Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
|
|
4695 | 1fjn RC | 4640 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 1H GLY 1 -8.678 4.293 3.304
2 2H GLY 1 2H GLY 1 -7.643 3.365 2.325
3 3H GLY 1 3H GLY 1 -8.473 4.696 1.669
4 1HA GLY 1 2HA GLY 1 -7.154 6.248 2.752
5 2HA GLY 1 1HA GLY 1 -6.579 5.048 3.908
6 H PHE 2 H PHE 2 -4.657 6.489 2.698
7 HA PHE 2 HA PHE 2 -2.701 6.345 1.413
8 1HB PHE 2 2HB PHE 2 -3.364 3.386 1.363
9 2HB PHE 2 1HB PHE 2 -1.779 4.111 1.099
10 HD1 PHE 2 HD1 PHE 2 -3.976 2.711 3.517
11 HD2 PHE 2 HD2 PHE 2 -0.880 5.650 3.034
12 HE1 PHE 2 HE1 PHE 2 -3.555 2.668 5.960
13 HE2 PHE 2 HE2 PHE 2 -0.458 5.607 5.478
14 HZ PHE 2 HZ PHE 2 -1.796 4.116 6.941
15 H GLY 3 H GLY 3 -5.299 6.734 0.011
16 1HA GLY 3 2HA GLY 3 -5.970 6.992 -2.214
17 2HA GLY 3 1HA GLY 3 -4.360 6.465 -2.697
18 H CYS 4 H CYS 4 -7.050 4.849 -0.951
19 HA CYS 4 HA CYS 4 -6.724 2.545 -2.821
20 1HB CYS 4 2HB CYS 4 -7.613 2.772 0.041
21 2HB CYS 4 1HB CYS 4 -8.163 1.410 -0.933
22 HA PRO 5 HA PRO 5 -7.967 0.657 -2.858
23 1HB PRO 5 2HB PRO 5 -9.270 -0.554 -4.947
24 2HB PRO 5 1HB PRO 5 -9.873 -0.555 -3.281
25 1HG PRO 5 2HG PRO 5 -10.862 0.983 -5.628
26 2HG PRO 5 1HG PRO 5 -11.725 0.502 -4.159
27 1HD PRO 5 2HD PRO 5 -10.652 3.080 -4.727
28 2HD PRO 5 1HD PRO 5 -11.317 2.525 -3.176
29 H ASN 6 H ASN 6 -7.452 3.228 -4.647
30 HA ASN 6 HA ASN 6 -6.650 2.457 -7.246
31 1HB ASN 6 2HB ASN 6 -6.730 4.815 -6.162
32 2HB ASN 6 1HB ASN 6 -5.094 4.459 -5.614
33 1HD2 ASN 6 1HD2 ASN 6 -7.020 5.332 -8.396
34 2HD2 ASN 6 2HD2 ASN 6 -5.739 5.391 -9.508
35 H ASN 7 H ASN 7 -4.952 1.286 -8.012
36 HA ASN 7 HA ASN 7 -3.187 -0.097 -6.142
37 1HB ASN 7 2HB ASN 7 -3.437 -0.075 -9.157
38 2HB ASN 7 1HB ASN 7 -2.169 -0.979 -8.330
39 1HD2 ASN 7 1HD2 ASN 7 -2.934 -2.669 -6.718
40 2HD2 ASN 7 2HD2 ASN 7 -4.440 -3.409 -6.973
41 H TYR 8 H TYR 8 -2.835 2.521 -8.521
42 HA TYR 8 HA TYR 8 0.019 2.728 -8.388
43 1HB TYR 8 2HB TYR 8 -1.595 3.790 -10.096
44 2HB TYR 8 1HB TYR 8 -1.851 5.050 -8.890
45 HD1 TYR 8 HD1 TYR 8 -0.237 6.761 -8.528
46 HD2 TYR 8 HD2 TYR 8 0.751 3.345 -10.940
47 HE1 TYR 8 HE1 TYR 8 1.858 7.874 -9.248
48 HE2 TYR 8 HE2 TYR 8 2.847 4.458 -11.657
49 HH TYR 8 HH TYR 8 4.325 6.684 -10.236
50 H GLN 9 H GLN 9 -2.526 4.629 -6.721
51 HA GLN 9 HA GLN 9 -0.720 6.148 -5.104
52 1HB GLN 9 2HB GLN 9 -3.613 5.382 -4.612
