.332
177 1HD2 LEU 23 1HD2 LEU 23 8.793 2.874 -2.876
178 2HD2 LEU 23 2HD2 LEU 23 9.510 3.117 -1.283
179 3HD2 LEU 23 3HD2 LEU 23 7.790 3.420 -1.531
180 H ILE 24 H ILE 24 5.397 3.509 1.323
181 HA ILE 24 HA ILE 24 4.004 1.535 3.018
182 HB ILE 24 HB ILE 24 3.145 3.473 4.377
183 1HG1 ILE 24 2HG1 ILE 24 5.443 4.934 3.051
184 2HG1 ILE 24 1HG1 ILE 24 3.737 5.252 2.754
185 1HG2 ILE 24 1HG2 ILE 24 4.878 3.312 5.898
186 2HG2 ILE 24 2HG2 ILE 24 6.117 3.303 4.643
187 3HG2 ILE 24 3HG2 ILE 24 5.116 1.874 4.905
188 1HD1 ILE 24 1HD1 ILE 24 3.958 5.457 5.491
189 2HD1 ILE 24 2HD1 ILE 24 3.901 6.793 4.341
190 3HD1 ILE 24 3HD1 ILE 24 5.456 6.172 4.895
191 H CYS 25 H CYS 25 1.910 1.218 2.612
192 HA CYS 25 HA CYS 25 0.715 2.220 0.264
193 1HB CYS 25 2HB CYS 25 0.105 0.054 1.227
194 2HB CYS 25 1HB CYS 25 -0.557 0.854 2.647
195 H GLY 26 H GLY 26 -0.759 3.835 -0.110
196 1HA GLY 26 2HA GLY 26 -1.698 5.397 2.195
197 2HA GLY 26 1HA GLY 26 -0.811 6.213 0.916
198 HA PRO 27 HA PRO 27 -4.926 6.965 -0.675
199 1HB PRO 27 2HB PRO 27 -3.558 8.248 -2.921
200 2HB PRO 27 1HB PRO 27 -4.604 8.964 -1.694
201 1HG PRO 27 2HG PRO 27 -1.950 9.438 -1.773
202 2HG PRO 27 1HG PRO 27 -2.858 9.372 -0.252
203 1HD PRO 27 2HD PRO 27 -1.126 7.277 -1.514
204 2HD PRO 27 1HD PRO 27 -1.224 7.781 0.188
205 H PHE 28 H PHE 28 -4.511 4.477 -1.088
206 HA PHE 28 HA PHE 28 -4.948 2.699 -2.402
207 1HB PHE 28 2HB PHE 28 -5.895 4.838 -4.337
208 2HB PHE 28 1HB PHE 28 -5.980 3.116 -4.705
209 HD1 PHE 28 1HD PHE 28 -8.095 2.306 -4.530
210 HD2 PHE 28 2HD PHE 28 -6.788 5.200 -1.697
211 HE1 PHE 28 1HE PHE 28 -10.266 2.161 -3.385
212 HE2 PHE 28 2HE PHE 28 -8.957 5.058 -0.545
213 HZ PHE 28 HZ PHE 28 -10.700 3.537 -1.388
214 H VAL 29 H VAL 29 -2.386 4.343 -2.500
215 HA VAL 29 HA VAL 29 -1.055 2.649 -4.428
216 HB VAL 29 HB VAL 29 0.280 4.506 -5.420
217 1HG1 VAL 29 1HG1 VAL 29 -2.545 4.010 -5.985
218 2HG1 VAL 29 2HG1 VAL 29 -1.152 4.038 -7.068
219 3HG1 VAL 29 3HG1 VAL 29 -1.947 5.546 -6.613
220 1HG2 VAL 29 1HG2 VAL 29 -0.006 6.699 -4.946
221 2HG2 VAL 29 2HG2 VAL 29 -0.651 6.063 -3.433
222 3HG2 VAL 29 3HG2 VAL 29 -1.749 6.542 -4.728
223 H CYS 30 H CYS 30 1.246 2.613 -3.997
224 HA CYS 30 HA CYS 30 1.769 3.153 -1.189
225 1HB CYS 30 2HB CYS 30 2.342 0.996 -2.642
226 2HB CYS 30 1HB CYS 30 3.795 1.922 -3.002
227 H VAL 31 H VAL 31 3.688 4.305 -0.502
228 HA VAL 31 HA VAL 31 4.928 5.989 -2.558
229 HB VAL 31 HB VAL 31 4.776 7.977 -1.038
230 1HG1 VAL 31 1HG1 VAL 31 2.773 6.897 -2.728
231 2HG1 VAL 31 2HG1 VAL 31 3.117 8.589 -2.373
232 3HG1 VAL 31 3HG1 VAL 31 1.972 7.695 -1.375
233 1HG2 VAL 31 1HG2 VAL 31 4.365 6.970 1.081
234 2HG2 VAL 31 2HG2 VAL 31 2.899 6.186 0.492
235 3HG2 VAL 31 3HG2 VAL 31 2.948 7.939 0.678
Start of MODEL 13
1 1H ALA 1 1HT ALA 1 4.524 -11.684 1.040
2 2H ALA 1 2HT ALA 1 5.065 -10.226 1.711
3 3H ALA 1 3HT ALA 1 6.124 -11.183 0.800
4 HA ALA 1 HA ALA 1 5.452 -10.339 -1.116
5 1HB ALA 1 1HB ALA 1 3.059 -10.040 -1.670
6 2HB ALA 1 2HB ALA 1 2.645 -10.484 -0.014
7 3HB ALA 1 3HB ALA 1 3.422 -11.659 -1.075
8 H CYS 2 H CYS 2 5.170 -8.228 -1.961
9 HA CYS 2 HA CYS 2 4.257 -6.118 -0.175
10 1HB CYS 2 2HB CYS 2 6.302 -4.866 -0.248
11 2HB CYS 2 1HB CYS 2 6.651 -6.455 0.407
12 H SER 3 H SER 3 3.420 -4.446 -1.271
13 HA SER 3 HA SER 3 3.153 -4.739 -4.132
14 1HB SER 3 2HB SER 3 1.223 -4.180 -2.623
15 2HB SER 3 1HB SER 3 1.972 -2.615 -2.322
16 HG SER 3 HG SER 3 0.299 -2.993 -4.147
17 H LYS 4 H LYS 4 3.844 -3.296 -5.679
18 HA LYS 4 HA LYS 4 6.227 -1.849 -5.151
19 1HB LYS 4 2HB LYS 4 5.665 -2.897 -7.351
20 2HB LYS 4 1HB LYS 4 4.423 -1.674 -7.579
21 1HG LYS 4 2HG LYS 4 6.081 0.069 -7.644
22 2HG LYS 4 1HG LYS 4 7.358 -1.084 -7.256
23 1HD LYS 4 2HD LYS 4 7.436 -0.646 -9.610
24 2HD LYS 4 1HD LYS 4 6.825 -2.283 -9.379
25 1HE LYS 4 2HE LYS 4 4.689 -0.322 -9.446
26 2HE LYS 4 1HE LYS 4 5.669 -0.280 -10.910
27 1HZ LYS 4 1HZ LYS 4 3.635 -1.920 -10.624
28 2HZ LYS 4 2HZ LYS 4 4.819 -2.901 -9.922
29 3HZ LYS 4 3HZ LYS 4 5.012 -2.356 -11.512
30 H LYS 5 H LYS 5 6.538 0.469 -5.317
31 HA LYS 5 HA LYS 5 4.850 1.949 -3.752
32 1HB LYS 5 2HB LYS 5 7.054 2.760 -4.094
33 2HB LYS 5 1HB LYS 5 6.821 2.861 -5.834
34 1HG LYS 5 2HG LYS 5 5.567 4.794 -5.686
35 2HG LYS 5 1HG LYS 5 5.106 4.486 -4.025
36 1HD LYS 5 2HD LYS 5 7.331 5.030 -3.263
37 2HD LYS 5 1HD LYS 5 7.880 5.221 -4.932
38 1HE LYS 5 2HE LYS 5 6.773 7.210 -5.216
39 2HE LYS 5 1HE LYS 5 5.550 6.829 -4.005
40 1HZ LYS 5 1HZ LYS 5 8.381 7.540 -3.437
41 2HZ LYS 5 2HZ LYS 5 7.207 7.172 -2.270
42 3HZ LYS 5 3HZ LYS 5 7.047 8.559 -3.231
43 H TRP 6 H TRP 6 5.092 2.583 -7.231
44 HA TRP 6 HA TRP 6 2.526 3.876 -7.127
45 1HB TRP 6 2HB TRP 6 4.097 3.300 -9.637
46 2HB TRP 6 1HB TRP 6 2.956 4.605 -9.334
47 HD1 TRP 6 HD TRP 6 6.560 3.548 -8.509
48 HE1 TRP 6 1HE TRP 6 7.907 5.640 -7.870
49 HE3 TRP 6 3HE TRP 6 2.753 6.949 -8.350
50 HZ2 TRP 6 2HZ TRP 6 7.418 8.367 -7.345
51 HZ3 TRP 6 3HZ TRP 6 3.273 9.278 -7.763
52 HH2 TRP 6 HH TRP 6 5.561 9.971 -7.265
53 H GLU 7 H GLU 7 2.615 1.060 -6.477
54 HA GLU 7 HA GLU 7 1.390 -0.268 -8.782
55 1HB GLU 7 2HB GLU 7 2.908 -1.322 -6.902
56 2HB GLU 7 1HB GLU 7 1.390 -1.441 -6.027
57 1HG GLU 7 2HG GLU 7 1.710 -3.518 -7.077
58 2HG GLU 7 1HG GLU 7 0.474 -2.683 -8.020
59 H TYR 8 H TYR 8 -0.080 -1.368 -6.021
60 HA TYR 8 HA TYR 8 -2.222 0.530 -5.822
61 1HB TYR 8 2HB TYR 8 -2.859 -0.641 -7.904
62 2HB TYR 8 1HB TYR 8 -2.765 -2.185 -7.067
63 HD1 TYR 8 1HD TYR 8 -4.797 -3.112 -6.529
64 HD2 TYR 8 2HD TYR 8 -4.430 1.126 -6.504
65 HE1 TYR 8 1HE TYR 8 -7.165 -2.916 -5.896
66 HE2 TYR 8 2HE TYR 8 -6.795 1.333 -5.869
67 HH TYR 8 HH TYR 8 -8.709 0.258 -5.518
68 H CYS 9 H CYS 9 -3.333 0.261 -3.924
69 HA CYS 9 HA CYS 9 -3.237 -2.228 -2.485
70 1HB CYS 9 2HB CYS 9 -2.099 -1.341 -0.501
71 2HB CYS 9 1HB CYS 9 -1.041 -1.310 -1.905
72 H ILE 10 H ILE 10 -4.655 -2.266 -0.703
73 HA ILE 10 HA ILE 10 -6.134 -0.005 0.160
74 HB ILE 10 HB ILE 10 -7.213 -0.221 -2.022
75 1HG1 ILE 10 2HG1 ILE 10 -9.559 -0.490 -1.271
76 2HG1 ILE 10 1HG1 ILE 10 -8.979 -1.177 0.241
77 1HG2 ILE 10 1HG2 ILE 10 -6.719 -2.673 -2.268
78 2HG2 ILE 10 2HG2 ILE 10 -8.326 -2.164 -2.786
79 3HG2 ILE 10 3HG2 ILE 10 -8.116 -2.979 -1.236
80 1HD1 ILE 10 1HD1 ILE 10 -7.734 1.004 0.582
81 2HD1 ILE 10 2HD1 ILE 10 -9.491 1.058 0.712
82 3HD1 ILE 10 3HD1 ILE 10 -8.696 1.637 -0.753
83 H VAL 11 H VAL 11 -5.740 -3.452 -0.119
84 HA VAL 11 HA VAL 11 -7.474 -4.326 1.888
85 HB VAL 11 HB VAL 11 -5.985 -6.327 2.039
86 1HG1 VAL 11 1HG1 VAL 11 -7.338 -6.967 0.392
87 2HG1 VAL 11 2HG1 VAL 11 -6.106 -6.425 -0.748
88 3HG1 VAL 11 3HG1 VAL 11 -7.406 -5.332 -0.268
89 1HG2 VAL 11 1HG2 VAL 11 -4.307 -4.746 0.092
90 2HG2 VAL 11 2HG2 VAL 11 -4.131 -6.478 0.374
91 3HG2 VAL 11 3HG2 VAL 11 -3.828 -5.335 1.683
92 HA PRO 12 HA PRO 12 -5.813 -2.857 5.683
93 1HB PRO 12 2HB PRO 12 -6.357 -5.595 6.714
94 2HB PRO 12 1HB PRO 12 -6.889 -4.029 7.337
95 1HG PRO 12 2HG PRO 12 -8.582 -5.613 6.032
96 2HG PRO 12 1HG PRO 12 -8.617 -3.855 5.800
97 1HD PRO 12 2HD PRO 12 -7.510 -5.983 4.018
98 2HD PRO 12 1HD PRO 12 -8.358 -4.482 3.593
99 H ILE 13 H ILE 13 -3.659 -2.594 5.422
100 HA ILE 13 HA ILE 13 -1.749 -4.620 5.054
101 HB ILE 13 HB ILE 13 -0.073 -2.916 5.729
102 1HG1 ILE 13 2HG1 ILE 13 -2.495 -1.154 6.183
103 2HG1 ILE 13 1HG1 ILE 13 -1.455 -1.790 7.452
104 1HG2 ILE 13 1HG2 ILE 13 -1.755 -1.324 3.955
105 2HG2 ILE 13 2HG2 ILE 13 -1.632 -3.017 3.479
106 3HG2 ILE 13 3HG2 ILE 13 -0.172 -2.048 3.672
107 1HD1 ILE 13 1HD1 ILE 13 -0.504 0.240 7.247
108 2HD1 ILE 13 2HD1 ILE 13 -1.013 0.433 5.569
109 3HD1 ILE 13 3HD1 ILE 13 0.388 -0.566 5.957
110 H LEU 14 H LEU 14 -3.461 -3.649 7.796
111 HA LEU 14 HA LEU 14 -1.629 -4.249 9.848
112 1HB LEU 14 2HB LEU 14 -3.687 -2.918 10.148
113 2HB LEU 14 1HB LEU 14 -4.646 -4.361 9.887
114 HG LEU 14 HG LEU 14 -3.618 -5.360 11.924
115 1HD1 LEU 14 1HD1 LEU 14 -1.637 -3.628 11.690
116 2HD1 LEU 14 2HD1 LEU 14 -2.122 -4.276 13.258
117 3HD1 LEU 14 3HD1 LEU 14 -2.666 -2.674 12.760
118 1HD2 LEU 14 1HD2 LEU 14 -5.321 -4.547 13.115
119 2HD2 LEU 14 2HD2 LEU 14 -5.672 -3.543 11.708
120 3HD2 LEU 14 3HD2 LEU 14 -4.702 -2.898 13.033
121 H GLY 15 H GLY 15 -3.558 -6.287 7.772
122 1HA GLY 15 2HA GLY 15 -2.306 -8.613 8.900
123 2HA GLY 15 1HA GLY 15 -4.007 -8.509 9.314
124 H PHE 16 H PHE 16 -2.040 -8.032 6.359
125 HA PHE 16 HA PHE 16 -3.246 -10.258 5.062
126 1HB PHE 16 2HB PHE 16 -5.040 -8.378 4.973
127 2HB PHE 16 1HB PHE 16 -3.982 -7.638 3.777
128 HD1 PHE 16 1HD PHE 16 -5.086 -7.859 1.751
129 HD2 PHE 16 2HD PHE 16 -4.806 -11.221 4.342
130 HE1 PHE 16 1HE PHE 16 -6.072 -9.282 0.004
131 HE2 PHE 16 2HE PHE 16 -5.790 -12.651 2.598
132 HZ PHE 16 HZ PHE 16 -6.423 -11.682 0.426
133 H VAL 17 H VAL 17 -2.033 -7.060 4.027
134 HA VAL 17 HA VAL 17 0.389 -8.327 3.004
135 HB VAL 17 HB VAL 17 -0.833 -6.337 1.158
136 1HG1 VAL 17 1HG1 VAL 17 1.368 -8.076 1.155
137 2HG1 VAL 17 2HG1 VAL 17 0.836 -6.995 -0.134
138 3HG1 VAL 17 3HG1 VAL 17 0.267 -8.663 -0.092
139 1HG2 VAL 17 1HG2 VAL 17 -2.410 -8.486 1.860
140 2HG2 VAL 17 2HG2 VAL 17 -1.595 -9.040 0.397
141 3HG2 VAL 17 3HG2 VAL 17 -2.536 -7.549 0.371
142 H TYR 18 H TYR 18 1.695 -6.324 1.921
143 HA TYR 18 HA TYR 18 1.363 -3.764 3.065
144 1HB TYR 18 2HB TYR 18 2.027 -5.092 5.110
145 2HB TYR 18 1HB TYR 18 3.561 -5.429 4.320
146 HD1 TYR 18 1HD TYR 18 1.548 -2.291 4.610
147 HD2 TYR 18 2HD TYR 18 5.219 -4.275 5.444
148 HE1 TYR 18 1HE TYR 18 2.463 -0.202 5.527
149 HE2 TYR 18 2HE TYR 18 6.142 -2.191 6.364
150 HH TYR 18 HH TYR 18 5.485 -0.109 7.226
151 H CYS 19 H CYS 19 3.079 -2.315 2.390
152 HA CYS 19 HA CYS 19 4.203 -2.996 -0.126
153 1HB CYS 19 2HB CYS 19 4.532 -0.717 1.766
154 2HB CYS 19 1HB CYS 19 5.472 -0.784 0.282
155 H CYS 20 H CYS 20 6.552 -2.685 -0.624
156 HA CYS 20 HA CYS 20 8.125 -4.508 0.876
157 1HB CYS 20 2HB CYS 20 9.205 -2.450 -1.046
158 2HB CYS 20 1HB CYS 20 9.880 -4.026 -0.662
159 HA PRO 21 HA PRO 21 9.774 -2.024 4.109
160 1HB PRO 21 2HB PRO 21 12.483 -2.884 3.236
161 2HB PRO 21 1HB PRO 21 11.722 -2.949 4.831
162 1HG PRO 21 2HG PRO 21 11.981 -5.160 3.353
163 2HG PRO 21 1HG PRO 21 10.524 -4.878 4.327
164 1HD PRO 21 2HD PRO 21 10.918 -4.596 1.378
165 2HD PRO 21 1HD PRO 21 9.495 -5.159 2.272
166 H GLY 22 H GLY 22 9.720 0.032 3.872
167 1HA GLY 22 2HA GLY 22 11.182 2.013 3.540
168 2HA GLY 22 1HA GLY 22 11.540 1.340 1.955
169 H LEU 23 H LEU 23 8.728 0.468 1.564
170 HA LEU 23 HA LEU 23 7.637 3.106 0.868
171 1HB LEU 23 2HB LEU 23 6.967 0.387 -0.267
172 2HB LEU 23 1HB LEU 23 6.368 1.929 -0.849
173 HG LEU 23 HG LEU 23 9.272 1.106 -0.907
174 1HD1 LEU 23 1HD1 LEU 23 8.824 0.976 -3.397
175 2HD1 LEU 23 2HD1 LEU 23 7.110 0.945 -2.985
176 3HD1 LEU 23 3HD1 LEU 23 8.178 -0.335 -2.411
177 1HD2 LEU 23 1HD2 LEU 23 9.732 3.084 -1.962
178 2HD2 LEU 23 2HD2 LEU 23 8.438 3.604 -0.882
179 3HD2 LEU 23 3HD2 LEU 23 8.089 3.266 -2.578
180 H ILE 24 H ILE 24 5.459 3.580 1.315
181 HA ILE 24 HA ILE 24 4.089 1.657 3.083
182 HB ILE 24 HB ILE 24 3.207 3.613 4.390
183 1HG1 ILE 24 2HG1 ILE 24 5.485 5.084 3.044