53 2HB GLN 9 1HB GLN 9 -2.726 6.595 -3.688
54 1HG GLN 9 2HG GLN 9 -2.819 6.794 -6.687
55 2HG GLN 9 1HG GLN 9 -4.193 7.352 -5.735
56 1HE2 GLN 9 1HE2 GLN 9 -3.852 9.190 -4.279
57 2HE2 GLN 9 2HE2 GLN 9 -2.490 10.190 -4.433
58 H CYS 10 H CYS 10 -2.391 3.054 -4.514
59 HA CYS 10 HA CYS 10 -1.500 2.740 -1.799
60 1HB CYS 10 2HB CYS 10 -3.332 1.416 -3.019
61 2HB CYS 10 1HB CYS 10 -2.023 0.466 -3.721
62 H HIS 11 H HIS 11 -0.156 1.719 -4.930
63 HA HIS 11 HA HIS 11 2.084 0.277 -3.854
64 1HB HIS 11 2HB HIS 11 1.113 0.335 -6.291
65 2HB HIS 11 1HB HIS 11 2.193 1.713 -6.497
66 HD1 HIS 11 HD1 HIS 11 2.155 -1.868 -6.777
67 HD2 HIS 11 HD2 HIS 11 5.006 0.940 -5.614
68 HE1 HIS 11 HE1 HIS 11 4.407 -3.020 -6.944
69 H ARG 12 H ARG 12 1.583 3.675 -4.752
70 HA ARG 12 HA ARG 12 4.290 4.555 -4.502
71 1HB ARG 12 2HB ARG 12 2.170 5.806 -5.400
72 2HB ARG 12 1HB ARG 12 1.962 6.295 -3.718
73 1HG ARG 12 2HG ARG 12 4.209 7.265 -3.690
74 2HG ARG 12 1HG ARG 12 4.490 6.714 -5.341
75 1HD ARG 12 2HD ARG 12 3.362 8.462 -6.220
76 2HD ARG 12 1HD ARG 12 2.017 8.252 -5.099
77 HE ARG 12 HE ARG 12 3.585 9.463 -3.413
78 1HH1 ARG 12 1HH2 ARG 12 2.087 11.252 -5.339
79 2HH1 ARG 12 2HH2 ARG 12 3.356 12.271 -5.931
80 1HH2 ARG 12 2HH1 ARG 12 5.905 10.186 -4.818
81 2HH2 ARG 12 1HH1 ARG 12 5.526 11.665 -5.635
82 H HIS 13 H HIS 13 1.678 4.225 -2.105
83 HA HIS 13 HA HIS 13 3.083 5.420 0.094
84 1HB HIS 13 2HB HIS 13 0.687 5.102 0.245
85 2HB HIS 13 1HB HIS 13 0.853 3.364 0.002
86 HD1 HIS 13 HD1 HIS 13 2.319 5.914 2.457
87 HD2 HIS 13 HD2 HIS 13 0.736 2.058 2.416
88 HE1 HIS 13 HE1 HIS 13 2.377 5.090 4.852
89 H CYS 14 H CYS 14 2.825 2.050 -1.047
90 HA CYS 14 HA CYS 14 4.383 0.872 1.050
91 1HB CYS 14 2HB CYS 14 4.021 -0.036 -1.822
92 2HB CYS 14 1HB CYS 14 4.642 -1.032 -0.507
93 H LYS 15 H LYS 15 5.259 2.412 -2.009
94 HA LYS 15 HA LYS 15 8.011 1.610 -2.064
95 1HB LYS 15 2HB LYS 15 6.534 3.957 -3.274
96 2HB LYS 15 1HB LYS 15 8.256 3.684 -3.541
97 1HG LYS 15 2HG LYS 15 6.804 1.222 -3.953
98 2HG LYS 15 1HG LYS 15 6.099 2.503 -4.938
99 1HD LYS 15 2HD LYS 15 8.208 2.982 -5.982
100 2HD LYS 15 1HD LYS 15 9.076 1.959 -4.835
101 1HE LYS 15 2HE LYS 15 7.974 -0.032 -5.713
102 2HE LYS 15 1HE LYS 15 6.986 0.953 -6.790
103 1HZ LYS 15 1HZ LYS 15 8.925 -0.036 -7.899
104 2HZ LYS 15 2HZ LYS 15 9.954 0.830 -6.861