184 2HG1 ILE 24 1HG1 ILE 24 3.777 5.360 2.722
185 1HG2 ILE 24 1HG2 ILE 24 5.613 3.993 5.467
186 2HG2 ILE 24 2HG2 ILE 24 5.993 2.614 4.437
187 3HG2 ILE 24 3HG2 ILE 24 4.718 2.484 5.648
188 1HD1 ILE 24 1HD1 ILE 24 5.045 6.936 4.323
189 2HD1 ILE 24 2HD1 ILE 24 4.847 5.634 5.496
190 3HD1 ILE 24 3HD1 ILE 24 3.429 6.383 4.760
191 H CYS 25 H CYS 25 2.004 1.305 2.648
192 HA CYS 25 HA CYS 25 0.834 2.283 0.274
193 1HB CYS 25 2HB CYS 25 0.207 0.119 1.166
194 2HB CYS 25 1HB CYS 25 -0.408 0.862 2.638
195 H GLY 26 H GLY 26 -0.700 3.841 -0.124
196 1HA GLY 26 2HA GLY 26 -1.675 5.420 2.154
197 2HA GLY 26 1HA GLY 26 -0.814 6.235 0.858
198 HA PRO 27 HA PRO 27 -4.959 6.851 -0.709
199 1HB PRO 27 2HB PRO 27 -4.260 8.287 -2.900
200 2HB PRO 27 1HB PRO 27 -4.271 8.965 -1.268
201 1HG PRO 27 2HG PRO 27 -1.966 7.930 -2.873
202 2HG PRO 27 1HG PRO 27 -2.067 9.392 -1.874
203 1HD PRO 27 2HD PRO 27 -0.883 7.112 -1.014
204 2HD PRO 27 1HD PRO 27 -1.719 8.229 0.083
205 H PHE 28 H PHE 28 -4.559 4.374 -1.105
206 HA PHE 28 HA PHE 28 -5.018 2.584 -2.397
207 1HB PHE 28 2HB PHE 28 -5.875 4.688 -4.413
208 2HB PHE 28 1HB PHE 28 -6.007 2.959 -4.715
209 HD1 PHE 28 1HD PHE 28 -8.132 2.193 -4.531
210 HD2 PHE 28 2HD PHE 28 -6.827 5.219 -1.839
211 HE1 PHE 28 1HE PHE 28 -10.338 2.172 -3.444
212 HE2 PHE 28 2HE PHE 28 -9.030 5.201 -0.745
213 HZ PHE 28 HZ PHE 28 -10.789 3.675 -1.548
214 H VAL 29 H VAL 29 -2.427 4.252 -2.544
215 HA VAL 29 HA VAL 29 -1.092 2.454 -4.379
216 HB VAL 29 HB VAL 29 0.249 4.273 -5.452
217 1HG1 VAL 29 1HG1 VAL 29 -1.507 5.050 -7.041
218 2HG1 VAL 29 2HG1 VAL 29 -2.718 4.317 -5.988
219 3HG1 VAL 29 3HG1 VAL 29 -1.498 3.308 -6.765
220 1HG2 VAL 29 1HG2 VAL 29 -1.775 6.343 -4.925
221 2HG2 VAL 29 2HG2 VAL 29 -0.019 6.467 -5.038
222 3HG2 VAL 29 3HG2 VAL 29 -0.770 5.909 -3.542
223 H CYS 30 H CYS 30 1.253 2.550 -3.996
224 HA CYS 30 HA CYS 30 1.752 3.115 -1.191
225 1HB CYS 30 2HB CYS 30 2.409 0.964 -2.539
226 2HB CYS 30 1HB CYS 30 3.760 1.946 -3.086
227 H VAL 31 H VAL 31 3.620 4.345 -0.503
228 HA VAL 31 HA VAL 31 4.777 6.094 -2.551
229 HB VAL 31 HB VAL 31 4.545 8.065 -1.031
230 1HG1 VAL 31 1HG1 VAL 31 2.225 6.728 -2.318
231 2HG1 VAL 31 2HG1 VAL 31 3.022 8.249 -2.718
232 3HG1 VAL 31 3HG1 VAL 31 1.921 8.166 -1.343
233 1HG2 VAL 31 1HG2 VAL 31 2.456 7.678 0.584
234 2HG2 VAL 31 2HG2 VAL 31 4.123 7.440 1.109
235 3HG2 VAL 31 3HG2 VAL 31 3.143 6.054 0.629
Start of MODEL 14
1 1H ALA 1 1HT ALA 1 3.686 -10.899 0.267
2 2H ALA 1 2HT ALA 1 5.155 -10.722 1.087
3 3H ALA 1 3HT ALA 1 4.900 -12.062 0.082
4 HA ALA 1 HA ALA 1 6.322 -10.464 -1.005
5 1HB ALA 1 1HB ALA 1 4.685 -11.845 -2.303
6 2HB ALA 1 2HB ALA 1 5.158 -10.337 -3.087
7 3HB ALA 1 3HB ALA 1 3.592 -10.461 -2.284
8 H CYS 2 H CYS 2 6.830 -8.365 -1.450
9 HA CYS 2 HA CYS 2 5.172 -6.337 -0.156
10 1HB CYS 2 2HB CYS 2 7.087 -4.932 -0.241
11 2HB CYS 2 1HB CYS 2 7.620 -6.516 0.298
12 H SER 3 H SER 3 4.087 -4.816 -1.182
13 HA SER 3 HA SER 3 3.674 -5.074 -4.012
14 1HB SER 3 2HB SER 3 1.820 -4.638 -2.419
15 2HB SER 3 1HB SER 3 2.526 -3.064 -2.058
16 HG SER 3 HG SER 3 2.005 -2.351 -4.045
17 H LYS 4 H LYS 4 4.158 -3.608 -5.606
18 HA LYS 4 HA LYS 4 6.460 -1.976 -5.246
19 1HB LYS 4 2HB LYS 4 4.510 -2.234 -7.540
20 2HB LYS 4 1HB LYS 4 5.924 -1.195 -7.596
21 1HG LYS 4 2HG LYS 4 7.400 -3.046 -7.482
22 2HG LYS 4 1HG LYS 4 6.085 -4.151 -7.076
23 1HD LYS 4 2HD LYS 4 6.067 -2.612 -9.651
24 2HD LYS 4 1HD LYS 4 6.970 -4.122 -9.503
25 1HE LYS 4 2HE LYS 4 5.110 -5.368 -9.550
26 2HE LYS 4 1HE LYS 4 4.250 -4.285 -8.458
27 1HZ LYS 4 1HZ LYS 4 3.053 -3.713 -10.217
28 2HZ LYS 4 2HZ LYS 4 4.117 -4.460 -11.308
29 3HZ LYS 4 3HZ LYS 4 4.415 -2.880 -10.786
30 H LYS 5 H LYS 5 6.601 0.294 -5.349
31 HA LYS 5 HA LYS 5 4.862 1.674 -3.762
32 1HB LYS 5 2HB LYS 5 6.993 2.608 -4.038
33 2HB LYS 5 1HB LYS 5 6.846 2.641 -5.791
34 1HG LYS 5 2HG LYS 5 5.501 4.527 -5.768
35 2HG LYS 5 1HG LYS 5 4.991 4.262 -4.122
36 1HD LYS 5 2HD LYS 5 7.162 4.926 -3.298
37 2HD LYS 5 1HD LYS 5 7.765 5.074 -4.953
38 1HE LYS 5 2HE LYS 5 6.602 7.008 -5.352
39 2HE LYS 5 1HE LYS 5 5.337 6.618 -4.186
40 1HZ LYS 5 1HZ LYS 5 7.051 6.990 -2.413
41 2HZ LYS 5 2HZ LYS 5 6.607 8.379 -3.280
42 3HZ LYS 5 3HZ LYS 5 8.074 7.612 -3.615
43 H TRP 6 H TRP 6 4.940 2.063 -7.299
44 HA TRP 6 HA TRP 6 2.565 3.648 -7.081
45 1HB TRP 6 2HB TRP 6 3.900 2.695 -9.617
46 2HB TRP 6 1HB TRP 6 2.811 4.071 -9.420
47 HD1 TRP 6 HD TRP 6 6.400 2.971 -8.583
48 HE1 TRP 6 1HE TRP 6 7.834 5.061 -8.167
49 HE3 TRP 6 3HE TRP 6 2.717 6.506 -8.635
50 HZ2 TRP 6 2HZ TRP 6 7.454 7.838 -7.875
51 HZ3 TRP 6 3HZ TRP 6 3.331 8.856 -8.267
52 HH2 TRP 6 HH TRP 6 5.653 9.507 -7.888
53 H GLU 7 H GLU 7 2.489 0.745 -6.328
54 HA GLU 7 HA GLU 7 0.633 -0.347 -8.301
55 1HB GLU 7 2HB GLU 7 1.384 -1.344 -5.548
56 2HB GLU 7 1HB GLU 7 0.255 -2.156 -6.617
57 1HG GLU 7 2HG GLU 7 3.193 -1.734 -7.040
58 2HG GLU 7 1HG GLU 7 2.357 -3.253 -6.738
59 H TYR 8 H TYR 8 -1.573 -0.456 -8.071
60 HA TYR 8 HA TYR 8 -2.773 1.565 -6.424
61 1HB TYR 8 2HB TYR 8 -3.499 0.887 -8.778
62 2HB TYR 8 1HB TYR 8 -4.213 -0.544 -8.046
63 HD1 TYR 8 1HD TYR 8 -6.473 -0.445 -7.627
64 HD2 TYR 8 2HD TYR 8 -4.220 3.161 -7.496
65 HE1 TYR 8 1HE TYR 8 -8.534 0.820 -7.183
66 HE2 TYR 8 2HE TYR 8 -6.275 4.435 -7.047
67 HH TYR 8 HH TYR 8 -8.479 4.353 -6.830
68 H CYS 9 H CYS 9 -1.682 0.175 -4.550
69 HA CYS 9 HA CYS 9 -3.291 -2.031 -3.649
70 1HB CYS 9 2HB CYS 9 -1.840 -1.911 -1.597
71 2HB CYS 9 1HB CYS 9 -0.980 -2.170 -3.109
72 H ILE 10 H ILE 10 -5.295 -0.855 -3.706
73 HA ILE 10 HA ILE 10 -5.913 1.308 -2.026
74 HB ILE 10 HB ILE 10 -7.378 0.722 -3.851
75 1HG1 ILE 10 2HG1 ILE 10 -8.773 0.273 -1.203
76 2HG1 ILE 10 1HG1 ILE 10 -8.407 1.839 -1.920
77 1HG2 ILE 10 1HG2 ILE 10 -8.271 -1.762 -2.434
78 2HG2 ILE 10 2HG2 ILE 10 -6.917 -1.784 -3.563
79 3HG2 ILE 10 3HG2 ILE 10 -8.517 -1.292 -4.115
80 1HD1 ILE 10 1HD1 ILE 10 -10.723 0.306 -2.233
81 2HD1 ILE 10 2HD1 ILE 10 -9.879 0.234 -3.781
82 3HD1 ILE 10 3HD1 ILE 10 -10.293 1.796 -3.073
83 H VAL 11 H VAL 11 -5.690 -2.111 -1.451
84 HA VAL 11 HA VAL 11 -7.083 -2.189 1.016
85 HB VAL 11 HB VAL 11 -5.860 -4.365 1.354
86 1HG1 VAL 11 1HG1 VAL 11 -7.525 -3.742 -1.045
87 2HG1 VAL 11 2HG1 VAL 11 -7.938 -4.659 0.404
88 3HG1 VAL 11 3HG1 VAL 11 -6.895 -5.374 -0.824
89 1HG2 VAL 11 1HG2 VAL 11 -4.410 -3.342 -1.005
90 2HG2 VAL 11 2HG2 VAL 11 -4.858 -5.047 -1.053
91 3HG2 VAL 11 3HG2 VAL 11 -3.873 -4.431 0.275
92 HA PRO 12 HA PRO 12 -4.056 -0.255 3.595
93 1HB PRO 12 2HB PRO 12 -5.026 -1.081 5.998
94 2HB PRO 12 1HB PRO 12 -5.775 0.203 5.042
95 1HG PRO 12 2HG PRO 12 -6.540 -2.681 5.271
96 2HG PRO 12 1HG PRO 12 -7.580 -1.244 5.252
97 1HD PRO 12 2HD PRO 12 -7.216 -2.806 3.072
98 2HD PRO 12 1HD PRO 12 -7.491 -1.056 2.957
99 H ILE 13 H ILE 13 -2.132 -0.786 4.468
100 HA ILE 13 HA ILE 13 -0.969 -3.268 4.144
101 HB ILE 13 HB ILE 13 -0.196 -1.194 6.205
102 1HG1 ILE 13 2HG1 ILE 13 0.750 -1.538 3.350
103 2HG1 ILE 13 1HG1 ILE 13 -0.360 -0.290 3.904
104 1HG2 ILE 13 1HG2 ILE 13 2.046 -2.158 6.035
105 2HG2 ILE 13 2HG2 ILE 13 1.435 -3.384 4.924
106 3HG2 ILE 13 3HG2 ILE 13 0.874 -3.351 6.595
107 1HD1 ILE 13 1HD1 ILE 13 2.372 -0.077 3.716
108 2HD1 ILE 13 2HD1 ILE 13 2.100 -0.343 5.439
109 3HD1 ILE 13 3HD1 ILE 13 1.303 0.998 4.616
110 H LEU 14 H LEU 14 -2.507 -1.919 7.032
111 HA LEU 14 HA LEU 14 -2.045 -4.348 8.522
112 1HB LEU 14 2HB LEU 14 -3.510 -3.143 10.269
113 2HB LEU 14 1HB LEU 14 -1.890 -2.565 9.968
114 HG LEU 14 HG LEU 14 -3.613 -0.787 10.320
115 1HD1 LEU 14 1HD1 LEU 14 -2.019 -0.839 7.783
116 2HD1 LEU 14 2HD1 LEU 14 -1.623 -0.075 9.322
117 3HD1 LEU 14 3HD1 LEU 14 -2.912 0.585 8.314
118 1HD2 LEU 14 1HD2 LEU 14 -5.393 -0.435 8.982
119 2HD2 LEU 14 2HD2 LEU 14 -5.244 -2.174 8.723
120 3HD2 LEU 14 3HD2 LEU 14 -4.576 -1.046 7.543
121 H GLY 15 H GLY 15 -3.575 -4.604 6.130
122 1HA GLY 15 2HA GLY 15 -5.913 -5.919 7.281
123 2HA GLY 15 1HA GLY 15 -6.220 -4.687 6.064
124 H PHE 16 H PHE 16 -4.070 -5.157 4.341
125 HA PHE 16 HA PHE 16 -3.947 -7.927 3.629
126 1HB PHE 16 2HB PHE 16 -6.250 -7.190 2.847
127 2HB PHE 16 1HB PHE 16 -5.433 -6.119 1.716
128 HD1 PHE 16 1HD PHE 16 -5.999 -7.009 -0.357
129 HD2 PHE 16 2HD PHE 16 -4.496 -9.578 2.686
130 HE1 PHE 16 1HE PHE 16 -5.855 -8.848 -1.985
131 HE2 PHE 16 2HE PHE 16 -4.347 -11.421 1.062
132 HZ PHE 16 HZ PHE 16 -5.027 -11.056 -1.277
133 H VAL 17 H VAL 17 -2.167 -8.302 2.493
134 HA VAL 17 HA VAL 17 -0.193 -8.036 1.424
135 HB VAL 17 HB VAL 17 -1.071 -5.495 0.104
136 1HG1 VAL 17 1HG1 VAL 17 0.916 -7.538 -0.324
137 2HG1 VAL 17 2HG1 VAL 17 0.762 -5.946 -1.071
138 3HG1 VAL 17 3HG1 VAL 17 -0.093 -7.328 -1.755
139 1HG2 VAL 17 1HG2 VAL 17 -2.435 -6.635 -1.496
140 2HG2 VAL 17 2HG2 VAL 17 -3.044 -7.039 0.108
141 3HG2 VAL 17 3HG2 VAL 17 -2.060 -8.202 -0.780
142 H TYR 18 H TYR 18 1.430 -5.998 0.799
143 HA TYR 18 HA TYR 18 1.618 -3.860 2.602
144 1HB TYR 18 2HB TYR 18 3.473 -4.676 4.038
145 2HB TYR 18 1HB TYR 18 1.981 -5.564 4.317
146 HD1 TYR 18 1HD TYR 18 1.842 -7.912 3.883
147 HD2 TYR 18 2HD TYR 18 5.352 -5.756 2.816
148 HE1 TYR 18 1HE TYR 18 3.026 -10.033 3.509
149 HE2 TYR 18 2HE TYR 18 6.543 -7.872 2.437
150 HH TYR 18 HH TYR 18 5.981 -10.529 3.535
151 H CYS 19 H CYS 19 3.343 -2.513 2.057
152 HA CYS 19 HA CYS 19 4.575 -3.020 -0.485
153 1HB CYS 19 2HB CYS 19 4.898 -0.851 1.552
154 2HB CYS 19 1HB CYS 19 5.701 -0.814 -0.010
155 H CYS 20 H CYS 20 6.966 -2.442 -0.720
156 HA CYS 20 HA CYS 20 8.519 -4.332 0.773
157 1HB CYS 20 2HB CYS 20 9.564 -2.164 -1.047
158 2HB CYS 20 1HB CYS 20 10.346 -3.680 -0.630
159 HA PRO 21 HA PRO 21 9.870 -1.915 4.173
160 1HB PRO 21 2HB PRO 21 12.671 -2.471 3.346
161 2HB PRO 21 1HB PRO 21 11.878 -2.686 4.911
162 1HG PRO 21 2HG PRO 21 12.379 -4.786 3.334
163 2HG PRO 21 1HG PRO 21 10.881 -4.689 4.279
164 1HD PRO 21 2HD PRO 21 11.311 -4.235 1.358
165 2HD PRO 21 1HD PRO 21 9.919 -4.950 2.192
166 H GLY 22 H GLY 22 9.602 0.131 4.024
167 1HA GLY 22 2HA GLY 22 10.849 2.267 3.881
168 2HA GLY 22 1HA GLY 22 11.380 1.727 2.295
169 H LEU 23 H LEU 23 8.745 0.606 1.606
170 HA LEU 23 HA LEU 23 7.418 3.145 0.967
171 1HB LEU 23 2HB LEU 23 7.065 0.429 -0.305
172 2HB LEU 23 1HB LEU 23 6.415 1.949 -0.888
173 HG LEU 23 HG LEU 23 9.362 1.318 -0.728
174 1HD1 LEU 23 1HD1 LEU 23 7.323 0.812 -2.815
175 2HD1 LEU 23 2HD1 LEU 23 8.797 -0.076 -2.425
176 3HD1 LEU 23 3HD1 LEU 23 8.889 1.427 -3.343
177 1HD2 LEU 23 1HD2 LEU 23 8.398 3.387 -2.556
178 2HD2 LEU 23 2HD2 LEU 23 9.763 3.404 -1.439
179 3HD2 LEU 23 3HD2 LEU 23 8.138 3.758 -0.852
180 H ILE 24 H ILE 24 5.132 3.327 1.197
181 HA ILE 24 HA ILE 24 3.774 1.180 2.657
182 HB ILE 24 HB ILE 24 2.797 2.765 4.299
183 1HG1 ILE 24 2HG1 ILE 24 3.402 4.841 2.934
184 2HG1 ILE 24 1HG1 ILE 24 3.618 4.941 4.674
185 1HG2 ILE 24 1HG2 ILE 24 4.894 2.974 5.709
186 2HG2 ILE 24 2HG2 ILE 24 5.749 2.253 4.344
187 3HG2 ILE 24 3HG2 ILE 24 4.456 1.360 5.146
188 1HD1 ILE 24 1HD1 ILE 24 6.063 4.355 4.219
189 2HD1 ILE 24 2HD1 ILE 24 5.505 5.969 3.779
190 3HD1 ILE 24 3HD1 ILE 24 5.703 4.735 2.535
191 H CYS 25 H CYS 25 1.692 0.912 2.076