105 3HZ LYS 15 3HZ LYS 15 8.948 1.659 -7.952
106 H SER 16 H SER 16 6.403 4.511 -0.705
107 HA SER 16 HA SER 16 8.837 5.769 0.163
108 1HB SER 16 2HB SER 16 7.287 7.050 1.724
109 2HB SER 16 1HB SER 16 6.899 7.157 0.012
110 HG SER 16 HG SER 16 5.077 6.199 0.410
111 H ILE 17 H ILE 17 6.818 3.255 1.572
112 HA ILE 17 HA ILE 17 7.907 3.437 4.249
113 HB ILE 17 HB ILE 17 6.617 1.082 2.824
114 1HG1 ILE 17 2HG1 ILE 17 5.293 2.819 4.893
115 2HG1 ILE 17 1HG1 ILE 17 5.355 3.365 3.218
116 1HG2 ILE 17 1HG2 ILE 17 7.976 0.473 4.837
117 2HG2 ILE 17 2HG2 ILE 17 6.252 0.177 5.062
118 3HG2 ILE 17 3HG2 ILE 17 7.005 1.595 5.791
119 1HD1 ILE 17 1HD1 ILE 17 4.585 0.604 3.243
120 2HD1 ILE 17 2HD1 ILE 17 3.654 1.995 2.688
121 3HD1 ILE 17 3HD1 ILE 17 3.557 1.484 4.373
122 HA PRO 18 HA PRO 18 11.839 1.629 3.297
123 1HB PRO 18 2HB PRO 18 12.684 1.371 5.903
124 2HB PRO 18 1HB PRO 18 12.696 2.902 5.009
125 1HG PRO 18 2HG PRO 18 10.827 1.990 7.150
126 2HG PRO 18 1HG PRO 18 11.304 3.637 6.703
127 1HD PRO 18 2HD PRO 18 8.872 2.386 6.005
128 2HD PRO 18 1HD PRO 18 9.527 3.865 5.270
129 H GLY 19 H GLY 19 12.523 -0.471 3.020
130 1HA GLY 19 2HA GLY 19 12.777 -2.790 3.452
131 2HA GLY 19 1HA GLY 19 11.771 -2.606 4.889
132 H ARG 20 H ARG 20 10.897 -1.586 1.602
133 HA ARG 20 HA ARG 20 9.007 -3.854 1.360
134 1HB ARG 20 2HB ARG 20 8.258 -1.060 1.913
135 2HB ARG 20 1HB ARG 20 7.417 -1.771 0.539
136 1HG ARG 20 2HG ARG 20 6.012 -2.556 2.163
137 2HG ARG 20 1HG ARG 20 7.230 -3.822 2.299
138 1HD ARG 20 2HD ARG 20 8.020 -3.036 4.297
139 2HD ARG 20 1HD ARG 20 7.754 -1.350 3.856
140 HE ARG 20 HE ARG 20 5.392 -1.628 4.485
141 1HH1 ARG 20 2HH1 ARG 20 7.081 -2.535 6.870
142 2HH1 ARG 20 1HH1 ARG 20 6.260 -3.989 7.328
143 1HH2 ARG 20 1HH2 ARG 20 4.509 -4.253 4.334
144 2HH2 ARG 20 2HH2 ARG 20 4.804 -4.967 5.884
145 H CYS 21 H CYS 21 7.823 -3.627 -0.845
146 HA CYS 21 HA CYS 21 9.579 -2.367 -2.893
147 1HB CYS 21 2HB CYS 21 9.352 -5.189 -2.399
148 2HB CYS 21 1HB CYS 21 8.633 -4.828 -3.969
149 H GLY 22 H GLY 22 6.553 -4.250 -2.489
150 1HA GLY 22 2HA GLY 22 5.120 -2.131 -3.997
151 2HA GLY 22 1HA GLY 22 4.986 -3.793 -4.570
152 H GLY 23 H GLY 23 2.618 -2.809 -3.954
153 1HA GLY 23 2HA GLY 23 1.783 -4.364 -1.639
154 2HA GLY 23 1HA GLY 23 1.645 -2.631 -1.363
155 H TYR 24 H TYR 24 -0.692 -3.628 -1.175
156 HA TYR 24 HA TYR 24 -2.115 -2.847 -3.630
157 1HB TYR 24 2HB TYR 24 -3.351 -4.921 -3.863
158 2HB TYR 24 1HB TYR 24 -1.632 -5.307 -3.891
159 HD1 TYR 24 HD1 TYR 24 -4.776 -5.669 -2.084
160 HD2 TYR 24 HD2 TYR 24 -0.526 -6.260 -1.853
161 HE1 TYR 24 HE1 TYR 24 -5.091 -7.174 -0.140
162 HE2 TYR 24 HE2 TYR 24 -0.844 -7.765 0.092
163 HH TYR 24 HH TYR 24 -3.392 -9.274 0.851
164 H CYS 25 H CYS 25 -4.496 -2.690 -3.216
165 HA CYS 25 HA CYS 25 -4.990 -1.748 -0.464
166 1HB CYS 25 2HB CYS 25 -6.627 -1.657 -3.010
167 2HB CYS 25 1HB CYS 25 -7.237 -1.086 -1.457
168 H GLY 26 H GLY 26 -5.555 -3.294 0.996
169 1HA GLY 26 2HA GLY 26 -7.946 -4.855 0.695
170 2HA GLY 26 1HA GLY 26 -6.536 -5.881 0.430
171 H GLY 27 H GLY 27 -8.493 -5.910 2.661
172 1HA GLY 27 2HA GLY 27 -7.482 -6.821 4.848
173 2HA GLY 27 1HA GLY 27 -6.688 -5.250 4.954
174 H TRP 28 H TRP 28 -8.455 -3.402 4.464
175 HA TRP 28 HA TRP 28 -10.842 -3.992 6.164
176 1HB TRP 28 2HB TRP 28 -9.140 -2.596 7.345
177 2HB TRP 28 1HB TRP 28 -9.275 -1.395 6.064
178 HD1 TRP 28 HD1 TRP 28 -11.379 -3.040 8.836
179 HE1 TRP 28 HE1 TRP 28 -13.282 -1.428 9.479
180 HE3 TRP 28 HE3 TRP 28 -10.691 0.592 5.312
181 HZ2 TRP 28 HZ2 TRP 28 -14.369 1.071 8.617
182 HZ3 TRP 28 HZ3 TRP 28 -12.173 2.576 5.248
183 HH2 TRP 28 HH2 TRP 28 -14.011 2.819 6.893
184 H HIS 29 H HIS 29 -12.252 -4.268 4.419
185 HA HIS 29 HA HIS 29 -13.693 -3.642 2.691
186 1HB HIS 29 2HB HIS 29 -13.062 -0.852 3.707
187 2HB HIS 29 1HB HIS 29 -14.444 -1.300 2.712
188 HD1 HIS 29 HD1 HIS 29 -14.537 -0.160 5.725
189 HD2 HIS 29 HD2 HIS 29 -15.048 -4.130 4.570
190 HE1 HIS 29 HE1 HIS 29 -15.797 -1.296 7.606
191 H ARG 30 H ARG 30 -10.830 -3.924 2.083
192 HA ARG 30 HA ARG 30 -9.348 -3.548 0.310
193 1HB ARG 30 2HB ARG 30 -11.568 -4.032 -0.910
194 2HB ARG 30 1HB ARG 30 -11.677 -2.290 -1.146
195 1HG ARG 30 2HG ARG 30 -9.604 -2.248 -2.378
196 2HG ARG 30 1HG ARG 30 -9.264 -3.928 -1.965
197 1HD ARG 30 2HD ARG 30 -10.920 -4.755 -3.407
198 2HD ARG 30 1HD ARG 30 -11.793 -3.223 -3.439
199 HE ARG 30 HE ARG 30 -9.092 -3.172 -4.625
200 1HH1 ARG 30 2HH1 ARG 30 -11.853 -1.607 -5.037
201 2HH1 ARG 30 1HH1 ARG 30 -12.119 -1.989 -6.704
202 1HH2 ARG 30 1HH2 ARG 30 -9.704 -4.488 -6.789
203 2HH2 ARG 30 2HH2 ARG 30 -10.899 -3.627 -7.699
204 H LEU 31 H LEU 31 -9.831 -1.411 2.362
205 HA LEU 31 HA LEU 31 -9.055 0.980 0.749