192 HA CYS 25 HA CYS 25 0.608 2.442 -0.069
193 1HB CYS 25 2HB CYS 25 -0.691 0.399 1.739
194 2HB CYS 25 1HB CYS 25 -1.471 1.106 0.327
195 H GLY 26 H GLY 26 -0.775 4.137 -0.090
196 1HA GLY 26 2HA GLY 26 -2.111 4.897 2.405
197 2HA GLY 26 1HA GLY 26 -0.999 6.052 1.692
198 HA PRO 27 HA PRO 27 -4.357 7.581 -0.729
199 1HB PRO 27 2HB PRO 27 -2.601 8.324 -2.922
200 2HB PRO 27 1HB PRO 27 -3.372 9.363 -1.723
201 1HG PRO 27 2HG PRO 27 -0.687 8.922 -1.807
202 2HG PRO 27 1HG PRO 27 -1.566 9.296 -0.314
203 1HD PRO 27 2HD PRO 27 -0.622 6.646 -1.348
204 2HD PRO 27 1HD PRO 27 -0.583 7.288 0.309
205 H PHE 28 H PHE 28 -4.420 4.971 -0.991
206 HA PHE 28 HA PHE 28 -5.195 3.260 -2.244
207 1HB PHE 28 2HB PHE 28 -5.753 5.470 -4.255
208 2HB PHE 28 1HB PHE 28 -6.193 3.787 -4.529
209 HD1 PHE 28 1HD PHE 28 -8.481 3.710 -4.480
210 HD2 PHE 28 2HD PHE 28 -6.436 5.865 -1.433
211 HE1 PHE 28 1HE PHE 28 -10.613 4.072 -3.308
212 HE2 PHE 28 2HE PHE 28 -8.564 6.229 -0.256
213 HZ PHE 28 HZ PHE 28 -10.657 5.332 -1.193
214 H VAL 29 H VAL 29 -2.382 4.502 -2.500
215 HA VAL 29 HA VAL 29 -1.357 2.492 -4.311
216 HB VAL 29 HB VAL 29 0.198 4.083 -5.465
217 1HG1 VAL 29 1HG1 VAL 29 -2.712 4.008 -5.934
218 2HG1 VAL 29 2HG1 VAL 29 -1.371 3.610 -7.008
219 3HG1 VAL 29 3HG1 VAL 29 -1.834 5.295 -6.761
220 1HG2 VAL 29 1HG2 VAL 29 -0.124 5.890 -3.707
221 2HG2 VAL 29 2HG2 VAL 29 -1.619 6.304 -4.547
222 3HG2 VAL 29 3HG2 VAL 29 -0.073 6.423 -5.387
223 H CYS 30 H CYS 30 1.115 2.515 -4.057
224 HA CYS 30 HA CYS 30 1.681 2.957 -1.239
225 1HB CYS 30 2HB CYS 30 2.237 0.795 -2.463
226 2HB CYS 30 1HB CYS 30 3.482 1.703 -3.306
227 H VAL 31 H VAL 31 3.572 4.140 -0.542
228 HA VAL 31 HA VAL 31 4.694 5.930 -2.580
229 HB VAL 31 HB VAL 31 4.492 7.877 -1.079
230 1HG1 VAL 31 1HG1 VAL 31 1.674 7.078 -1.143
231 2HG1 VAL 31 2HG1 VAL 31 2.533 6.859 -2.669
232 3HG1 VAL 31 3HG1 VAL 31 2.487 8.447 -1.903
233 1HG2 VAL 31 1HG2 VAL 31 3.247 7.859 0.942
234 2HG2 VAL 31 2HG2 VAL 31 4.382 6.512 1.030
235 3HG2 VAL 31 3HG2 VAL 31 2.684 6.213 0.658
Start of MODEL 15
1 1H ALA 1 1HT ALA 1 3.317 -10.675 1.316
2 2H ALA 1 2HT ALA 1 2.545 -11.198 -0.096
3 3H ALA 1 3HT ALA 1 2.383 -9.591 0.411
4 HA ALA 1 HA ALA 1 5.113 -10.293 0.119
5 1HB ALA 1 1HB ALA 1 5.113 -10.465 -2.334
6 2HB ALA 1 2HB ALA 1 3.351 -10.532 -2.322
7 3HB ALA 1 3HB ALA 1 4.289 -11.830 -1.581
8 H CYS 2 H CYS 2 6.215 -8.489 -0.860
9 HA CYS 2 HA CYS 2 4.681 -6.035 -0.585
10 1HB CYS 2 2HB CYS 2 6.767 -4.903 -0.477
11 2HB CYS 2 1HB CYS 2 6.945 -6.355 0.486
12 H SER 3 H SER 3 4.356 -4.550 -2.258
13 HA SER 3 HA SER 3 4.911 -5.635 -4.932
14 1HB SER 3 2HB SER 3 2.504 -5.505 -4.136
15 2HB SER 3 1HB SER 3 2.666 -3.753 -4.221
16 HG SER 3 HG SER 3 1.801 -4.908 -6.145
17 H LYS 4 H LYS 4 4.100 -3.424 -6.394
18 HA LYS 4 HA LYS 4 6.485 -1.808 -6.312
19 1HB LYS 4 2HB LYS 4 4.157 -1.268 -8.125
20 2HB LYS 4 1HB LYS 4 5.874 -1.050 -8.433
21 1HG LYS 4 2HG LYS 4 6.149 -3.491 -8.525
22 2HG LYS 4 1HG LYS 4 4.412 -3.680 -8.272
23 1HD LYS 4 2HD LYS 4 4.215 -2.112 -10.341
24 2HD LYS 4 1HD LYS 4 5.879 -2.610 -10.651
25 1HE LYS 4 2HE LYS 4 4.438 -4.068 -11.877
26 2HE LYS 4 1HE LYS 4 5.111 -4.983 -10.530
27 1HZ LYS 4 1HZ LYS 4 2.618 -3.680 -9.898
28 2HZ LYS 4 2HZ LYS 4 3.092 -5.286 -9.650
29 3HZ LYS 4 3HZ LYS 4 2.479 -4.813 -11.149
30 H LYS 5 H LYS 5 6.557 0.459 -6.109
31 HA LYS 5 HA LYS 5 5.011 1.548 -4.075
32 1HB LYS 5 2HB LYS 5 7.072 2.593 -4.391
33 2HB LYS 5 1HB LYS 5 6.829 2.764 -6.125
34 1HG LYS 5 2HG LYS 5 5.474 4.624 -5.881
35 2HG LYS 5 1HG LYS 5 5.044 4.218 -4.238
36 1HD LYS 5 2HD LYS 5 7.212 4.871 -3.446
37 2HD LYS 5 1HD LYS 5 7.790 5.092 -5.100
38 1HE LYS 5 2HE LYS 5 6.586 7.034 -5.407
39 2HE LYS 5 1HE LYS 5 5.398 6.619 -4.174
40 1HZ LYS 5 1HZ LYS 5 6.812 8.385 -3.390
41 2HZ LYS 5 2HZ LYS 5 8.203 7.473 -3.689
42 3HZ LYS 5 3HZ LYS 5 7.117 6.989 -2.477
43 H TRP 6 H TRP 6 4.786 2.324 -7.539
44 HA TRP 6 HA TRP 6 2.385 3.805 -7.012
45 1HB TRP 6 2HB TRP 6 3.530 3.105 -9.717
46 2HB TRP 6 1HB TRP 6 2.453 4.440 -9.310
47 HD1 TRP 6 HD TRP 6 6.111 3.328 -8.872
48 HE1 TRP 6 1HE TRP 6 7.559 5.402 -8.421
49 HE3 TRP 6 3HE TRP 6 2.408 6.804 -8.352
50 HZ2 TRP 6 2HZ TRP 6 7.181 8.144 -7.891
51 HZ3 TRP 6 3HZ TRP 6 3.032 9.129 -7.862
52 HH2 TRP 6 HH TRP 6 5.372 9.784 -7.630
53 H GLU 7 H GLU 7 2.502 0.874 -6.485
54 HA GLU 7 HA GLU 7 0.675 -0.303 -8.392
55 1HB GLU 7 2HB GLU 7 2.375 -1.538 -6.889
56 2HB GLU 7 1HB GLU 7 1.195 -1.322 -5.605
57 1HG GLU 7 2HG GLU 7 0.731 -3.439 -6.390
58 2HG GLU 7 1HG GLU 7 -0.454 -2.441 -7.232
59 H TYR 8 H TYR 8 -1.499 -0.346 -8.263
60 HA TYR 8 HA TYR 8 -2.819 1.420 -6.413
61 1HB TYR 8 2HB TYR 8 -3.332 0.798 -8.955
62 2HB TYR 8 1HB TYR 8 -4.306 -0.465 -8.217
63 HD1 TYR 8 1HD TYR 8 -6.452 0.261 -8.873
64 HD2 TYR 8 2HD TYR 8 -3.837 2.963 -6.886
65 HE1 TYR 8 1HE TYR 8 -8.301 1.863 -8.630
66 HE2 TYR 8 2HE TYR 8 -5.681 4.570 -6.631
67 HH TYR 8 HH TYR 8 -7.779 5.098 -7.382
68 H CYS 9 H CYS 9 -1.904 0.022 -4.615
69 HA CYS 9 HA CYS 9 -2.826 -2.545 -4.051
70 1HB CYS 9 2HB CYS 9 -2.275 -1.836 -1.612
71 2HB CYS 9 1HB CYS 9 -0.983 -1.922 -2.805
72 H ILE 10 H ILE 10 -4.456 0.499 -3.599
73 HA ILE 10 HA ILE 10 -6.563 1.013 -2.904
74 HB ILE 10 HB ILE 10 -7.040 -1.976 -3.029
75 1HG1 ILE 10 2HG1 ILE 10 -6.397 -0.963 -5.190
76 2HG1 ILE 10 1HG1 ILE 10 -8.066 -1.525 -5.197
77 1HG2 ILE 10 1HG2 ILE 10 -9.436 -0.596 -3.459
78 2HG2 ILE 10 2HG2 ILE 10 -8.695 0.166 -2.052
79 3HG2 ILE 10 3HG2 ILE 10 -8.998 -1.570 -2.057
80 1HD1 ILE 10 1HD1 ILE 10 -7.989 1.203 -4.362
81 2HD1 ILE 10 2HD1 ILE 10 -8.771 0.487 -5.771
82 3HD1 ILE 10 3HD1 ILE 10 -7.091 1.016 -5.869
83 H VAL 11 H VAL 11 -5.708 1.761 -0.943
84 HA VAL 11 HA VAL 11 -6.479 0.141 1.376
85 HB VAL 11 HB VAL 11 -4.485 0.890 2.611
86 1HG1 VAL 11 1HG1 VAL 11 -4.396 -1.285 1.545
87 2HG1 VAL 11 2HG1 VAL 11 -2.810 -0.515 1.485
88 3HG1 VAL 11 3HG1 VAL 11 -3.828 -0.552 0.045
89 1HG2 VAL 11 1HG2 VAL 11 -2.655 2.007 1.542
90 2HG2 VAL 11 2HG2 VAL 11 -4.121 2.949 1.271
91 3HG2 VAL 11 3HG2 VAL 11 -3.468 1.941 -0.022
92 HA PRO 12 HA PRO 12 -8.431 3.782 2.916
93 1HB PRO 12 2HB PRO 12 -7.033 3.429 5.504
94 2HB PRO 12 1HB PRO 12 -8.764 3.467 5.159
95 1HG PRO 12 2HG PRO 12 -7.529 1.178 5.771
96 2HG PRO 12 1HG PRO 12 -8.833 1.231 4.570
97 1HD PRO 12 2HD PRO 12 -5.875 1.062 4.153
98 2HD PRO 12 1HD PRO 12 -7.188 0.253 3.270
99 H ILE 13 H ILE 13 -8.015 5.922 2.943
100 HA ILE 13 HA ILE 13 -5.548 6.961 2.237
101 HB ILE 13 HB ILE 13 -7.695 8.103 1.851
102 1HG1 ILE 13 2HG1 ILE 13 -6.929 10.415 2.385
103 2HG1 ILE 13 1HG1 ILE 13 -5.651 9.726 3.380
104 1HG2 ILE 13 1HG2 ILE 13 -9.095 8.149 3.591
105 2HG2 ILE 13 2HG2 ILE 13 -8.227 9.614 4.050
106 3HG2 ILE 13 3HG2 ILE 13 -7.788 8.066 4.773
107 1HD1 ILE 13 1HD1 ILE 13 -5.158 10.463 0.941
108 2HD1 ILE 13 2HD1 ILE 13 -5.889 8.912 0.523
109 3HD1 ILE 13 3HD1 ILE 13 -4.467 8.966 1.565
110 H LEU 14 H LEU 14 -6.727 6.178 5.374
111 HA LEU 14 HA LEU 14 -5.193 7.893 6.974
112 1HB LEU 14 2HB LEU 14 -6.251 5.121 7.512
113 2HB LEU 14 1HB LEU 14 -5.450 6.095 8.726
114 HG LEU 14 HG LEU 14 -7.745 6.344 9.144
115 1HD1 LEU 14 1HD1 LEU 14 -6.202 8.524 8.461
116 2HD1 LEU 14 2HD1 LEU 14 -7.718 8.551 9.360
117 3HD1 LEU 14 3HD1 LEU 14 -7.725 8.803 7.615
118 1HD2 LEU 14 1HD2 LEU 14 -9.223 7.256 7.185
119 2HD2 LEU 14 2HD2 LEU 14 -8.922 5.526 7.357
120 3HD2 LEU 14 3HD2 LEU 14 -8.006 6.468 6.180
121 H GLY 15 H GLY 15 -4.386 4.939 5.293
122 1HA GLY 15 2HA GLY 15 -1.997 4.755 4.697
123 2HA GLY 15 1HA GLY 15 -1.646 5.163 6.369
124 H PHE 16 H PHE 16 -1.134 2.767 4.548
125 HA PHE 16 HA PHE 16 -1.411 0.778 6.593
126 1HB PHE 16 2HB PHE 16 -3.683 0.720 5.574
127 2HB PHE 16 1HB PHE 16 -2.950 0.382 4.010
128 HD1 PHE 16 1HD PHE 16 -3.501 -1.765 3.408
129 HD2 PHE 16 2HD PHE 16 -2.289 -0.994 7.414
130 HE1 PHE 16 1HE PHE 16 -3.582 -4.175 3.893
131 HE2 PHE 16 2HE PHE 16 -2.366 -3.404 7.906
132 HZ PHE 16 HZ PHE 16 -3.013 -4.998 6.143
133 H VAL 17 H VAL 17 0.236 -0.683 6.369
134 HA VAL 17 HA VAL 17 2.119 -0.248 4.264
135 HB VAL 17 HB VAL 17 2.368 -2.731 5.828
136 1HG1 VAL 17 1HG1 VAL 17 4.022 -1.150 4.283
137 2HG1 VAL 17 2HG1 VAL 17 4.497 -2.521 5.285
138 3HG1 VAL 17 3HG1 VAL 17 4.576 -0.884 5.937
139 1HG2 VAL 17 1HG2 VAL 17 2.672 -1.851 7.919
140 2HG2 VAL 17 2HG2 VAL 17 1.430 -0.749 7.324
141 3HG2 VAL 17 3HG2 VAL 17 3.125 -0.263 7.302
142 H TYR 18 H TYR 18 3.037 -2.178 3.123
143 HA TYR 18 HA TYR 18 1.650 -4.489 2.483
144 1HB TYR 18 2HB TYR 18 -0.062 -2.916 1.543
145 2HB TYR 18 1HB TYR 18 1.162 -2.304 0.434
146 HD1 TYR 18 1HD TYR 18 0.189 -5.757 1.495
147 HD2 TYR 18 2HD TYR 18 0.689 -3.010 -1.716
148 HE1 TYR 18 1HE TYR 18 -0.376 -7.534 -0.104
149 HE2 TYR 18 2HE TYR 18 0.121 -4.782 -3.325
150 HH TYR 18 HH TYR 18 -1.366 -7.122 -3.044
151 H CYS 19 H CYS 19 3.485 -1.820 1.124
152 HA CYS 19 HA CYS 19 5.036 -3.367 -0.683
153 1HB CYS 19 2HB CYS 19 5.348 -0.620 0.493
154 2HB CYS 19 1HB CYS 19 6.526 -1.288 -0.629
155 H CYS 20 H CYS 20 7.518 -3.164 -0.507
156 HA CYS 20 HA CYS 20 8.318 -4.669 1.767
157 1HB CYS 20 2HB CYS 20 9.587 -3.724 -0.717
158 2HB CYS 20 1HB CYS 20 10.675 -3.920 0.644
159 HA PRO 21 HA PRO 21 9.554 -1.692 4.714
160 1HB PRO 21 2HB PRO 21 12.366 -2.627 4.440
161 2HB PRO 21 1HB PRO 21 11.367 -2.404 5.882
162 1HG PRO 21 2HG PRO 21 11.814 -4.852 4.905
163 2HG PRO 21 1HG PRO 21 10.228 -4.410 5.567
164 1HD PRO 21 2HD PRO 21 11.076 -4.694 2.717
165 2HD PRO 21 1HD PRO 21 9.515 -5.066 3.460
166 H GLY 22 H GLY 22 9.433 0.232 4.023
167 1HA GLY 22 2HA GLY 22 11.099 2.152 3.640
168 2HA GLY 22 1HA GLY 22 11.404 1.304 2.131
169 H LEU 23 H LEU 23 8.736 0.487 1.600
170 HA LEU 23 HA LEU 23 7.532 3.105 0.973
171 1HB LEU 23 2HB LEU 23 7.186 0.479 -0.478
172 2HB LEU 23 1HB LEU 23 6.513 2.024 -0.960
173 HG LEU 23 HG LEU 23 9.465 1.404 -0.846
174 1HD1 LEU 23 1HD1 LEU 23 9.444 1.077 -3.153
175 2HD1 LEU 23 2HD1 LEU 23 7.833 1.772 -3.331
176 3HD1 LEU 23 3HD1 LEU 23 8.031 0.186 -2.586
177 1HD2 LEU 23 1HD2 LEU 23 8.957 3.765 -0.512
178 2HD2 LEU 23 2HD2 LEU 23 7.965 3.767 -1.969
179 3HD2 LEU 23 3HD2 LEU 23 9.704 3.496 -2.086
180 H ILE 24 H ILE 24 5.313 3.411 1.275
181 HA ILE 24 HA ILE 24 3.821 1.219 2.553
182 HB ILE 24 HB ILE 24 2.871 2.864 4.207
183 1HG1 ILE 24 2HG1 ILE 24 5.283 4.507 3.403
184 2HG1 ILE 24 1HG1 ILE 24 3.612 4.915 3.028
185 1HG2 ILE 24 1HG2 ILE 24 5.592 1.725 4.241
186 2HG2 ILE 24 2HG2 ILE 24 4.230 1.456 5.329
187 3HG2 ILE 24 3HG2 ILE 24 5.220 2.905 5.497
188 1HD1 ILE 24 1HD1 ILE 24 4.702 4.635 5.817
189 2HD1 ILE 24 2HD1 ILE 24 3.108 5.227 5.346
190 3HD1 ILE 24 3HD1 ILE 24 4.550 6.161 4.946
191 H CYS 25 H CYS 25 1.647 1.184 2.123
192 HA CYS 25 HA CYS 25 0.734 2.825 -0.044
193 1HB CYS 25 2HB CYS 25 -0.443 0.535 1.482
194 2HB CYS 25 1HB CYS 25 -1.455 1.499 0.414
195 H GLY 26 H GLY 26 -0.753 4.416 -0.067
196 1HA GLY 26 2HA GLY 26 -2.006 5.188 2.478
197 2HA GLY 26 1HA GLY 26 -1.047 6.373 1.604
198 HA PRO 27 HA PRO 27 -4.710 7.409 -0.645
199 1HB PRO 27 2HB PRO 27 -3.688 8.505 -2.891
200 2HB PRO 27 1HB PRO 27 -3.563 9.293 -1.314
201 1HG PRO 27 2HG PRO 27 -1.517 7.712 -2.812
202 2HG PRO 27 1HG PRO 27 -1.315 9.196 -1.865
203 1HD PRO 27 2HD PRO 27 -0.700 6.684 -0.943
204 2HD PRO 27 1HD PRO 27 -1.122 8.051 0.105
205 H PHE 28 H PHE 28 -4.463 4.805 -0.782
206 HA PHE 28 HA PHE 28 -5.064 2.941 -1.893
207 1HB PHE 28 2HB PHE 28 -6.044 4.919 -3.980
208 2HB PHE 28 1HB PHE 28 -6.312 3.180 -4.079
209 HD1 PHE 28 1HD PHE 28 -6.768 5.977 -1.635
210 HD2 PHE 28 2HD PHE 28 -8.294 2.369 -3.298
211 HE1 PHE 28 1HE PHE 28 -8.791 6.204 -0.256
212 HE2 PHE 28 2HE PHE 28 -10.322 2.591 -1.923
213 HZ PHE 28 HZ PHE 28 -10.573 4.510 -0.400
214 H VAL 29 H VAL 29 -2.442 4.427 -2.372
215 HA VAL 29 HA VAL 29 -1.389 2.500 -4.281
216 HB VAL 29 HB VAL 29 0.025 4.206 -5.435
217 1HG1 VAL 29 1HG1 VAL 29 -2.944 4.212 -5.728
218 2HG1 VAL 29 2HG1 VAL 29 -1.700 3.595 -6.816
219 3HG1 VAL 29 3HG1 VAL 29 -1.981 5.331 -6.692
220 1HG2 VAL 29 1HG2 VAL 29 -0.193 5.936 -3.643
221 2HG2 VAL 29 2HG2 VAL 29 -1.821 6.270 -4.234
222 3HG2 VAL 29 3HG2 VAL 29 -0.428 6.547 -5.280
223 H CYS 30 H CYS 30 1.061 2.552 -4.095
224 HA CYS 30 HA CYS 30 1.741 2.958 -1.300
225 1HB CYS 30 2HB CYS 30 2.185 0.839 -2.684
226 2HB CYS 30 1HB CYS 30 3.494 1.753 -3.416
227 H VAL 31 H VAL 31 3.599 4.159 -0.631
228 HA VAL 31 HA VAL 31 4.737 5.938 -2.666
229 HB VAL 31 HB VAL 31 4.529 7.892 -1.173
230 1HG1 VAL 31 1HG1 VAL 31 1.707 7.164 -1.242
231 2HG1 VAL 31 2HG1 VAL 31 2.553 6.832 -2.754
232 3HG1 VAL 31 3HG1 VAL 31 2.567 8.460 -2.075
233 1HG2 VAL 31 1HG2 VAL 31 3.073 7.832 0.789
234 2HG2 VAL 31 2HG2 VAL 31 4.434 6.725 0.967
235 3HG2 VAL 31 3HG2 VAL 31 2.836 6.099 0.564
Start of MODEL 16
1 1H ALA 1 1HT ALA 1 6.669 -10.612 1.611
2 2H ALA 1 2HT ALA 1 5.239 -11.304 2.185
3 3H ALA 1 3HT ALA 1 5.602 -9.691 2.548
4 HA ALA 1 HA ALA 1 5.575 -10.241 -0.268
5 1HB ALA 1 1HB ALA 1 3.334 -11.113 1.409
6 2HB ALA 1 2HB ALA 1 3.737 -11.532 -0.256
7 3HB ALA 1 3HB ALA 1 2.880 -10.030 0.093
8 H CYS 2 H CYS 2 5.011 -8.335 -1.349
9 HA CYS 2 HA CYS 2 3.944 -6.105 0.183
10 1HB CYS 2 2HB CYS 2 5.809 -4.636 -0.285
11 2HB CYS 2 1HB CYS 2 6.340 -6.020 0.653
12 H SER 3 H SER 3 4.997 -4.221 -1.906
13 HA SER 3 HA SER 3 3.966 -5.113 -4.414
14 1HB SER 3 2HB SER 3 1.853 -4.744 -3.146
15 2HB SER 3 1HB SER 3 2.335 -3.071 -2.875
16 HG SER 3 HG SER 3 1.620 -2.613 -4.786
17 H LYS 4 H LYS 4 4.110 -3.448 -6.054
18 HA LYS 4 HA LYS 4 6.427 -1.846 -5.815
19 1HB LYS 4 2HB LYS 4 5.437 -2.833 -7.939
20 2HB LYS 4 1HB LYS 4 4.247 -1.543 -7.887
21 1HG LYS 4 2HG LYS 4 6.236 0.058 -7.874
22 2HG LYS 4 1HG LYS 4 7.204 -1.342 -8.343
23 1HD LYS 4 2HD LYS 4 4.836 -0.202 -9.828
24 2HD LYS 4 1HD LYS 4 6.529 -0.118 -10.319
25 1HE LYS 4 2HE LYS 4 6.568 -2.275 -11.036
26 2HE LYS 4 1HE LYS 4 5.417 -2.816 -9.814
27 1HZ LYS 4 1HZ LYS 4 4.285 -2.962 -11.841
28 2HZ LYS 4 2HZ LYS 4 4.840 -1.460 -12.382
29 3HZ LYS 4 3HZ LYS 4 3.696 -1.542 -11.129
30 H LYS 5 H LYS 5 6.633 0.415 -5.662
31 HA LYS 5 HA LYS 5 5.001 1.705 -3.875
32 1HB LYS 5 2HB LYS 5 7.160 2.599 -4.183
33 2HB LYS 5 1HB LYS 5 6.917 2.802 -5.913
34 1HG LYS 5 2HG LYS 5 5.640 4.710 -5.644
35 2HG LYS 5 1HG LYS 5 5.196 4.302 -4.001
36 1HD LYS 5 2HD LYS 5 7.412 4.838 -3.219
37 2HD LYS 5 1HD LYS 5 7.962 5.104 -4.877
38 1HE LYS 5 2HE LYS 5 6.841 7.097 -5.076
39 2HE LYS 5 1HE LYS 5 5.625 6.660 -3.877
40 1HZ LYS 5 1HZ LYS 5 7.236 6.978 -2.129
41 2HZ LYS 5 2HZ LYS 5 7.165 8.378 -3.082
42 3HZ LYS 5 3HZ LYS 5 8.460 7.306 -3.257
43 H TRP 6 H TRP 6 5.076 2.572 -7.320
44 HA TRP 6 HA TRP 6 2.599 3.975 -6.981
45 1HB TRP 6 2HB TRP 6 3.999 3.414 -9.595
46 2HB TRP 6 1HB TRP 6 2.892 4.730 -9.217
47 HD1 TRP 6 HD TRP 6 6.510 3.599 -8.574
48 HE1 TRP 6 1HE TRP 6 7.911 5.649 -7.915
49 HE3 TRP 6 3HE TRP 6 2.761 7.038 -8.138
50 HZ2 TRP 6 2HZ TRP 6 7.483 8.361 -7.274
51 HZ3 TRP 6 3HZ TRP 6 3.338 9.338 -7.490
52 HH2 TRP 6 HH TRP 6 5.652 9.984 -7.061
53 H GLU 7 H GLU 7 2.662 1.070 -6.523
54 HA GLU 7 HA GLU 7 0.910 0.129 -8.694
55 1HB GLU 7 2HB GLU 7 2.855 -1.198 -7.319
56 2HB GLU 7 1HB GLU 7 1.430 -1.648 -6.395
57 1HG GLU 7 2HG GLU 7 1.756 -3.333 -8.009
58 2HG GLU 7 1HG GLU 7 0.382 -2.374 -8.557
59 H TYR 8 H TYR 8 -1.235 -0.244 -8.378
60 HA TYR 8 HA TYR 8 -2.572 1.180 -6.356
61 1HB TYR 8 2HB TYR 8 -3.651 0.748 -8.482
62 2HB TYR 8 1HB TYR 8 -3.527 -0.990 -8.247
63 HD1 TYR 8 1HD TYR 8 -5.508 -2.034 -7.766
64 HD2 TYR 8 2HD TYR 8 -4.911 1.925 -6.339
65 HE1 TYR 8 1HE TYR 8 -7.753 -2.065 -6.764
66 HE2 TYR 8 2HE TYR 8 -7.152 1.906 -5.328
67 HH TYR 8 HH TYR 8 -8.800 -0.510 -4.555
68 H CYS 9 H CYS 9 -2.797 0.681 -4.294
69 HA CYS 9 HA CYS 9 -2.113 -1.903 -3.282
70 1HB CYS 9 2HB CYS 9 -3.321 0.498 -1.888
71 2HB CYS 9 1HB CYS 9 -2.753 -0.954 -1.071
72 H ILE 10 H ILE 10 -3.553 -3.313 -4.255
73 HA ILE 10 HA ILE 10 -6.366 -3.057 -4.165
74 HB ILE 10 HB ILE 10 -6.500 -5.377 -4.832
75 1HG1 ILE 10 2HG1 ILE 10 -4.673 -6.191 -3.274
76 2HG1 ILE 10 1HG1 ILE 10 -4.675 -6.907 -4.879
77 1HG2 ILE 10 1HG2 ILE 10 -4.921 -5.312 -6.815
78 2HG2 ILE 10 2HG2 ILE 10 -4.336 -3.782 -6.162
79 3HG2 ILE 10 3HG2 ILE 10 -6.029 -3.953 -6.630
80 1HD1 ILE 10 1HD1 ILE 10 -2.953 -4.537 -4.456
81 2HD1 ILE 10 2HD1 ILE 10 -2.687 -5.976 -5.441
82 3HD1 ILE 10 3HD1 ILE 10 -2.468 -6.051 -3.692
83 H VAL 11 H VAL 11 -4.035 -4.101 -1.888
84 HA VAL 11 HA VAL 11 -5.660 -5.727 -0.252
85 HB VAL 11 HB VAL 11 -3.933 -5.397 1.474
86 1HG1 VAL 11 1HG1 VAL 11 -2.676 -6.915 0.436
87 2HG1 VAL 11 2HG1 VAL 11 -2.149 -5.751 -0.780
88 3HG1 VAL 11 3HG1 VAL 11 -3.664 -6.627 -0.996
89 1HG2 VAL 11 1HG2 VAL 11 -2.110 -3.866 -0.217
90 2HG2 VAL 11 2HG2 VAL 11 -2.470 -3.699 1.502
91 3HG2 VAL 11 3HG2 VAL 11 -3.520 -2.942 0.303
92 HA PRO 12 HA PRO 12 -8.409 -2.845 1.623
93 1HB PRO 12 2HB PRO 12 -7.968 -4.511 4.057
94 2HB PRO 12 1HB PRO 12 -9.482 -4.020 3.286
95 1HG PRO 12 2HG PRO 12 -8.567 -6.500 3.001
96 2HG PRO 12 1HG PRO 12 -9.325 -5.651 1.640
97 1HD PRO 12 2HD PRO 12 -6.437 -6.197 2.165
98 2HD PRO 12 1HD PRO 12 -7.319 -6.172 0.625
99 H ILE 13 H ILE 13 -7.858 -0.907 2.212
100 HA ILE 13 HA ILE 13 -5.474 -0.072 3.347
101 HB ILE 13 HB ILE 13 -7.025 1.378 2.082
102 1HG1 ILE 13 2HG1 ILE 13 -6.383 2.460 4.836
103 2HG1 ILE 13 1HG1 ILE 13 -5.241 2.354 3.501
104 1HG2 ILE 13 1HG2 ILE 13 -9.167 1.460 2.640
105 2HG2 ILE 13 2HG2 ILE 13 -8.721 2.361 4.089
106 3HG2 ILE 13 3HG2 ILE 13 -8.848 0.603 4.148
107 1HD1 ILE 13 1HD1 ILE 13 -7.135 3.767 2.290
108 2HD1 ILE 13 2HD1 ILE 13 -5.869 4.513 3.262
109 3HD1 ILE 13 3HD1 ILE 13 -7.468 4.243 3.955
110 H LEU 14 H LEU 14 -8.150 -1.498 4.881
111 HA LEU 14 HA LEU 14 -8.159 -0.383 7.422
112 1HB LEU 14 2HB LEU 14 -9.821 -2.002 6.601
113 2HB LEU 14 1HB LEU 14 -8.609 -3.267 6.642
114 HG LEU 14 HG LEU 14 -8.446 -2.971 9.109
115 1HD1 LEU 14 1HD1 LEU 14 -10.810 -1.145 8.701
116 2HD1 LEU 14 2HD1 LEU 14 -9.208 -0.671 9.267
117 3HD1 LEU 14 3HD1 LEU 14 -10.216 -1.727 10.257
118 1HD2 LEU 14 1HD2 LEU 14 -10.549 -4.147 7.583
119 2HD2 LEU 14 2HD2 LEU 14 -11.204 -3.561 9.111
120 3HD2 LEU 14 3HD2 LEU 14 -9.848 -4.688 9.108
121 H GLY 15 H GLY 15 -5.988 -2.775 5.992
122 1HA GLY 15 2HA GLY 15 -3.704 -2.372 7.193
123 2HA GLY 15 1HA GLY 15 -4.587 -3.024 8.564
124 H PHE 16 H PHE 16 -4.519 -3.963 5.130
125 HA PHE 16 HA PHE 16 -3.828 -6.674 6.035
126 1HB PHE 16 2HB PHE 16 -5.359 -5.715 3.621
127 2HB PHE 16 1HB PHE 16 -4.714 -7.347 3.731
128 HD1 PHE 16 1HD PHE 16 -6.568 -5.076 6.063
129 HD2 PHE 16 2HD PHE 16 -6.324 -8.893 4.197
130 HE1 PHE 16 1HE PHE 16 -8.583 -5.794 7.277
131 HE2 PHE 16 2HE PHE 16 -8.340 -9.617 5.407
132 HZ PHE 16 HZ PHE 16 -9.472 -8.066 6.950
133 H VAL 17 H VAL 17 -2.003 -7.591 5.392
134 HA VAL 17 HA VAL 17 0.060 -7.884 4.493
135 HB VAL 17 HB VAL 17 -0.771 -6.343 2.045
136 1HG1 VAL 17 1HG1 VAL 17 1.386 -8.100 2.742
137 2HG1 VAL 17 2HG1 VAL 17 1.127 -7.197 1.248
138 3HG1 VAL 17 3HG1 VAL 17 0.443 -8.811 1.432
139 1HG2 VAL 17 1HG2 VAL 17 -2.541 -7.657 1.732
140 2HG2 VAL 17 2HG2 VAL 17 -2.156 -8.600 3.172
141 3HG2 VAL 17 3HG2 VAL 17 -1.439 -9.030 1.619
142 H TYR 18 H TYR 18 1.593 -6.164 2.836
143 HA TYR 18 HA TYR 18 1.699 -3.534 3.944
144 1HB TYR 18 2HB TYR 18 3.853 -3.829 5.146
145 2HB TYR 18 1HB TYR 18 2.556 -4.765 5.882
146 HD1 TYR 18 1HD TYR 18 5.708 -4.935 4.020
147 HD2 TYR 18 2HD TYR 18 2.554 -7.205 5.756
148 HE1 TYR 18 1HE TYR 18 7.059 -6.975 3.792
149 HE2 TYR 18 2HE TYR 18 3.901 -9.250 5.537
150 HH TYR 18 HH TYR 18 6.871 -9.493 5.286
151 H CYS 19 H CYS 19 3.304 -2.237 2.939
152 HA CYS 19 HA CYS 19 4.082 -3.122 0.326
153 1HB CYS 19 2HB CYS 19 4.259 -0.638 1.898
154 2HB CYS 19 1HB CYS 19 5.435 -0.813 0.602
155 H CYS 20 H CYS 20 6.417 -2.662 -0.399
156 HA CYS 20 HA CYS 20 8.122 -4.423 1.015
157 1HB CYS 20 2HB CYS 20 9.063 -2.399 -1.001
158 2HB CYS 20 1HB CYS 20 9.726 -3.990 -0.668
159 HA PRO 21 HA PRO 21 9.966 -1.917 4.104
160 1HB PRO 21 2HB PRO 21 12.615 -2.730 3.020
161 2HB PRO 21 1HB PRO 21 11.986 -2.796 4.672
162 1HG PRO 21 2HG PRO 21 12.158 -5.014 3.194
163 2HG PRO 21 1HG PRO 21 10.776 -4.743 4.274
164 1HD PRO 21 2HD PRO 21 10.941 -4.480 1.302
165 2HD PRO 21 1HD PRO 21 9.596 -5.051 2.308
166 H GLY 22 H GLY 22 9.841 0.131 3.879
167 1HA GLY 22 2HA GLY 22 11.161 2.172 3.497
168 2HA GLY 22 1HA GLY 22 11.565 1.506 1.922
169 H LEU 23 H LEU 23 8.676 0.502 1.748
170 HA LEU 23 HA LEU 23 7.499 3.090 0.972
171 1HB LEU 23 2HB LEU 23 6.997 0.376 -0.253
172 2HB LEU 23 1HB LEU 23 6.370 1.911 -0.821
173 HG LEU 23 HG LEU 23 9.301 1.186 -0.790
174 1HD1 LEU 23 1HD1 LEU 23 7.335 0.164 -2.460
175 2HD1 LEU 23 2HD1 LEU 23 9.075 0.171 -2.754
176 3HD1 LEU 23 3HD1 LEU 23 8.068 1.472 -3.389
177 1HD2 LEU 23 1HD2 LEU 23 9.728 3.197 -1.795
178 2HD2 LEU 23 2HD2 LEU 23 8.378 3.652 -0.755
179 3HD2 LEU 23 3HD2 LEU 23 8.103 3.333 -2.467
180 H ILE 24 H ILE 24 5.213 3.320 1.230
181 HA ILE 24 HA ILE 24 3.856 1.279 2.847
182 HB ILE 24 HB ILE 24 2.922 3.119 4.323
183 1HG1 ILE 24 2HG1 ILE 24 5.334 4.624 3.285
184 2HG1 ILE 24 1HG1 ILE 24 3.659 5.016 2.914
185 1HG2 ILE 24 1HG2 ILE 24 4.274 2.164 5.792
186 2HG2 ILE 24 2HG2 ILE 24 5.583 3.223 5.268
187 3HG2 ILE 24 3HG2 ILE 24 5.355 1.655 4.495
188 1HD1 ILE 24 1HD1 ILE 24 4.913 6.327 4.757
189 2HD1 ILE 24 2HD1 ILE 24 4.571 4.911 5.752
190 3HD1 ILE 24 3HD1 ILE 24 3.246 5.824 5.031
191 H CYS 25 H CYS 25 1.717 1.060 2.377
192 HA CYS 25 HA CYS 25 0.665 2.363 0.085
193 1HB CYS 25 2HB CYS 25 -0.485 0.481 2.116
194 2HB CYS 25 1HB CYS 25 -1.551 1.282 0.970
195 H GLY 26 H GLY 26 -0.676 4.060 -0.145
196 1HA GLY 26 2HA GLY 26 -1.760 5.325 2.283
197 2HA GLY 26 1HA GLY 26 -0.839 6.277 1.126
198 HA PRO 27 HA PRO 27 -4.796 7.128 -0.714
199 1HB PRO 27 2HB PRO 27 -3.931 8.419 -2.931
200 2HB PRO 27 1HB PRO 27 -3.889 9.151 -1.323
201 1HG PRO 27 2HG PRO 27 -1.684 7.851 -2.870
202 2HG PRO 27 1HG PRO 27 -1.648 9.337 -1.904
203 1HD PRO 27 2HD PRO 27 -0.715 6.949 -0.994
204 2HD PRO 27 1HD PRO 27 -1.395 8.193 0.072
205 H PHE 28 H PHE 28 -4.456 4.589 -0.994
206 HA PHE 28 HA PHE 28 -4.972 2.762 -2.207
207 1HB PHE 28 2HB PHE 28 -5.928 4.839 -4.197