206 1HB LEU 31 2HB LEU 31 -10.402 0.749 3.448
207 2HB LEU 31 1HB LEU 31 -9.749 2.265 2.828
208 HG LEU 31 HG LEU 31 -11.708 0.599 1.239
209 1HD1 LEU 31 1HD1 LEU 31 -13.470 2.125 2.069
210 2HD1 LEU 31 2HD1 LEU 31 -12.303 2.867 3.163
211 3HD1 LEU 31 3HD1 LEU 31 -12.767 1.179 3.381
212 1HD2 LEU 31 1HD2 LEU 31 -12.099 2.777 0.117
213 2HD2 LEU 31 2HD2 LEU 31 -10.406 2.295 0.012
214 3HD2 LEU 31 3HD2 LEU 31 -10.902 3.527 1.172
215 H ARG 32 H ARG 32 -7.922 -1.317 3.065
216 HA ARG 32 HA ARG 32 -5.829 0.447 4.145
217 1HB ARG 32 2HB ARG 32 -6.914 -1.354 5.527
218 2HB ARG 32 1HB ARG 32 -6.168 -2.552 4.471
219 1HG ARG 32 2HG ARG 32 -4.698 -2.344 6.339
220 2HG ARG 32 1HG ARG 32 -3.929 -1.446 5.033
221 1HD ARG 32 2HD ARG 32 -4.771 0.661 5.924
222 2HD ARG 32 1HD ARG 32 -5.681 -0.195 7.169
223 HE ARG 32 HE ARG 32 -2.743 -0.592 7.133
224 1HH1 ARG 32 1HH2 ARG 32 -4.722 -1.178 9.415
225 2HH1 ARG 32 2HH2 ARG 32 -4.343 0.108 10.510
226 1HH2 ARG 32 2HH1 ARG 32 -2.598 1.961 8.142
227 2HH2 ARG 32 1HH1 ARG 32 -3.134 1.892 9.788
228 H CYS 33 H CYS 33 -3.656 0.377 3.525
229 HA CYS 33 HA CYS 33 -3.106 -0.993 0.956
230 1HB CYS 33 2HB CYS 33 -1.927 1.306 2.436
231 2HB CYS 33 1HB CYS 33 -0.829 0.357 1.433
232 H THR 34 H THR 34 -2.394 -3.052 1.155
233 HA THR 34 HA THR 34 -0.694 -3.784 3.479
234 HB THR 34 HB THR 34 -2.077 -5.494 1.388
235 HG1 THR 34 HG1 THR 34 -3.677 -5.251 2.708
236 1HG2 THR 34 1HG2 THR 34 -1.426 -7.389 2.841
237 2HG2 THR 34 2HG2 THR 34 -0.516 -6.280 3.867
238 3HG2 THR 34 3HG2 THR 34 -0.011 -6.555 2.199
239 H CYS 35 H CYS 35 1.440 -3.482 3.116
240 HA CYS 35 HA CYS 35 2.530 -3.936 0.374
241 1HB CYS 35 2HB CYS 35 4.035 -2.637 2.640
242 2HB CYS 35 1HB CYS 35 4.284 -2.453 0.905
243 H TYR 36 H TYR 36 4.428 -5.248 0.127
244 HA TYR 36 HA TYR 36 4.912 -7.100 2.427
245 1HB TYR 36 2HB TYR 36 5.808 -8.601 0.427
246 2HB TYR 36 1HB TYR 36 4.095 -8.558 0.831
247 HD1 TYR 36 HD1 TYR 36 2.481 -7.605 -0.666
248 HD2 TYR 36 HD2 TYR 36 6.681 -7.231 -1.486
249 HE1 TYR 36 HE1 TYR 36 1.961 -6.784 -2.945
250 HE2 TYR 36 HE2 TYR 36 6.161 -6.410 -3.767
251 HH TYR 36 HH TYR 36 3.039 -5.435 -4.708
252 H ARG 37 H ARG 37 7.083 -7.785 2.815
253 HA ARG 37 HA ARG 37 9.082 -5.751 2.407
254 1HB ARG 37 2HB ARG 37 9.071 -8.507 3.580
255 2HB ARG 37 1HB ARG 37 10.612 -7.718 3.255
256 1HG ARG 37 2HG ARG 37 10.103 -5.894 4.698
257 2HG ARG 37 1HG ARG 37 8.402 -6.346 4.792
258 1HD ARG 37 2HD ARG 37 9.289 -8.576 5.802
259 2HD ARG 37 1HD ARG 37 10.777 -7.671 6.084
260 HE ARG 37 HE ARG 37 9.203 -6.004 7.316
261 1HH1 ARG 37 2HH1 ARG 37 6.887 -7.999 6.756
262 2HH1 ARG 37 1HH1 ARG 37 6.749 -8.754 8.309
263 1HH2 ARG 37 1HH2 ARG 37 9.807 -7.557 9.450
264 2HH2 ARG 37 2HH2 ARG 37 8.406 -8.495 9.843
265 H CYS 38 H CYS 38 10.810 -5.697 0.985
266 HA CYS 38 HA CYS 38 10.551 -7.299 -1.458
267 1HB CYS 38 2HB CYS 38 11.287 -4.766 -1.157
268 2HB CYS 38 1HB CYS 38 12.885 -5.486 -0.967
269 H GLY 39 HN GLY 39 11.736 -9.092 -1.936
270 1HA GLY 39 2HA GLY 39 13.706 -10.046 0.052
271 2HA GLY 39 1HA GLY 39 13.022 -11.001 -1.263
Start of MODEL 2
1 1H GLY 1 1H GLY 1 -7.463 3.536 2.256
2 2H GLY 1 2H GLY 1 -8.220 4.687 1.259
3 3H GLY 1 3H GLY 1 -8.612 4.600 2.910
4 1HA GLY 1 2HA GLY 1 -7.116 6.483 2.299
5 2HA GLY 1 1HA GLY 1 -6.505 5.421 3.565
6 H PHE 2 H PHE 2 -4.644 6.868 2.265
7 HA PHE 2 HA PHE 2 -2.628 6.711 1.082
8 1HB PHE 2 2HB PHE 2 -3.122 3.723 1.050
9 2HB PHE 2 1HB PHE 2 -1.572 4.560 0.995
10 HD1 PHE 2 HD1 PHE 2 -1.197 6.268 3.040
11 HD2 PHE 2 HD2 PHE 2 -3.806 2.857 3.097
12 HE1 PHE 2 HE1 PHE 2 -1.094 6.231 5.518
13 HE2 PHE 2 HE2 PHE 2 -3.703 2.819 5.575
14 HZ PHE 2 HZ PHE 2 -2.347 4.507 6.784
15 H GLY 3 H GLY 3 -5.179 6.963 -0.407
16 1HA GLY 3 2HA GLY 3 -5.754 7.145 -2.668
17 2HA GLY 3 1HA GLY 3 -4.146 6.549 -3.075
18 H CYS 4 H CYS 4 -6.831 5.046 -1.237
19 HA CYS 4 HA CYS 4 -6.563 2.657 -3.003
20 1HB CYS 4 2HB CYS 4 -7.461 3.064 -0.169
21 2HB CYS 4 1HB CYS 4 -8.090 1.687 -1.071
22 HA PRO 5 HA PRO 5 -7.835 0.810 -2.991
23 1HB PRO 5 2HB PRO 5 -9.111 -0.466 -5.059
24 2HB PRO 5 1HB PRO 5 -9.750 -0.390 -3.408
25 1HG PRO 5 2HG PRO 5 -10.662 1.067 -5.836
26 2HG PRO 5 1HG PRO 5 -11.565 0.659 -4.368
27 1HD PRO 5 2HD PRO 5 -10.440 3.195 -5.014
28 2HD PRO 5 1HD PRO 5 -11.145 2.712 -3.456
29 H ASN 6 H ASN 6 -7.339 3.304 -4.959
30 HA ASN 6 HA ASN 6 -6.442 2.363 -7.462
31 1HB ASN 6 2HB ASN 6 -6.574 4.791 -6.551
32 2HB ASN 6 1HB ASN 6 -4.949 4.492 -5.938
33 1HD2 ASN 6 1HD2 ASN 6 -6.702 5.460 -8.713
34 2HD2 ASN 6 2HD2 ASN 6 -5.441 5.322 -9.842
35 H ASN 7 H ASN 7 -4.815 1.016 -8.023
36 HA ASN 7 HA ASN 7 -3.038 -0.086 -5.993
37 1HB ASN 7 2HB ASN 7 -3.294 -0.508 -8.978