208 2HB PHE 28 1HB PHE 28 -6.074 3.109 -4.491
209 HD1 PHE 28 1HD PHE 28 -8.197 2.355 -4.192
210 HD2 PHE 28 2HD PHE 28 -6.713 5.344 -1.551
211 HE1 PHE 28 1HE PHE 28 -10.324 2.317 -2.958
212 HE2 PHE 28 2HE PHE 28 -8.837 5.307 -0.310
213 HZ PHE 28 HZ PHE 28 -10.646 3.793 -1.013
214 H VAL 29 H VAL 29 -2.358 4.275 -2.462
215 HA VAL 29 HA VAL 29 -1.169 2.458 -4.384
216 HB VAL 29 HB VAL 29 0.242 4.255 -5.425
217 1HG1 VAL 29 1HG1 VAL 29 -2.626 3.872 -5.940
218 2HG1 VAL 29 2HG1 VAL 29 -1.242 3.727 -7.023
219 3HG1 VAL 29 3HG1 VAL 29 -1.919 5.316 -6.665
220 1HG2 VAL 29 1HG2 VAL 29 -0.943 6.585 -5.357
221 2HG2 VAL 29 2HG2 VAL 29 0.168 6.116 -4.070
222 3HG2 VAL 29 3HG2 VAL 29 -1.573 6.001 -3.817
223 H CYS 30 H CYS 30 1.230 2.466 -4.040
224 HA CYS 30 HA CYS 30 1.761 2.919 -1.218
225 1HB CYS 30 2HB CYS 30 2.366 0.797 -2.600
226 2HB CYS 30 1HB CYS 30 3.702 1.765 -3.203
227 H VAL 31 H VAL 31 3.580 4.159 -0.473
228 HA VAL 31 HA VAL 31 4.797 5.931 -2.467
229 HB VAL 31 HB VAL 31 4.521 7.884 -0.935
230 1HG1 VAL 31 1HG1 VAL 31 2.846 8.424 -2.281
231 2HG1 VAL 31 2HG1 VAL 31 1.736 7.473 -1.293
232 3HG1 VAL 31 3HG1 VAL 31 2.581 6.719 -2.646
233 1HG2 VAL 31 1HG2 VAL 31 2.673 6.023 0.553
234 2HG2 VAL 31 2HG2 VAL 31 2.740 7.769 0.792
235 3HG2 VAL 31 3HG2 VAL 31 4.148 6.772 1.163
Start of MODEL 17
1 1H ALA 1 1HT ALA 1 4.243 -10.639 1.385
2 2H ALA 1 2HT ALA 1 3.700 -11.869 0.352
3 3H ALA 1 3HT ALA 1 2.760 -10.482 0.582
4 HA ALA 1 HA ALA 1 5.459 -10.450 -0.621
5 1HB ALA 1 1HB ALA 1 3.151 -11.487 -1.779
6 2HB ALA 1 2HB ALA 1 4.620 -10.987 -2.616
7 3HB ALA 1 3HB ALA 1 3.281 -9.854 -2.431
8 H CYS 2 H CYS 2 6.145 -8.415 -1.196
9 HA CYS 2 HA CYS 2 4.634 -6.202 -0.034
10 1HB CYS 2 2HB CYS 2 6.659 -4.958 -0.141
11 2HB CYS 2 1HB CYS 2 7.048 -6.548 0.492
12 H SER 3 H SER 3 3.778 -4.564 -1.164
13 HA SER 3 HA SER 3 3.461 -4.960 -4.011
14 1HB SER 3 2HB SER 3 2.239 -2.857 -2.216
15 2HB SER 3 1HB SER 3 1.717 -3.283 -3.847
16 HG SER 3 HG SER 3 0.937 -4.358 -1.569
17 H LYS 4 H LYS 4 3.889 -3.462 -5.601
18 HA LYS 4 HA LYS 4 6.280 -1.948 -5.320
19 1HB LYS 4 2HB LYS 4 5.320 -3.141 -7.397
20 2HB LYS 4 1HB LYS 4 4.299 -1.727 -7.584
21 1HG LYS 4 2HG LYS 4 7.205 -1.245 -7.320
22 2HG LYS 4 1HG LYS 4 6.650 -2.015 -8.805
23 1HD LYS 4 2HD LYS 4 5.772 0.646 -7.688
24 2HD LYS 4 1HD LYS 4 6.725 0.363 -9.144
25 1HE LYS 4 2HE LYS 4 3.829 -0.322 -8.675
26 2HE LYS 4 1HE LYS 4 4.483 0.855 -9.809
27 1HZ LYS 4 1HZ LYS 4 4.205 -2.022 -10.060
28 2HZ LYS 4 2HZ LYS 4 5.679 -1.398 -10.628
29 3HZ LYS 4 3HZ LYS 4 4.219 -0.821 -11.255
30 H LYS 5 H LYS 5 6.534 0.316 -5.305
31 HA LYS 5 HA LYS 5 4.842 1.773 -3.745
32 1HB LYS 5 2HB LYS 5 7.046 2.579 -4.064
33 2HB LYS 5 1HB LYS 5 6.819 2.724 -5.801
34 1HG LYS 5 2HG LYS 5 5.575 4.664 -5.609
35 2HG LYS 5 1HG LYS 5 5.116 4.325 -3.955
36 1HD LYS 5 2HD LYS 5 7.326 4.856 -3.172
37 2HD LYS 5 1HD LYS 5 7.910 5.021 -4.832
38 1HE LYS 5 2HE LYS 5 6.837 7.029 -5.155
39 2HE LYS 5 1HE LYS 5 5.609 6.697 -3.938
40 1HZ LYS 5 1HZ LYS 5 7.196 8.409 -3.235
41 2HZ LYS 5 2HZ LYS 5 8.460 7.296 -3.350
42 3HZ LYS 5 3HZ LYS 5 7.231 7.062 -2.205
43 H TRP 6 H TRP 6 5.072 2.504 -7.207
44 HA TRP 6 HA TRP 6 2.547 3.854 -7.036
45 1HB TRP 6 2HB TRP 6 4.073 3.285 -9.576
46 2HB TRP 6 1HB TRP 6 2.951 4.601 -9.247
47 HD1 TRP 6 HD TRP 6 6.548 3.488 -8.459
48 HE1 TRP 6 1HE TRP 6 7.921 5.557 -7.798
49 HE3 TRP 6 3HE TRP 6 2.779 6.926 -8.236
50 HZ2 TRP 6 2HZ TRP 6 7.464 8.283 -7.236
51 HZ3 TRP 6 3HZ TRP 6 3.327 9.242 -7.622
52 HH2 TRP 6 HH TRP 6 5.624 9.904 -7.126
53 H GLU 7 H GLU 7 2.524 1.030 -6.446
54 HA GLU 7 HA GLU 7 1.213 -0.167 -8.779
55 1HB GLU 7 2HB GLU 7 2.699 -1.294 -6.826
56 2HB GLU 7 1HB GLU 7 1.093 -1.549 -6.160
57 1HG GLU 7 2HG GLU 7 1.760 -3.483 -7.418
58 2HG GLU 7 1HG GLU 7 0.431 -2.674 -8.250
59 H TYR 8 H TYR 8 -0.304 -1.365 -6.107
60 HA TYR 8 HA TYR 8 -2.367 0.654 -5.883
61 1HB TYR 8 2HB TYR 8 -2.985 -0.705 -7.902
62 2HB TYR 8 1HB TYR 8 -3.037 -2.133 -6.877
63 HD1 TYR 8 1HD TYR 8 -4.411 1.347 -6.647
64 HD2 TYR 8 2HD TYR 8 -5.182 -2.830 -6.443
65 HE1 TYR 8 1HE TYR 8 -6.767 1.815 -6.133
66 HE2 TYR 8 2HE TYR 8 -7.543 -2.373 -5.926
67 HH TYR 8 HH TYR 8 -8.797 -0.233 -4.794
68 H CYS 9 H CYS 9 -3.327 0.562 -3.906
69 HA CYS 9 HA CYS 9 -2.618 -1.746 -2.216
70 1HB CYS 9 2HB CYS 9 -2.786 1.178 -1.497
71 2HB CYS 9 1HB CYS 9 -2.695 -0.106 -0.297
72 H ILE 10 H ILE 10 -4.055 -1.535 -0.082
73 HA ILE 10 HA ILE 10 -6.075 -1.819 0.893
74 HB ILE 10 HB ILE 10 -7.292 -0.179 -1.342
75 1HG1 ILE 10 2HG1 ILE 10 -6.100 0.762 1.281
76 2HG1 ILE 10 1HG1 ILE 10 -5.395 1.026 -0.309
77 1HG2 ILE 10 1HG2 ILE 10 -8.311 -0.006 1.416
78 2HG2 ILE 10 2HG2 ILE 10 -8.549 -1.563 0.624
79 3HG2 ILE 10 3HG2 ILE 10 -9.186 -0.094 -0.114
80 1HD1 ILE 10 1HD1 ILE 10 -8.028 2.116 0.656
81 2HD1 ILE 10 2HD1 ILE 10 -7.318 2.386 -0.937
82 3HD1 ILE 10 3HD1 ILE 10 -6.518 3.015 0.504
83 H VAL 11 H VAL 11 -5.163 -3.852 -0.444
84 HA VAL 11 HA VAL 11 -7.524 -5.059 -1.711
85 HB VAL 11 HB VAL 11 -4.671 -5.624 -2.567
86 1HG1 VAL 11 1HG1 VAL 11 -6.447 -7.373 -2.938
87 2HG1 VAL 11 2HG1 VAL 11 -5.590 -6.831 -4.381
88 3HG1 VAL 11 3HG1 VAL 11 -7.217 -6.237 -4.046
89 1HG2 VAL 11 1HG2 VAL 11 -5.730 -3.249 -3.050
90 2HG2 VAL 11 2HG2 VAL 11 -6.512 -4.137 -4.359
91 3HG2 VAL 11 3HG2 VAL 11 -4.752 -4.093 -4.250
92 HA PRO 12 HA PRO 12 -7.244 -8.132 1.473
93 1HB PRO 12 2HB PRO 12 -7.572 -10.378 -0.218
94 2HB PRO 12 1HB PRO 12 -8.829 -9.523 0.679
95 1HG PRO 12 2HG PRO 12 -8.021 -9.256 -2.167
96 2HG PRO 12 1HG PRO 12 -9.619 -9.062 -1.426
97 1HD PRO 12 2HD PRO 12 -8.206 -6.942 -2.230
98 2HD PRO 12 1HD PRO 12 -9.168 -6.886 -0.736
99 H ILE 13 H ILE 13 -5.917 -9.730 2.307
100 HA ILE 13 HA ILE 13 -3.226 -9.609 1.923
101 HB ILE 13 HB ILE 13 -4.645 -12.102 2.864
102 1HG1 ILE 13 2HG1 ILE 13 -5.584 -10.136 3.992
103 2HG1 ILE 13 1HG1 ILE 13 -4.624 -11.100 5.107
104 1HG2 ILE 13 1HG2 ILE 13 -2.005 -11.779 2.513
105 2HG2 ILE 13 2HG2 ILE 13 -2.697 -12.779 3.790
106 3HG2 ILE 13 3HG2 ILE 13 -2.167 -11.134 4.147
107 1HD1 ILE 13 1HD1 ILE 13 -3.644 -9.194 5.679
108 2HD1 ILE 13 2HD1 ILE 13 -4.309 -8.343 4.286
109 3HD1 ILE 13 3HD1 ILE 13 -2.817 -9.268 4.123
110 H LEU 14 H LEU 14 -5.442 -11.429 -0.002
111 HA LEU 14 HA LEU 14 -3.822 -13.442 -1.031
112 1HB LEU 14 2HB LEU 14 -6.004 -11.909 -2.445
113 2HB LEU 14 1HB LEU 14 -5.357 -13.461 -2.944
114 HG LEU 14 HG LEU 14 -6.854 -12.942 -0.371
115 1HD1 LEU 14 1HD1 LEU 14 -8.624 -12.975 -1.746
116 2HD1 LEU 14 2HD1 LEU 14 -8.332 -14.713 -1.802
117 3HD1 LEU 14 3HD1 LEU 14 -7.704 -13.672 -3.080
118 1HD2 LEU 14 1HD2 LEU 14 -5.020 -14.864 -0.720
119 2HD2 LEU 14 2HD2 LEU 14 -6.423 -15.673 -1.416
120 3HD2 LEU 14 3HD2 LEU 14 -6.479 -15.088 0.246
121 H GLY 15 H GLY 15 -3.944 -10.017 -1.834
122 1HA GLY 15 2HA GLY 15 -1.425 -10.121 -3.140
123 2HA GLY 15 1HA GLY 15 -2.717 -10.033 -4.328
124 H PHE 16 H PHE 16 -0.637 -8.087 -3.747
125 HA PHE 16 HA PHE 16 -0.356 -5.845 -3.609
126 1HB PHE 16 2HB PHE 16 -3.358 -5.869 -3.968
127 2HB PHE 16 1HB PHE 16 -2.405 -4.392 -3.918
128 HD1 PHE 16 1HD PHE 16 -2.036 -3.457 -5.962
129 HD2 PHE 16 2HD PHE 16 -2.161 -7.700 -5.663
130 HE1 PHE 16 1HE PHE 16 -1.625 -3.636 -8.380
131 HE2 PHE 16 2HE PHE 16 -1.746 -7.887 -8.080
132 HZ PHE 16 HZ PHE 16 -1.478 -5.853 -9.443
133 H VAL 17 H VAL 17 -0.154 -7.095 -1.311
134 HA VAL 17 HA VAL 17 -1.744 -5.789 0.744
135 HB VAL 17 HB VAL 17 0.559 -7.525 1.443
136 1HG1 VAL 17 1HG1 VAL 17 -1.669 -6.469 2.758
137 2HG1 VAL 17 2HG1 VAL 17 -0.502 -7.630 3.392
138 3HG1 VAL 17 3HG1 VAL 17 -1.982 -8.199 2.619
139 1HG2 VAL 17 1HG2 VAL 17 -1.665 -9.234 0.999
140 2HG2 VAL 17 2HG2 VAL 17 -0.059 -9.305 0.276
141 3HG2 VAL 17 3HG2 VAL 17 -1.332 -8.360 -0.495
142 H TYR 18 H TYR 18 0.618 -6.105 2.498
143 HA TYR 18 HA TYR 18 1.434 -3.490 2.790
144 1HB TYR 18 2HB TYR 18 3.255 -4.398 4.210
145 2HB TYR 18 1HB TYR 18 1.697 -5.141 4.558
146 HD1 TYR 18 1HD TYR 18 1.324 -7.482 4.151
147 HD2 TYR 18 2HD TYR 18 5.014 -5.681 3.039
148 HE1 TYR 18 1HE TYR 18 2.302 -9.710 3.804
149 HE2 TYR 18 2HE TYR 18 6.001 -7.904 2.688
150 HH TYR 18 HH TYR 18 5.241 -10.461 3.805
151 H CYS 19 H CYS 19 3.183 -2.287 2.167
152 HA CYS 19 HA CYS 19 4.372 -2.905 -0.358
153 1HB CYS 19 2HB CYS 19 4.826 -0.728 1.647
154 2HB CYS 19 1HB CYS 19 5.602 -0.750 0.069
155 H CYS 20 H CYS 20 6.763 -2.555 -0.670
156 HA CYS 20 HA CYS 20 8.228 -4.465 0.875
157 1HB CYS 20 2HB CYS 20 9.368 -2.437 -1.049
158 2HB CYS 20 1HB CYS 20 10.069 -3.978 -0.582
159 HA PRO 21 HA PRO 21 9.814 -2.015 4.153
160 1HB PRO 21 2HB PRO 21 12.551 -2.805 3.303
161 2HB PRO 21 1HB PRO 21 11.772 -2.906 4.887
162 1HG PRO 21 2HG PRO 21 12.093 -5.092 3.381
163 2HG PRO 21 1HG PRO 21 10.626 -4.854 4.347
164 1HD PRO 21 2HD PRO 21 11.031 -4.536 1.405
165 2HD PRO 21 1HD PRO 21 9.609 -5.122 2.287
166 H GLY 22 H GLY 22 9.701 0.037 3.933
167 1HA GLY 22 2HA GLY 22 11.128 2.057 3.668
168 2HA GLY 22 1HA GLY 22 11.523 1.425 2.076
169 H LEU 23 H LEU 23 8.771 0.501 1.576
170 HA LEU 23 HA LEU 23 7.616 3.119 0.925
171 1HB LEU 23 2HB LEU 23 6.996 0.404 -0.245
172 2HB LEU 23 1HB LEU 23 6.422 1.951 -0.837
173 HG LEU 23 HG LEU 23 9.323 1.120 -0.813
174 1HD1 LEU 23 1HD1 LEU 23 7.489 1.250 -3.192
175 2HD1 LEU 23 2HD1 LEU 23 7.820 -0.240 -2.310
176 3HD1 LEU 23 3HD1 LEU 23 9.133 0.619 -3.116
177 1HD2 LEU 23 1HD2 LEU 23 9.728 3.051 -2.126
178 2HD2 LEU 23 2HD2 LEU 23 8.768 3.577 -0.742
179 3HD2 LEU 23 3HD2 LEU 23 8.004 3.367 -2.318
180 H ILE 24 H ILE 24 5.372 3.490 1.280
181 HA ILE 24 HA ILE 24 4.016 1.519 2.996
182 HB ILE 24 HB ILE 24 3.126 3.434 4.384
183 1HG1 ILE 24 2HG1 ILE 24 5.479 4.900 3.166
184 2HG1 ILE 24 1HG1 ILE 24 3.786 5.246 2.829
185 1HG2 ILE 24 1HG2 ILE 24 4.540 2.351 5.731
186 2HG2 ILE 24 2HG2 ILE 24 5.648 3.684 5.410
187 3HG2 ILE 24 3HG2 ILE 24 5.767 2.194 4.474
188 1HD1 ILE 24 1HD1 ILE 24 3.616 6.525 4.628
189 2HD1 ILE 24 2HD1 ILE 24 5.368 6.395 4.788
190 3HD1 ILE 24 3HD1 ILE 24 4.317 5.281 5.663
191 H CYS 25 H CYS 25 1.916 1.222 2.559
192 HA CYS 25 HA CYS 25 0.753 2.303 0.234
193 1HB CYS 25 2HB CYS 25 -0.305 0.677 2.521
194 2HB CYS 25 1HB CYS 25 -1.406 1.311 1.304
195 H GLY 26 H GLY 26 -0.697 3.907 -0.127
196 1HA GLY 26 2HA GLY 26 -1.691 5.440 2.175
197 2HA GLY 26 1HA GLY 26 -0.807 6.270 0.903
198 HA PRO 27 HA PRO 27 -4.933 6.987 -0.701
199 1HB PRO 27 2HB PRO 27 -4.163 8.390 -2.899
200 2HB PRO 27 1HB PRO 27 -4.210 9.080 -1.273
201 1HG PRO 27 2HG PRO 27 -1.876 7.997 -2.805
202 2HG PRO 27 1HG PRO 27 -1.984 9.471 -1.825
203 1HD PRO 27 2HD PRO 27 -0.847 7.207 -0.896
204 2HD PRO 27 1HD PRO 27 -1.736 8.321 0.161
205 H PHE 28 H PHE 28 -4.608 4.504 -1.089
206 HA PHE 28 HA PHE 28 -5.098 2.721 -2.377
207 1HB PHE 28 2HB PHE 28 -5.867 4.818 -4.440
208 2HB PHE 28 1HB PHE 28 -6.081 3.088 -4.682
209 HD1 PHE 28 1HD PHE 28 -8.133 2.213 -4.237
210 HD2 PHE 28 2HD PHE 28 -6.897 5.696 -2.125
211 HE1 PHE 28 1HE PHE 28 -10.336 2.332 -3.147
212 HE2 PHE 28 2HE PHE 28 -9.094 5.816 -1.029
213 HZ PHE 28 HZ PHE 28 -10.818 4.134 -1.539
214 H VAL 29 H VAL 29 -2.455 4.332 -2.530
215 HA VAL 29 HA VAL 29 -1.172 2.477 -4.355
216 HB VAL 29 HB VAL 29 0.222 4.255 -5.432
217 1HG1 VAL 29 1HG1 VAL 29 -1.474 5.039 -7.048
218 2HG1 VAL 29 2HG1 VAL 29 -2.741 4.439 -5.978
219 3HG1 VAL 29 3HG1 VAL 29 -1.596 3.313 -6.707
220 1HG2 VAL 29 1HG2 VAL 29 -0.582 6.580 -5.416
221 2HG2 VAL 29 2HG2 VAL 29 -0.096 6.035 -3.811
222 3HG2 VAL 29 3HG2 VAL 29 -1.807 6.142 -4.225
223 H CYS 30 H CYS 30 1.203 2.563 -4.005
224 HA CYS 30 HA CYS 30 1.722 3.074 -1.192
225 1HB CYS 30 2HB CYS 30 2.361 0.931 -2.481
226 2HB CYS 30 1HB CYS 30 3.640 1.901 -3.192
227 H VAL 31 H VAL 31 3.553 4.319 -0.482
228 HA VAL 31 HA VAL 31 4.737 6.074 -2.507
229 HB VAL 31 HB VAL 31 4.495 8.035 -0.984
230 1HG1 VAL 31 1HG1 VAL 31 2.938 8.331 -2.584
231 2HG1 VAL 31 2HG1 VAL 31 1.813 8.009 -1.264
232 3HG1 VAL 31 3HG1 VAL 31 2.262 6.716 -2.374
233 1HG2 VAL 31 1HG2 VAL 31 2.233 6.965 0.500
234 2HG2 VAL 31 2HG2 VAL 31 3.602 7.925 1.059
235 3HG2 VAL 31 3HG2 VAL 31 3.756 6.175 0.908
Start of MODEL 18
1 1H ALA 1 1HT ALA 1 6.139 -11.440 0.731
2 2H ALA 1 2HT ALA 1 4.472 -11.666 0.886
3 3H ALA 1 3HT ALA 1 5.206 -10.303 1.570
4 HA ALA 1 HA ALA 1 5.855 -10.357 -1.148
5 1HB ALA 1 1HB ALA 1 3.865 -10.554 -2.283
6 2HB ALA 1 2HB ALA 1 2.891 -10.192 -0.858
7 3HB ALA 1 3HB ALA 1 3.646 -11.777 -1.030
8 H CYS 2 H CYS 2 6.021 -8.239 -1.757
9 HA CYS 2 HA CYS 2 4.797 -6.250 0.050
10 1HB CYS 2 2HB CYS 2 6.758 -4.897 -0.150
11 2HB CYS 2 1HB CYS 2 7.247 -6.505 0.353
12 H SER 3 H SER 3 3.780 -4.579 -0.821
13 HA SER 3 HA SER 3 3.042 -4.713 -3.579
14 1HB SER 3 2HB SER 3 1.451 -4.036 -1.812
15 2HB SER 3 1HB SER 3 2.421 -2.599 -1.498
16 HG SER 3 HG SER 3 1.909 -1.830 -3.530
17 H LYS 4 H LYS 4 3.584 -3.374 -5.236
18 HA LYS 4 HA LYS 4 6.102 -2.050 -5.145
19 1HB LYS 4 2HB LYS 4 3.922 -2.029 -7.247
20 2HB LYS 4 1HB LYS 4 5.487 -1.266 -7.456
21 1HG LYS 4 2HG LYS 4 5.543 -3.343 -8.595
22 2HG LYS 4 1HG LYS 4 6.535 -3.516 -7.149
23 1HD LYS 4 2HD LYS 4 5.129 -5.026 -6.203
24 2HD LYS 4 1HD LYS 4 3.688 -4.272 -6.888
25 1HE LYS 4 2HE LYS 4 5.673 -5.889 -8.481
26 2HE LYS 4 1HE LYS 4 4.194 -6.550 -7.783
27 1HZ LYS 4 1HZ LYS 4 3.290 -5.972 -9.732
28 2HZ LYS 4 2HZ LYS 4 4.540 -4.909 -10.131
29 3HZ LYS 4 3HZ LYS 4 3.280 -4.390 -9.121
30 H LYS 5 H LYS 5 6.495 0.232 -5.371
31 HA LYS 5 HA LYS 5 4.977 1.821 -3.706
32 1HB LYS 5 2HB LYS 5 7.198 2.528 -4.152
33 2HB LYS 5 1HB LYS 5 6.898 2.611 -5.885
34 1HG LYS 5 2HG LYS 5 5.724 4.592 -5.722
35 2HG LYS 5 1HG LYS 5 5.304 4.319 -4.049
36 1HD LYS 5 2HD LYS 5 7.582 4.789 -3.367
37 2HD LYS 5 1HD LYS 5 8.059 4.982 -5.057
38 1HE LYS 5 2HE LYS 5 7.027 7.005 -5.267
39 2HE LYS 5 1HE LYS 5 5.789 6.622 -4.071
40 1HZ LYS 5 1HZ LYS 5 8.630 7.246 -3.456
41 2HZ LYS 5 2HZ LYS 5 7.421 6.910 -2.316
42 3HZ LYS 5 3HZ LYS 5 7.331 8.311 -3.267
43 H TRP 6 H TRP 6 5.082 2.314 -7.226
44 HA TRP 6 HA TRP 6 2.654 3.834 -7.012
45 1HB TRP 6 2HB TRP 6 4.005 2.990 -9.576
46 2HB TRP 6 1HB TRP 6 2.975 4.392 -9.293
47 HD1 TRP 6 HD TRP 6 6.530 3.113 -8.572
48 HE1 TRP 6 1HE TRP 6 8.053 5.123 -8.092
49 HE3 TRP 6 3HE TRP 6 2.992 6.789 -8.406
50 HZ2 TRP 6 2HZ TRP 6 7.788 7.899 -7.673
51 HZ3 TRP 6 3HZ TRP 6 3.705 9.095 -7.950
52 HH2 TRP 6 HH TRP 6 6.056 9.637 -7.584
53 H GLU 7 H GLU 7 2.641 0.981 -6.286
54 HA GLU 7 HA GLU 7 0.963 -0.249 -8.333
55 1HB GLU 7 2HB GLU 7 2.604 -1.512 -6.812
56 2HB GLU 7 1HB GLU 7 1.428 -1.268 -5.530
57 1HG GLU 7 2HG GLU 7 1.059 -3.428 -6.384
58 2HG GLU 7 1HG GLU 7 -0.253 -2.420 -6.997
59 H TYR 8 H TYR 8 -1.235 -0.337 -8.249
60 HA TYR 8 HA TYR 8 -2.579 1.506 -6.511
61 1HB TYR 8 2HB TYR 8 -3.146 0.841 -8.968
62 2HB TYR 8 1HB TYR 8 -3.959 -0.542 -8.247
63 HD1 TYR 8 1HD TYR 8 -3.804 3.153 -7.659
64 HD2 TYR 8 2HD TYR 8 -6.237 -0.317 -8.024
65 HE1 TYR 8 1HE TYR 8 -5.810 4.531 -7.316
66 HE2 TYR 8 2HE TYR 8 -8.249 1.052 -7.680
67 HH TYR 8 HH TYR 8 -8.018 4.559 -7.153
68 H CYS 9 H CYS 9 -1.916 0.494 -4.493
69 HA CYS 9 HA CYS 9 -2.819 -2.105 -3.785
70 1HB CYS 9 2HB CYS 9 -2.178 -1.377 -1.441
71 2HB CYS 9 1HB CYS 9 -0.899 -1.342 -2.647
72 H ILE 10 H ILE 10 -5.076 -1.370 -4.670
73 HA ILE 10 HA ILE 10 -6.749 -0.090 -2.667
74 HB ILE 10 HB ILE 10 -7.142 0.295 -5.083
75 1HG1 ILE 10 2HG1 ILE 10 -9.447 -1.114 -3.716
76 2HG1 ILE 10 1HG1 ILE 10 -8.989 0.567 -3.471
77 1HG2 ILE 10 1HG2 ILE 10 -7.861 -2.629 -5.139
78 2HG2 ILE 10 2HG2 ILE 10 -6.538 -1.837 -5.997
79 3HG2 ILE 10 3HG2 ILE 10 -8.210 -1.484 -6.435
80 1HD1 ILE 10 1HD1 ILE 10 -9.451 -0.136 -6.267
81 2HD1 ILE 10 2HD1 ILE 10 -10.035 1.236 -5.324
82 3HD1 ILE 10 3HD1 ILE 10 -10.865 -0.316 -5.229
83 H VAL 11 H VAL 11 -5.430 -2.273 -1.706
84 HA VAL 11 HA VAL 11 -7.093 -4.617 -1.748
85 HB VAL 11 HB VAL 11 -5.401 -5.225 0.198
86 1HG1 VAL 11 1HG1 VAL 11 -4.862 -6.606 -1.468
87 2HG1 VAL 11 2HG1 VAL 11 -3.734 -5.377 -2.040
88 3HG1 VAL 11 3HG1 VAL 11 -5.376 -5.434 -2.680
89 1HG2 VAL 11 1HG2 VAL 11 -3.836 -3.706 0.629
90 2HG2 VAL 11 2HG2 VAL 11 -4.545 -2.620 -0.567
91 3HG2 VAL 11 3HG2 VAL 11 -3.304 -3.778 -1.052
92 HA PRO 12 HA PRO 12 -9.752 -3.486 1.597
93 1HB PRO 12 2HB PRO 12 -10.575 -5.993 2.287
94 2HB PRO 12 1HB PRO 12 -11.185 -5.126 0.873
95 1HG PRO 12 2HG PRO 12 -9.076 -7.242 1.034
96 2HG PRO 12 1HG PRO 12 -10.375 -7.045 -0.156
97 1HD PRO 12 2HD PRO 12 -7.829 -6.304 -0.666
98 2HD PRO 12 1HD PRO 12 -9.222 -5.429 -1.336
99 H ILE 13 H ILE 13 -9.783 -3.484 3.842
100 HA ILE 13 HA ILE 13 -7.390 -3.737 5.199
101 HB ILE 13 HB ILE 13 -8.626 -3.509 7.291
102 1HG1 ILE 13 2HG1 ILE 13 -10.569 -4.995 6.542
103 2HG1 ILE 13 1HG1 ILE 13 -10.981 -3.566 7.479
104 1HG2 ILE 13 1HG2 ILE 13 -9.758 -1.373 6.761
105 2HG2 ILE 13 2HG2 ILE 13 -9.589 -1.751 5.046
106 3HG2 ILE 13 3HG2 ILE 13 -8.153 -1.522 6.044
107 1HD1 ILE 13 1HD1 ILE 13 -11.218 -3.853 4.491
108 2HD1 ILE 13 2HD1 ILE 13 -11.629 -2.413 5.423
109 3HD1 ILE 13 3HD1 ILE 13 -12.541 -3.905 5.656
110 H LEU 14 H LEU 14 -9.692 -6.213 4.508
111 HA LEU 14 HA LEU 14 -9.133 -8.030 6.571
112 1HB LEU 14 2HB LEU 14 -10.035 -8.496 3.731
113 2HB LEU 14 1HB LEU 14 -9.905 -9.777 4.917
114 HG LEU 14 HG LEU 14 -12.177 -9.223 4.871
115 1HD1 LEU 14 1HD1 LEU 14 -11.451 -9.463 7.123
116 2HD1 LEU 14 2HD1 LEU 14 -12.613 -8.138 7.070
117 3HD1 LEU 14 3HD1 LEU 14 -10.886 -7.794 7.181
118 1HD2 LEU 14 1HD2 LEU 14 -12.975 -6.857 5.169
119 2HD2 LEU 14 2HD2 LEU 14 -12.196 -7.209 3.626
120 3HD2 LEU 14 3HD2 LEU 14 -11.312 -6.342 4.881
121 H GLY 15 H GLY 15 -7.396 -7.230 3.659
122 1HA GLY 15 2HA GLY 15 -5.078 -8.658 4.562
123 2HA GLY 15 1HA GLY 15 -5.836 -9.417 3.167
124 H PHE 16 H PHE 16 -4.998 -6.135 4.234
125 HA PHE 16 HA PHE 16 -4.567 -5.241 1.564
126 1HB PHE 16 2HB PHE 16 -3.676 -3.163 2.751
127 2HB PHE 16 1HB PHE 16 -5.361 -3.586 3.009
128 HD1 PHE 16 1HD PHE 16 -6.013 -2.973 5.105
129 HD2 PHE 16 2HD PHE 16 -2.170 -4.728 4.608
130 HE1 PHE 16 1HE PHE 16 -5.670 -2.901 7.539
131 HE2 PHE 16 2HE PHE 16 -1.821 -4.664 7.042
132 HZ PHE 16 HZ PHE 16 -3.573 -3.749 8.511
133 H VAL 17 H VAL 17 -2.713 -7.257 3.258
134 HA VAL 17 HA VAL 17 -0.519 -7.893 3.235
135 HB VAL 17 HB VAL 17 -0.083 -6.356 0.705
136 1HG1 VAL 17 1HG1 VAL 17 1.496 -8.089 2.005
137 2HG1 VAL 17 2HG1 VAL 17 1.508 -7.908 0.251
138 3HG1 VAL 17 3HG1 VAL 17 0.596 -9.222 0.995
139 1HG2 VAL 17 1HG2 VAL 17 -1.364 -7.768 -0.620
140 2HG2 VAL 17 2HG2 VAL 17 -2.410 -7.497 0.774
141 3HG2 VAL 17 3HG2 VAL 17 -1.495 -8.998 0.638
142 H TYR 18 H TYR 18 1.504 -6.205 1.808
143 HA TYR 18 HA TYR 18 1.719 -3.769 3.290
144 1HB TYR 18 2HB TYR 18 3.754 -4.402 4.564
145 2HB TYR 18 1HB TYR 18 2.338 -5.307 5.081
146 HD1 TYR 18 1HD TYR 18 5.572 -5.514 3.342
147 HD2 TYR 18 2HD TYR 18 2.190 -7.696 4.725
148 HE1 TYR 18 1HE TYR 18 6.784 -7.620 2.967
149 HE2 TYR 18 2HE TYR 18 3.395 -9.807 4.356
150 HH TYR 18 HH TYR 18 6.313 -10.272 4.217
151 H CYS 19 H CYS 19 3.349 -2.426 2.495
152 HA CYS 19 HA CYS 19 4.299 -3.058 -0.137
153 1HB CYS 19 2HB CYS 19 4.591 -0.756 1.731
154 2HB CYS 19 1HB CYS 19 5.539 -0.801 0.250
155 H CYS 20 H CYS 20 6.661 -2.524 -0.664
156 HA CYS 20 HA CYS 20 8.330 -4.362 0.722
157 1HB CYS 20 2HB CYS 20 9.231 -2.192 -1.169
158 2HB CYS 20 1HB CYS 20 10.045 -3.709 -0.817
159 HA PRO 21 HA PRO 21 9.968 -2.007 4.029
160 1HB PRO 21 2HB PRO 21 12.688 -2.643 3.010
161 2HB PRO 21 1HB PRO 21 11.994 -2.852 4.623
162 1HG PRO 21 2HG PRO 21 12.321 -4.949 2.998
163 2HG PRO 21 1HG PRO 21 10.891 -4.814 4.039
164 1HD PRO 21 2HD PRO 21 11.149 -4.332 1.102
165 2HD PRO 21 1HD PRO 21 9.794 -5.024 2.011
166 H GLY 22 H GLY 22 9.766 0.047 3.922
167 1HA GLY 22 2HA GLY 22 11.019 2.156 3.718
168 2HA GLY 22 1HA GLY 22 11.508 1.602 2.123
169 H LEU 23 H LEU 23 8.731 0.513 1.651
170 HA LEU 23 HA LEU 23 7.510 3.092 0.944
171 1HB LEU 23 2HB LEU 23 6.992 0.363 -0.240
172 2HB LEU 23 1HB LEU 23 6.402 1.899 -0.846
173 HG LEU 23 HG LEU 23 9.316 1.114 -0.758
174 1HD1 LEU 23 1HD1 LEU 23 7.357 0.114 -2.444
175 2HD1 LEU 23 2HD1 LEU 23 9.100 0.084 -2.714
176 3HD1 LEU 23 3HD1 LEU 23 8.126 1.397 -3.378
177 1HD2 LEU 23 1HD2 LEU 23 9.723 3.245 -1.218
178 2HD2 LEU 23 2HD2 LEU 23 7.998 3.608 -1.140
179 3HD2 LEU 23 3HD2 LEU 23 8.729 3.117 -2.669
180 H ILE 24 H ILE 24 5.267 3.391 1.254
181 HA ILE 24 HA ILE 24 3.888 1.352 2.864
182 HB ILE 24 HB ILE 24 2.920 3.190 4.295
183 1HG1 ILE 24 2HG1 ILE 24 5.297 4.739 3.237
184 2HG1 ILE 24 1HG1 ILE 24 3.613 5.083 2.860
185 1HG2 ILE 24 1HG2 ILE 24 5.254 3.417 5.561
186 2HG2 ILE 24 2HG2 ILE 24 5.678 2.130 4.433
187 3HG2 ILE 24 3HG2 ILE 24 4.322 1.920 5.540
188 1HD1 ILE 24 1HD1 ILE 24 3.829 6.563 4.530
189 2HD1 ILE 24 2HD1 ILE 24 5.180 5.699 5.265
190 3HD1 ILE 24 3HD1 ILE 24 3.525 5.156 5.549
191 H CYS 25 H CYS 25 1.828 1.025 2.273
192 HA CYS 25 HA CYS 25 0.772 2.345 -0.011
193 1HB CYS 25 2HB CYS 25 0.192 0.024 0.463
194 2HB CYS 25 1HB CYS 25 -0.586 0.501 1.966
195 H GLY 26 H GLY 26 -0.646 4.009 -0.212
196 1HA GLY 26 2HA GLY 26 -1.829 5.096 2.258
197 2HA GLY 26 1HA GLY 26 -0.901 6.140 1.195
198 HA PRO 27 HA PRO 27 -4.821 7.087 -0.659
199 1HB PRO 27 2HB PRO 27 -3.919 8.518 -2.777
200 2HB PRO 27 1HB PRO 27 -3.918 9.145 -1.125
201 1HG PRO 27 2HG PRO 27 -1.669 7.951 -2.697
202 2HG PRO 27 1HG PRO 27 -1.666 9.379 -1.647
203 1HD PRO 27 2HD PRO 27 -0.733 6.959 -0.846
204 2HD PRO 27 1HD PRO 27 -1.471 8.123 0.270
205 H PHE 28 H PHE 28 -4.484 4.572 -1.101
206 HA PHE 28 HA PHE 28 -5.001 2.836 -2.440
207 1HB PHE 28 2HB PHE 28 -5.852 5.029 -4.363
208 2HB PHE 28 1HB PHE 28 -6.053 3.313 -4.706
209 HD1 PHE 28 1HD PHE 28 -6.656 5.415 -1.666
210 HD2 PHE 28 2HD PHE 28 -8.238 2.713 -4.544
211 HE1 PHE 28 1HE PHE 28 -8.811 5.427 -0.483
212 HE2 PHE 28 2HE PHE 28 -10.398 2.718 -3.367
213 HZ PHE 28 HZ PHE 28 -10.687 4.077 -1.333
214 H VAL 29 H VAL 29 -2.378 4.411 -2.565
215 HA VAL 29 HA VAL 29 -1.112 2.660 -4.488
216 HB VAL 29 HB VAL 29 0.286 4.481 -5.488
217 1HG1 VAL 29 1HG1 VAL 29 -2.417 3.832 -6.145
218 2HG1 VAL 29 2HG1 VAL 29 -1.081 4.255 -7.215
219 3HG1 VAL 29 3HG1 VAL 29 -2.113 5.521 -6.551
220 1HG2 VAL 29 1HG2 VAL 29 -0.801 6.071 -3.518
221 2HG2 VAL 29 2HG2 VAL 29 -1.629 6.622 -4.974
222 3HG2 VAL 29 3HG2 VAL 29 0.134 6.633 -4.905
223 H CYS 30 H CYS 30 1.209 2.582 -4.033
224 HA CYS 30 HA CYS 30 1.711 3.137 -1.226
225 1HB CYS 30 2HB CYS 30 2.222 0.923 -2.436
226 2HB CYS 30 1HB CYS 30 3.579 1.775 -3.158
227 H VAL 31 H VAL 31 3.659 4.246 -0.520
228 HA VAL 31 HA VAL 31 4.896 5.946 -2.567
229 HB VAL 31 HB VAL 31 4.765 7.918 -1.069
230 1HG1 VAL 31 1HG1 VAL 31 2.846 8.600 -2.007
231 2HG1 VAL 31 2HG1 VAL 31 1.914 7.286 -1.289
232 3HG1 VAL 31 3HG1 VAL 31 2.840 7.007 -2.764
233 1HG2 VAL 31 1HG2 VAL 31 4.515 6.756 1.062
234 2HG2 VAL 31 2HG2 VAL 31 2.904 6.219 0.588
235 3HG2 VAL 31 3HG2 VAL 31 3.226 7.936 0.829
Start of MODEL 19
1 1H ALA 1 1HT ALA 1 2.405 -11.512 0.922
2 2H ALA 1 2HT ALA 1 1.490 -10.090 0.860
3 3H ALA 1 3HT ALA 1 2.735 -10.240 1.995
4 HA ALA 1 HA ALA 1 4.393 -10.179 0.333
5 1HB ALA 1 1HB ALA 1 2.994 -9.625 -2.039
6 2HB ALA 1 2HB ALA 1 2.222 -11.046 -1.334
7 3HB ALA 1 3HB ALA 1 3.955 -11.056 -1.664
8 H CYS 2 H CYS 2 5.104 -8.182 -0.724
9 HA CYS 2 HA CYS 2 3.666 -5.898 0.368
10 1HB CYS 2 2HB CYS 2 5.662 -4.635 -0.121
11 2HB CYS 2 1HB CYS 2 6.082 -6.102 0.745
12 H SER 3 H SER 3 4.877 -4.123 -1.778
13 HA SER 3 HA SER 3 3.691 -4.864 -4.246
14 1HB SER 3 2HB SER 3 1.657 -4.393 -2.812
15 2HB SER 3 1HB SER 3 2.205 -2.720 -2.707
16 HG SER 3 HG SER 3 1.283 -4.158 -4.948
17 H LYS 4 H LYS 4 4.001 -3.294 -5.878
18 HA LYS 4 HA LYS 4 6.322 -1.707 -5.607
19 1HB LYS 4 2HB LYS 4 5.600 -2.699 -7.741
20 2HB LYS 4 1HB LYS 4 4.173 -1.676 -7.741
21 1HG LYS 4 2HG LYS 4 5.674 0.307 -7.850
22 2HG LYS 4 1HG LYS 4 7.038 -0.799 -8.027
23 1HD LYS 4 2HD LYS 4 6.404 -0.097 -10.219
24 2HD LYS 4 1HD LYS 4 5.873 -1.769 -10.030
25 1HE LYS 4 2HE LYS 4 3.714 -0.289 -9.135
26 2HE LYS 4 1HE LYS 4 4.317 0.644 -10.504
27 1HZ LYS 4 1HZ LYS 4 2.749 -0.888 -11.344
28 2HZ LYS 4 2HZ LYS 4 3.411 -2.182 -10.478
29 3HZ LYS 4 3HZ LYS 4 4.263 -1.506 -11.781
30 H LYS 5 H LYS 5 6.547 0.549 -5.503
31 HA LYS 5 HA LYS 5 4.844 1.914 -3.842
32 1HB LYS 5 2HB LYS 5 7.028 2.777 -4.099
33 2HB LYS 5 1HB LYS 5 6.852 2.919 -5.843
34 1HG LYS 5 2HG LYS 5 5.582 4.846 -5.687
35 2HG LYS 5 1HG LYS 5 5.087 4.506 -4.042
36 1HD LYS 5 2HD LYS 5 7.287 5.041 -3.218
37 2HD LYS 5 1HD LYS 5 7.888 5.237 -4.866
38 1HE LYS 5 2HE LYS 5 6.796 7.235 -5.175
39 2HE LYS 5 1HE LYS 5 5.552 6.866 -3.981
40 1HZ LYS 5 1HZ LYS 5 7.074 8.580 -3.197
41 2HZ LYS 5 2HZ LYS 5 8.385 7.528 -3.366
42 3HZ LYS 5 3HZ LYS 5 7.177 7.196 -2.222
43 H TRP 6 H TRP 6 5.100 2.667 -7.295
44 HA TRP 6 HA TRP 6 2.557 3.998 -7.160
45 1HB TRP 6 2HB TRP 6 4.127 3.457 -9.679
46 2HB TRP 6 1HB TRP 6 2.996 4.766 -9.354
47 HD1 TRP 6 HD TRP 6 6.585 3.657 -8.522
48 HE1 TRP 6 1HE TRP 6 7.946 5.726 -7.837
49 HE3 TRP 6 3HE TRP 6 2.809 7.092 -8.344
50 HZ2 TRP 6 2HZ TRP 6 7.479 8.450 -7.275
51 HZ3 TRP 6 3HZ TRP 6 3.347 9.406 -7.717
52 HH2 TRP 6 HH TRP 6 5.636 10.069 -7.186
53 H GLU 7 H GLU 7 2.550 1.182 -6.558
54 HA GLU 7 HA GLU 7 1.377 -0.098 -8.904
55 1HB GLU 7 2HB GLU 7 2.699 -1.275 -7.006
56 2HB GLU 7 1HB GLU 7 1.188 -1.201 -6.110
57 1HG GLU 7 2HG GLU 7 1.343 -3.341 -7.152
58 2HG GLU 7 1HG GLU 7 0.087 -2.417 -7.976
59 H TYR 8 H TYR 8 -0.460 -1.193 -6.425
60 HA TYR 8 HA TYR 8 -2.424 0.864 -6.184
61 1HB TYR 8 2HB TYR 8 -2.608 -0.224 -8.600
62 2HB TYR 8 1HB TYR 8 -3.417 -1.517 -7.727
63 HD1 TYR 8 1HD TYR 8 -3.579 2.185 -7.279
64 HD2 TYR 8 2HD TYR 8 -5.662 -1.384 -8.286
65 HE1 TYR 8 1HE TYR 8 -5.681 3.454 -7.398
66 HE2 TYR 8 2HE TYR 8 -7.771 -0.125 -8.404
67 HH TYR 8 HH TYR 8 -7.882 3.347 -7.668
68 H CYS 9 H CYS 9 -1.251 -0.299 -4.200
69 HA CYS 9 HA CYS 9 -2.113 -2.793 -3.299
70 1HB CYS 9 2HB CYS 9 -1.508 -1.810 -0.995
71 2HB CYS 9 1HB CYS 9 -0.240 -1.907 -2.213
72 H ILE 10 H ILE 10 -3.365 0.421 -2.419
73 HA ILE 10 HA ILE 10 -5.391 1.138 -1.679
74 HB ILE 10 HB ILE 10 -6.395 -1.591 -2.507
75 1HG1 ILE 10 2HG1 ILE 10 -6.482 1.052 -3.981
76 2HG1 ILE 10 1HG1 ILE 10 -5.413 -0.294 -4.368
77 1HG2 ILE 10 1HG2 ILE 10 -8.586 -0.785 -2.300
78 2HG2 ILE 10 2HG2 ILE 10 -8.051 0.891 -2.169
79 3HG2 ILE 10 3HG2 ILE 10 -7.770 -0.231 -0.838
80 1HD1 ILE 10 1HD1 ILE 10 -7.039 -0.734 -5.863
81 2HD1 ILE 10 2HD1 ILE 10 -8.288 0.064 -4.909
82 3HD1 ILE 10 3HD1 ILE 10 -7.758 -1.563 -4.484
83 H VAL 11 H VAL 11 -5.600 1.446 0.446
84 HA VAL 11 HA VAL 11 -5.230 -0.773 2.272
85 HB VAL 11 HB VAL 11 -5.529 0.979 4.064
86 1HG1 VAL 11 1HG1 VAL 11 -3.321 0.395 3.583
87 2HG1 VAL 11 2HG1 VAL 11 -3.335 2.153 3.446
88 3HG1 VAL 11 3HG1 VAL 11 -3.367 1.155 1.992
89 1HG2 VAL 11 1HG2 VAL 11 -5.755 2.734 1.638
90 2HG2 VAL 11 2HG2 VAL 11 -5.154 3.360 3.173
91 3HG2 VAL 11 3HG2 VAL 11 -6.781 2.689 3.072
92 HA PRO 12 HA PRO 12 -9.600 -1.561 2.443
93 1HB PRO 12 2HB PRO 12 -9.522 -3.342 4.508
94 2HB PRO 12 1HB PRO 12 -9.094 -3.759 2.846
95 1HG PRO 12 2HG PRO 12 -7.317 -3.113 5.159
96 2HG PRO 12 1HG PRO 12 -7.118 -4.346 3.900
97 1HD PRO 12 2HD PRO 12 -5.790 -1.977 3.871
98 2HD PRO 12 1HD PRO 12 -6.248 -2.844 2.392
99 H ILE 13 H ILE 13 -11.241 -0.643 3.530
100 HA ILE 13 HA ILE 13 -10.888 1.374 5.373
101 HB ILE 13 HB ILE 13 -13.371 -0.318 5.037
102 1HG1 ILE 13 2HG1 ILE 13 -12.610 0.586 2.898
103 2HG1 ILE 13 1HG1 ILE 13 -14.074 1.411 3.422
104 1HG2 ILE 13 1HG2 ILE 13 -14.157 2.262 5.586
105 2HG2 ILE 13 2HG2 ILE 13 -12.778 2.023 6.659
106 3HG2 ILE 13 3HG2 ILE 13 -14.149 0.915 6.725
107 1HD1 ILE 13 1HD1 ILE 13 -11.793 2.617 2.534
108 2HD1 ILE 13 2HD1 ILE 13 -11.626 2.736 4.286
109 3HD1 ILE 13 3HD1 ILE 13 -13.057 3.392 3.491
110 H LEU 14 H LEU 14 -11.516 -2.047 5.981
111 HA LEU 14 HA LEU 14 -11.531 -1.558 8.856
112 1HB LEU 14 2HB LEU 14 -12.161 -3.998 7.208
113 2HB LEU 14 1HB LEU 14 -12.019 -4.055 8.952
114 HG LEU 14 HG LEU 14 -14.325 -3.929 8.496
115 1HD1 LEU 14 1HD1 LEU 14 -13.007 -1.616 9.656
116 2HD1 LEU 14 2HD1 LEU 14 -14.393 -2.545 10.231
117 3HD1 LEU 14 3HD1 LEU 14 -14.624 -1.255 9.050
118 1HD2 LEU 14 1HD2 LEU 14 -15.334 -2.185 7.077
119 2HD2 LEU 14 2HD2 LEU 14 -14.262 -3.260 6.179
120 3HD2 LEU 14 3HD2 LEU 14 -13.718 -1.644 6.627
121 H GLY 15 H GLY 15 -9.023 -1.215 7.383
122 1HA GLY 15 2HA GLY 15 -7.253 -2.385 9.147
123 2HA GLY 15 1HA GLY 15 -7.404 -3.535 7.828
124 H PHE 16 H PHE 16 -5.393 -3.354 6.994
125 HA PHE 16 HA PHE 16 -4.862 -1.308 5.161
126 1HB PHE 16 2HB PHE 16 -2.830 -0.315 6.216
127 2HB PHE 16 1HB PHE 16 -4.322 0.110 7.040
128 HD1 PHE 16 1HD PHE 16 -4.559 -0.257 9.321
129 HD2 PHE 16 2HD PHE 16 -1.403 -2.191 7.220
130 HE1 PHE 16 1HE PHE 16 -3.595 -0.999 11.459
131 HE2 PHE 16 2HE PHE 16 -0.439 -2.943 9.355
132 HZ PHE 16 HZ PHE 16 -1.534 -2.346 11.478
133 H VAL 17 H VAL 17 -3.090 -1.804 3.840
134 HA VAL 17 HA VAL 17 -2.119 -4.545 4.161
135 HB VAL 17 HB VAL 17 -1.416 -2.883 1.778
136 1HG1 VAL 17 1HG1 VAL 17 -2.410 -5.491 1.186
137 2HG1 VAL 17 2HG1 VAL 17 -1.243 -5.601 2.505
138 3HG1 VAL 17 3HG1 VAL 17 -0.781 -4.849 0.978
139 1HG2 VAL 17 1HG2 VAL 17 -4.044 -2.967 2.597
140 2HG2 VAL 17 2HG2 VAL 17 -3.939 -4.285 1.429
141 3HG2 VAL 17 3HG2 VAL 17 -3.478 -2.649 0.957
142 H TYR 18 H TYR 18 0.282 -4.502 2.901
143 HA TYR 18 HA TYR 18 1.885 -2.428 4.166
144 1HB TYR 18 2HB TYR 18 3.444 -4.018 5.156
145 2HB TYR 18 1HB TYR 18 1.829 -4.266 5.801
146 HD1 TYR 18 1HD TYR 18 0.641 -6.325 5.407
147 HD2 TYR 18 2HD TYR 18 4.455 -5.669 3.640
148 HE1 TYR 18 1HE TYR 18 0.796 -8.718 4.864
149 HE2 TYR 18 2HE TYR 18 4.617 -8.058 3.085
150 HH TYR 18 HH TYR 18 2.916 -10.378 4.454
151 H CYS 19 H CYS 19 3.632 -1.849 3.045
152 HA CYS 19 HA CYS 19 3.966 -3.046 0.405
153 1HB CYS 19 2HB CYS 19 4.644 -0.437 1.653
154 2HB CYS 19 1HB CYS 19 5.548 -0.940 0.233
155 H CYS 20 H CYS 20 6.434 -2.632 -0.321
156 HA CYS 20 HA CYS 20 7.934 -4.553 1.164
157 1HB CYS 20 2HB CYS 20 9.122 -2.726 -0.904
158 2HB CYS 20 1HB CYS 20 9.533 -4.398 -0.550
159 HA PRO 21 HA PRO 21 9.921 -2.038 4.162
160 1HB PRO 21 2HB PRO 21 12.526 -3.020 3.112
161 2HB PRO 21 1HB PRO 21 11.905 -2.969 4.768
162 1HG PRO 21 2HG PRO 21 11.957 -5.267 3.404
163 2HG PRO 21 1HG PRO 21 10.603 -4.874 4.481
164 1HD PRO 21 2HD PRO 21 10.740 -4.796 1.499
165 2HD PRO 21 1HD PRO 21 9.375 -5.211 2.553
166 H GLY 22 H GLY 22 9.841 0.000 3.817
167 1HA GLY 22 2HA GLY 22 11.337 1.937 3.360
168 2HA GLY 22 1HA GLY 22 11.593 1.213 1.780
169 H LEU 23 H LEU 23 8.706 0.426 1.590
170 HA LEU 23 HA LEU 23 7.679 3.106 0.925
171 1HB LEU 23 2HB LEU 23 6.957 0.440 -0.292
172 2HB LEU 23 1HB LEU 23 6.380 2.009 -0.819
173 HG LEU 23 HG LEU 23 9.272 1.154 -0.916
174 1HD1 LEU 23 1HD1 LEU 23 7.941 -0.226 -2.408
175 2HD1 LEU 23 2HD1 LEU 23 8.925 0.912 -3.328
176 3HD1 LEU 23 3HD1 LEU 23 7.202 1.214 -3.106
177 1HD2 LEU 23 1HD2 LEU 23 9.718 3.136 -2.023
178 2HD2 LEU 23 2HD2 LEU 23 8.554 3.644 -0.800
179 3HD2 LEU 23 3HD2 LEU 23 8.029 3.390 -2.464
180 H ILE 24 H ILE 24 5.445 3.542 1.252
181 HA ILE 24 HA ILE 24 4.050 1.661 3.046
182 HB ILE 24 HB ILE 24 3.112 3.659 4.265
183 1HG1 ILE 24 2HG1 ILE 24 5.450 5.078 2.965
184 2HG1 ILE 24 1HG1 ILE 24 3.756 5.356 2.576
185 1HG2 ILE 24 1HG2 ILE 24 5.760 2.469 4.489
186 2HG2 ILE 24 2HG2 ILE 24 4.531 2.744 5.723
187 3HG2 ILE 24 3HG2 ILE 24 5.635 4.043 5.276
188 1HD1 ILE 24 1HD1 ILE 24 4.126 7.076 4.013
189 2HD1 ILE 24 2HD1 ILE 24 5.322 6.182 4.953
190 3HD1 ILE 24 3HD1 ILE 24 3.603 5.843 5.160
191 H CYS 25 H CYS 25 1.954 1.312 2.564
192 HA CYS 25 HA CYS 25 0.898 2.407 0.137
193 1HB CYS 25 2HB CYS 25 0.516 0.051 0.857
194 2HB CYS 25 1HB CYS 25 -0.482 0.649 2.177
195 H GLY 26 H GLY 26 -0.583 3.996 -0.139
196 1HA GLY 26 2HA GLY 26 -1.881 5.092 2.266
197 2HA GLY 26 1HA GLY 26 -0.997 6.152 1.183
198 HA PRO 27 HA PRO 27 -4.944 6.886 -0.718
199 1HB PRO 27 2HB PRO 27 -3.417 8.083 -2.923
200 2HB PRO 27 1HB PRO 27 -4.550 8.841 -1.802
201 1HG PRO 27 2HG PRO 27 -1.909 9.314 -1.674
202 2HG PRO 27 1HG PRO 27 -2.922 9.245 -0.219
203 1HD PRO 27 2HD PRO 27 -1.098 7.154 -1.356
204 2HD PRO 27 1HD PRO 27 -1.312 7.662 0.334
205 H PHE 28 H PHE 28 -4.560 4.374 -1.084
206 HA PHE 28 HA PHE 28 -5.023 2.592 -2.388
207 1HB PHE 28 2HB PHE 28 -5.914 4.749 -4.326
208 2HB PHE 28 1HB PHE 28 -6.004 3.036 -4.722
209 HD1 PHE 28 1HD PHE 28 -8.286 2.679 -4.861
210 HD2 PHE 28 2HD PHE 28 -6.693 4.639 -1.436
211 HE1 PHE 28 1HE PHE 28 -10.480 2.531 -3.759
212 HE2 PHE 28 2HE PHE 28 -8.885 4.494 -0.329
213 HZ PHE 28 HZ PHE 28 -10.782 3.438 -1.490
214 H VAL 29 H VAL 29 -2.421 4.256 -2.548
215 HA VAL 29 HA VAL 29 -1.119 2.463 -4.423
216 HB VAL 29 HB VAL 29 0.230 4.289 -5.479
217 1HG1 VAL 29 1HG1 VAL 29 -2.620 4.902 -6.143
218 2HG1 VAL 29 2HG1 VAL 29 -1.978 3.287 -6.438
219 3HG1 VAL 29 3HG1 VAL 29 -1.234 4.686 -7.211
220 1HG2 VAL 29 1HG2 VAL 29 -0.475 6.591 -5.360
221 2HG2 VAL 29 2HG2 VAL 29 -0.196 5.990 -3.725
222 3HG2 VAL 29 3HG2 VAL 29 -1.843 6.164 -4.331
223 H CYS 30 H CYS 30 1.256 2.580 -4.066
224 HA CYS 30 HA CYS 30 1.768 3.079 -1.251
225 1HB CYS 30 2HB CYS 30 2.428 0.956 -2.629
226 2HB CYS 30 1HB CYS 30 3.762 1.955 -3.190
227 H VAL 31 H VAL 31 3.604 4.328 -0.541
228 HA VAL 31 HA VAL 31 4.759 6.118 -2.552
229 HB VAL 31 HB VAL 31 4.469 8.074 -1.035
230 1HG1 VAL 31 1HG1 VAL 31 2.545 8.671 -2.037
231 2HG1 VAL 31 2HG1 VAL 31 1.679 7.246 -1.463
232 3HG1 VAL 31 3HG1 VAL 31 2.732 7.130 -2.874
233 1HG2 VAL 31 1HG2 VAL 31 3.720 7.863 1.042
234 2HG2 VAL 31 2HG2 VAL 31 3.626 6.119 0.803
235 3HG2 VAL 31 3HG2 VAL 31 2.223 7.131 0.466
Start of MODEL 20
1 1H ALA 1 1HT ALA 1 4.070 -11.883 0.141
2 2H ALA 1 2HT ALA 1 3.132 -10.561 0.618
3 3H ALA 1 3HT ALA 1 4.734 -10.694 1.149
4 HA ALA 1 HA ALA 1 5.581 -10.332 -1.020
5 1HB ALA 1 1HB ALA 1 3.413 -11.546 -1.960
6 2HB ALA 1 2HB ALA 1 4.371 -10.446 -2.950
7 3HB ALA 1 3HB ALA 1 2.888 -9.878 -2.185
8 H CYS 2 H CYS 2 6.142 -8.258 -1.485
9 HA CYS 2 HA CYS 2 4.700 -6.167 -0.026
10 1HB CYS 2 2HB CYS 2 6.690 -4.882 -0.182
11 2HB CYS 2 1HB CYS 2 7.161 -6.511 0.277
12 H SER 3 H SER 3 3.784 -4.448 -0.968
13 HA SER 3 HA SER 3 3.105 -4.650 -3.756
14 1HB SER 3 2HB SER 3 1.514 -3.982 -1.899
15 2HB SER 3 1HB SER 3 2.372 -2.446 -1.818
16 HG SER 3 HG SER 3 1.394 -3.359 -4.294
17 H LYS 4 H LYS 4 3.605 -3.174 -5.387
18 HA LYS 4 HA LYS 4 6.152 -1.856 -5.118
19 1HB LYS 4 2HB LYS 4 4.399 -1.289 -7.467
20 2HB LYS 4 1HB LYS 4 6.131 -1.555 -7.409
21 1HG LYS 4 2HG LYS 4 4.031 -3.694 -7.145
22 2HG LYS 4 1HG LYS 4 4.930 -3.319 -8.612
23 1HD LYS 4 2HD LYS 4 6.471 -4.785 -7.958
24 2HD LYS 4 1HD LYS 4 6.857 -3.708 -6.613
25 1HE LYS 4 2HE LYS 4 6.272 -6.119 -6.032
26 2HE LYS 4 1HE LYS 4 5.431 -4.853 -5.141
27 1HZ LYS 4 1HZ LYS 4 4.151 -6.870 -6.209
28 2HZ LYS 4 2HZ LYS 4 4.157 -5.872 -7.570
29 3HZ LYS 4 3HZ LYS 4 3.452 -5.330 -6.134
30 H LYS 5 H LYS 5 6.478 0.462 -5.498
31 HA LYS 5 HA LYS 5 4.916 2.042 -3.874
32 1HB LYS 5 2HB LYS 5 7.104 2.809 -4.421
33 2HB LYS 5 1HB LYS 5 6.728 2.848 -6.140
34 1HG LYS 5 2HG LYS 5 5.549 4.802 -5.977
35 2HG LYS 5 1HG LYS 5 5.103 4.513 -4.313
36 1HD LYS 5 2HD LYS 5 7.337 5.061 -3.577
37 2HD LYS 5 1HD LYS 5 7.864 5.245 -5.253
38 1HE LYS 5 2HE LYS 5 6.744 7.226 -5.534
39 2HE LYS 5 1HE LYS 5 5.538 6.844 -4.305
40 1HZ LYS 5 1HZ LYS 5 8.368 7.603 -3.802
41 2HZ LYS 5 2HZ LYS 5 7.255 7.162 -2.600
42 3HZ LYS 5 3HZ LYS 5 7.008 8.568 -3.518
43 H TRP 6 H TRP 6 4.937 2.419 -7.404
44 HA TRP 6 HA TRP 6 2.429 3.807 -7.211
45 1HB TRP 6 2HB TRP 6 3.791 2.978 -9.770
46 2HB TRP 6 1HB TRP 6 2.722 4.352 -9.490
47 HD1 TRP 6 HD TRP 6 6.328 3.199 -8.826
48 HE1 TRP 6 1HE TRP 6 7.792 5.261 -8.389
49 HE3 TRP 6 3HE TRP 6 2.673 6.755 -8.608
50 HZ2 TRP 6 2HZ TRP 6 7.444 8.028 -7.979
51 HZ3 TRP 6 3HZ TRP 6 3.317 9.086 -8.178
52 HH2 TRP 6 HH TRP 6 5.656 9.708 -7.864
53 H GLU 7 H GLU 7 2.579 0.989 -6.404
54 HA GLU 7 HA GLU 7 0.859 -0.297 -8.412
55 1HB GLU 7 2HB GLU 7 2.688 -1.625 -7.421
56 2HB GLU 7 1HB GLU 7 2.007 -1.373 -5.824
57 1HG GLU 7 2HG GLU 7 0.126 -2.728 -6.321
58 2HG GLU 7 1HG GLU 7 0.540 -2.782 -8.035
59 H TYR 8 H TYR 8 -1.298 -0.500 -8.126
60 HA TYR 8 HA TYR 8 -2.548 1.141 -6.184
61 1HB TYR 8 2HB TYR 8 -3.621 -0.767 -8.251
62 2HB TYR 8 1HB TYR 8 -4.683 0.071 -7.126
63 HD1 TYR 8 1HD TYR 8 -1.740 1.083 -9.220
64 HD2 TYR 8 2HD TYR 8 -5.775 1.835 -8.104
65 HE1 TYR 8 1HE TYR 8 -1.777 3.041 -10.704
66 HE2 TYR 8 2HE TYR 8 -5.824 3.797 -9.585
67 HH TYR 8 HH TYR 8 -3.458 5.395 -10.601
68 H CYS 9 H CYS 9 -1.922 0.342 -4.181
69 HA CYS 9 HA CYS 9 -2.606 -2.334 -3.371
70 1HB CYS 9 2HB CYS 9 -1.918 -1.465 -1.082
71 2HB CYS 9 1HB CYS 9 -0.674 -1.428 -2.326
72 H ILE 10 H ILE 10 -4.871 -1.790 -4.211
73 HA ILE 10 HA ILE 10 -6.608 -0.192 -2.630
74 HB ILE 10 HB ILE 10 -8.386 -1.702 -3.873
75 1HG1 ILE 10 2HG1 ILE 10 -7.390 -2.354 -6.134
76 2HG1 ILE 10 1HG1 ILE 10 -5.812 -2.231 -5.367
77 1HG2 ILE 10 1HG2 ILE 10 -7.250 0.750 -4.291
78 2HG2 ILE 10 2HG2 ILE 10 -8.637 0.099 -5.165
79 3HG2 ILE 10 3HG2 ILE 10 -7.017 -0.050 -5.846
80 1HD1 ILE 10 1HD1 ILE 10 -7.732 -3.921 -3.941
81 2HD1 ILE 10 2HD1 ILE 10 -6.035 -4.200 -4.331
82 3HD1 ILE 10 3HD1 ILE 10 -7.279 -4.496 -5.546
83 H VAL 11 H VAL 11 -5.440 -1.550 -0.712
84 HA VAL 11 HA VAL 11 -6.790 -3.968 0.009
85 HB VAL 11 HB VAL 11 -5.641 -3.647 2.220
86 1HG1 VAL 11 1HG1 VAL 11 -4.558 -4.245 -0.337
87 2HG1 VAL 11 2HG1 VAL 11 -4.068 -4.866 1.240
88 3HG1 VAL 11 3HG1 VAL 11 -3.326 -3.399 0.601
89 1HG2 VAL 11 1HG2 VAL 11 -5.467 -1.271 2.368
90 2HG2 VAL 11 2HG2 VAL 11 -4.602 -1.177 0.835
91 3HG2 VAL 11 3HG2 VAL 11 -3.826 -1.904 2.241
92 HA PRO 12 HA PRO 12 -10.292 -1.971 1.861
93 1HB PRO 12 2HB PRO 12 -11.594 -4.180 2.639
94 2HB PRO 12 1HB PRO 12 -11.432 -3.754 0.931
95 1HG PRO 12 2HG PRO 12 -9.922 -5.770 2.535
96 2HG PRO 12 1HG PRO 12 -10.507 -5.874 0.865
97 1HD PRO 12 2HD PRO 12 -7.908 -5.261 1.603
98 2HD PRO 12 1HD PRO 12 -8.640 -4.866 0.036
99 H ILE 13 H ILE 13 -11.213 -1.609 3.902
100 HA ILE 13 HA ILE 13 -10.944 -0.973 6.054
101 HB ILE 13 HB ILE 13 -10.982 -2.885 7.706
102 1HG1 ILE 13 2HG1 ILE 13 -9.937 -4.481 5.856
103 2HG1 ILE 13 1HG1 ILE 13 -11.040 -5.094 7.081
104 1HG2 ILE 13 1HG2 ILE 13 -13.040 -2.598 5.541
105 2HG2 ILE 13 2HG2 ILE 13 -12.986 -1.804 7.115
106 3HG2 ILE 13 3HG2 ILE 13 -13.306 -3.535 7.011
107 1HD1 ILE 13 1HD1 ILE 13 -12.691 -5.497 5.580
108 2HD1 ILE 13 2HD1 ILE 13 -11.301 -5.664 4.509
109 3HD1 ILE 13 3HD1 ILE 13 -12.221 -4.160 4.530
110 H LEU 14 H LEU 14 -9.290 -3.367 7.602
111 HA LEU 14 HA LEU 14 -7.087 -1.623 8.136
112 1HB LEU 14 2HB LEU 14 -7.596 -4.476 8.973
113 2HB LEU 14 1HB LEU 14 -6.292 -3.475 9.581
114 HG LEU 14 HG LEU 14 -9.240 -2.935 9.956
115 1HD1 LEU 14 1HD1 LEU 14 -7.878 -4.841 11.223
116 2HD1 LEU 14 2HD1 LEU 14 -9.114 -3.865 12.018
117 3HD1 LEU 14 3HD1 LEU 14 -7.408 -3.463 12.219
118 1HD2 LEU 14 1HD2 LEU 14 -8.474 -1.171 11.493
119 2HD2 LEU 14 2HD2 LEU 14 -7.981 -0.866 9.828
120 3HD2 LEU 14 3HD2 LEU 14 -6.811 -1.479 10.997
121 H GLY 15 H GLY 15 -7.364 -2.596 5.384
122 1HA GLY 15 2HA GLY 15 -5.839 -3.018 3.713
123 2HA GLY 15 1HA GLY 15 -4.595 -3.200 4.939
124 H PHE 16 H PHE 16 -3.698 -4.966 3.953
125 HA PHE 16 HA PHE 16 -4.527 -7.498 4.765
126 1HB PHE 16 2HB PHE 16 -6.300 -7.187 3.031
127 2HB PHE 16 1HB PHE 16 -5.041 -6.972 1.821
128 HD1 PHE 16 1HD PHE 16 -5.476 -9.436 4.590
129 HD2 PHE 16 2HD PHE 16 -5.035 -8.778 0.409
130 HE1 PHE 16 1HE PHE 16 -5.418 -11.867 4.217
131 HE2 PHE 16 2HE PHE 16 -4.977 -11.208 0.028
132 HZ PHE 16 HZ PHE 16 -5.169 -12.756 1.934
133 H VAL 17 H VAL 17 -3.048 -5.843 2.008
134 HA VAL 17 HA VAL 17 -0.752 -7.643 2.108
135 HB VAL 17 HB VAL 17 -0.954 -5.382 0.155
136 1HG1 VAL 17 1HG1 VAL 17 0.657 -7.710 0.499
137 2HG1 VAL 17 2HG1 VAL 17 0.811 -6.420 -0.693
138 3HG1 VAL 17 3HG1 VAL 17 -0.199 -7.824 -1.039
139 1HG2 VAL 17 1HG2 VAL 17 -3.150 -6.886 0.422
140 2HG2 VAL 17 2HG2 VAL 17 -2.220 -7.933 -0.650
141 3HG2 VAL 17 3HG2 VAL 17 -2.591 -6.278 -1.137
142 H TYR 18 H TYR 18 1.285 -6.045 1.314
143 HA TYR 18 HA TYR 18 1.468 -3.683 2.952
144 1HB TYR 18 2HB TYR 18 3.406 -4.543 4.273
145 2HB TYR 18 1HB TYR 18 1.895 -5.362 4.654
146 HD1 TYR 18 1HD TYR 18 1.624 -7.705 4.252
147 HD2 TYR 18 2HD TYR 18 5.150 -5.716 2.940
148 HE1 TYR 18 1HE TYR 18 2.683 -9.880 3.817
149 HE2 TYR 18 2HE TYR 18 6.216 -7.887 2.500
150 HH TYR 18 HH TYR 18 5.554 -10.542 3.669
151 H CYS 19 H CYS 19 3.211 -2.370 2.362
152 HA CYS 19 HA CYS 19 4.290 -2.869 -0.251
153 1HB CYS 19 2HB CYS 19 4.623 -0.713 1.784
154 2HB CYS 19 1HB CYS 19 5.541 -0.689 0.283
155 H CYS 20 H CYS 20 6.669 -2.452 -0.644
156 HA CYS 20 HA CYS 20 8.211 -4.393 0.759
157 1HB CYS 20 2HB CYS 20 9.278 -2.237 -1.056
158 2HB CYS 20 1HB CYS 20 9.989 -3.809 -0.725
159 HA PRO 21 HA PRO 21 9.853 -2.138 4.141
160 1HB PRO 21 2HB PRO 21 12.575 -2.851 3.184
161 2HB PRO 21 1HB PRO 21 11.831 -3.062 4.773
162 1HG PRO 21 2HG PRO 21 12.136 -5.143 3.122
163 2HG PRO 21 1HG PRO 21 10.687 -4.981 4.134
164 1HD PRO 21 2HD PRO 21 11.024 -4.468 1.210
165 2HD PRO 21 1HD PRO 21 9.629 -5.125 2.084
166 H GLY 22 H GLY 22 9.733 -0.075 4.060
167 1HA GLY 22 2HA GLY 22 11.054 1.994 3.901
168 2HA GLY 22 1HA GLY 22 11.566 1.437 2.314
169 H LEU 23 H LEU 23 8.796 0.442 1.725
170 HA LEU 23 HA LEU 23 7.683 3.048 0.972
171 1HB LEU 23 2HB LEU 23 7.166 0.280 -0.127
172 2HB LEU 23 1HB LEU 23 6.392 1.743 -0.697
173 HG LEU 23 HG LEU 23 8.762 2.563 -1.266
174 1HD1 LEU 23 1HD1 LEU 23 10.473 0.973 -1.567
175 2HD1 LEU 23 2HD1 LEU 23 9.380 -0.378 -1.261
176 3HD1 LEU 23 3HD1 LEU 23 9.848 0.695 0.059
177 1HD2 LEU 23 1HD2 LEU 23 7.761 2.192 -3.220
178 2HD2 LEU 23 2HD2 LEU 23 6.975 0.725 -2.638
179 3HD2 LEU 23 3HD2 LEU 23 8.633 0.659 -3.236
180 H ILE 24 H ILE 24 5.432 3.454 1.246
181 HA ILE 24 HA ILE 24 4.013 1.560 2.993
182 HB ILE 24 HB ILE 24 3.084 3.515 4.280
183 1HG1 ILE 24 2HG1 ILE 24 5.457 4.951 3.064
184 2HG1 ILE 24 1HG1 ILE 24 3.768 5.283 2.694
185 1HG2 ILE 24 1HG2 ILE 24 5.695 2.260 4.507
186 2HG2 ILE 24 2HG2 ILE 24 4.460 2.538 5.735
187 3HG2 ILE 24 3HG2 ILE 24 5.611 3.814 5.336
188 1HD1 ILE 24 1HD1 ILE 24 3.414 6.379 4.651
189 2HD1 ILE 24 2HD1 ILE 24 5.132 6.718 4.435
190 3HD1 ILE 24 3HD1 ILE 24 4.617 5.435 5.530
191 H CYS 25 H CYS 25 1.961 1.211 2.444
192 HA CYS 25 HA CYS 25 0.885 2.370 0.077
193 1HB CYS 25 2HB CYS 25 0.333 0.080 0.722
194 2HB CYS 25 1HB CYS 25 -0.437 0.657 2.195
195 H GLY 26 H GLY 26 -0.601 3.982 -0.205
196 1HA GLY 26 2HA GLY 26 -1.720 5.236 2.215
197 2HA GLY 26 1HA GLY 26 -0.846 6.213 1.047
198 HA PRO 27 HA PRO 27 -4.876 6.958 -0.680
199 1HB PRO 27 2HB PRO 27 -4.090 8.347 -2.873
200 2HB PRO 27 1HB PRO 27 -4.078 9.034 -1.244
201 1HG PRO 27 2HG PRO 27 -1.815 7.882 -2.829
202 2HG PRO 27 1HG PRO 27 -1.850 9.347 -1.831
203 1HD PRO 27 2HD PRO 27 -0.790 7.006 -0.964
204 2HD PRO 27 1HD PRO 27 -1.565 8.171 0.128
205 H PHE 28 H PHE 28 -4.474 4.447 -1.049
206 HA PHE 28 HA PHE 28 -4.958 2.650 -2.320
207 1HB PHE 28 2HB PHE 28 -5.924 4.747 -4.295
208 2HB PHE 28 1HB PHE 28 -6.078 3.014 -4.573
209 HD1 PHE 28 1HD PHE 28 -6.656 5.146 -1.547
210 HD2 PHE 28 2HD PHE 28 -8.267 2.412 -4.382
211 HE1 PHE 28 1HE PHE 28 -8.786 5.131 -0.317
212 HE2 PHE 28 2HE PHE 28 -10.399 2.393 -3.156
213 HZ PHE 28 HZ PHE 28 -10.661 3.754 -1.120
214 H VAL 29 H VAL 29 -2.391 4.272 -2.528
215 HA VAL 29 HA VAL 29 -1.102 2.531 -4.436
216 HB VAL 29 HB VAL 29 0.214 4.377 -5.501
217 1HG1 VAL 29 1HG1 VAL 29 -1.321 3.630 -7.011
218 2HG1 VAL 29 2HG1 VAL 29 -1.849 5.306 -6.857
219 3HG1 VAL 29 3HG1 VAL 29 -2.700 4.029 -5.986
220 1HG2 VAL 29 1HG2 VAL 29 -0.121 6.132 -3.877
221 2HG2 VAL 29 2HG2 VAL 29 -1.855 6.154 -4.200
222 3HG2 VAL 29 3HG2 VAL 29 -0.719 6.671 -5.447
223 H CYS 30 H CYS 30 1.222 2.533 -4.039
224 HA CYS 30 HA CYS 30 1.776 3.137 -1.253
225 1HB CYS 30 2HB CYS 30 2.361 0.941 -2.501
226 2HB CYS 30 1HB CYS 30 3.683 1.863 -3.202
227 H VAL 31 H VAL 31 3.793 4.252 -0.642
228 HA VAL 31 HA VAL 31 4.861 6.009 -2.731
229 HB VAL 31 HB VAL 31 4.808 7.952 -1.154
230 1HG1 VAL 31 1HG1 VAL 31 1.967 7.523 -1.307
231 2HG1 VAL 31 2HG1 VAL 31 2.765 6.970 -2.780
232 3HG1 VAL 31 3HG1 VAL 31 2.988 8.629 -2.226
233 1HG2 VAL 31 1HG2 VAL 31 2.985 7.766 0.654
234 2HG2 VAL 31 2HG2 VAL 31 4.569 7.065 0.983
235 3HG2 VAL 31 3HG2 VAL 31 3.226 6.025 0.508