38 2HB ASN 7 1HB ASN 7 -2.072 -1.327 -8.003
39 1HD2 ASN 7 1HD2 ASN 7 -2.757 -3.362 -7.317
40 2HD2 ASN 7 2HD2 ASN 7 -4.364 -3.789 -6.981
41 H TYR 8 H TYR 8 -2.721 2.266 -8.624
42 HA TYR 8 HA TYR 8 0.153 2.416 -8.575
43 1HB TYR 8 2HB TYR 8 -1.465 3.343 -10.363
44 2HB TYR 8 1HB TYR 8 -1.685 4.714 -9.278
45 HD1 TYR 8 HD1 TYR 8 0.827 2.803 -11.241
46 HD2 TYR 8 HD2 TYR 8 0.002 6.394 -9.032
47 HE1 TYR 8 HE1 TYR 8 2.938 3.801 -12.074
48 HE2 TYR 8 HE2 TYR 8 2.113 7.391 -9.866
49 HH TYR 8 HH TYR 8 4.485 6.174 -10.780
50 H GLN 9 H GLN 9 -2.368 4.468 -7.070
51 HA GLN 9 HA GLN 9 -0.553 6.106 -5.577
52 1HB GLN 9 2HB GLN 9 -3.481 5.441 -5.309
53 2HB GLN 9 1HB GLN 9 -2.668 6.413 -4.083
54 1HG GLN 9 2HG GLN 9 -2.143 7.220 -6.884
55 2HG GLN 9 1HG GLN 9 -3.799 7.461 -6.326
56 1HE2 GLN 9 1HE2 GLN 9 -0.403 8.332 -5.633
57 2HE2 GLN 9 2HE2 GLN 9 -0.778 9.686 -4.681
58 H CYS 10 H CYS 10 -2.352 3.149 -4.717
59 HA CYS 10 HA CYS 10 -1.473 2.956 -2.011
60 1HB CYS 10 2HB CYS 10 -3.296 1.584 -3.125
61 2HB CYS 10 1HB CYS 10 -2.018 0.624 -3.865
62 H HIS 11 H HIS 11 -0.093 1.667 -5.033
63 HA HIS 11 HA HIS 11 2.088 0.242 -3.881
64 1HB HIS 11 2HB HIS 11 1.377 0.052 -6.267
65 2HB HIS 11 1HB HIS 11 2.012 1.670 -6.559
66 HD1 HIS 11 HD1 HIS 11 3.026 -1.861 -6.304
67 HD2 HIS 11 HD2 HIS 11 4.926 1.848 -6.195
68 HE1 HIS 11 HE1 HIS 11 5.497 -2.312 -6.627
69 H ARG 12 H ARG 12 1.857 3.621 -5.020
70 HA ARG 12 HA ARG 12 4.556 4.368 -4.522
71 1HB ARG 12 2HB ARG 12 2.424 5.642 -5.592
72 2HB ARG 12 1HB ARG 12 2.449 6.400 -4.000
73 1HG ARG 12 2HG ARG 12 5.121 6.170 -5.185
74 2HG ARG 12 1HG ARG 12 4.022 7.140 -6.165
75 1HD ARG 12 2HD ARG 12 4.435 7.546 -3.189
76 2HD ARG 12 1HD ARG 12 5.275 8.470 -4.434
77 HE ARG 12 HE ARG 12 2.707 8.900 -5.162
78 1HH1 ARG 12 1HH2 ARG 12 2.091 7.984 -2.271
79 2HH1 ARG 12 2HH2 ARG 12 1.949 9.521 -1.482
80 1HH2 ARG 12 2HH1 ARG 12 3.454 11.284 -4.072
81 2HH2 ARG 12 1HH1 ARG 12 2.728 11.395 -2.505
82 H HIS 13 H HIS 13 1.703 4.449 -2.373
83 HA HIS 13 HA HIS 13 2.965 5.689 -0.134
84 1HB HIS 13 2HB HIS 13 0.568 5.487 -0.142
85 2HB HIS 13 1HB HIS 13 0.654 3.736 -0.321
86 HD1 HIS 13 HD1 HIS 13 1.985 6.312 2.181
87 HD2 HIS 13 HD2 HIS 13 0.335 2.486 2.108
88 HE1 HIS 13 HE1 HIS 13 1.827 5.555 4.591
89 H CYS 14 H CYS 14 2.746 2.272 -1.118
90 HA CYS 14 HA CYS 14 4.054 1.221 1.224
91 1HB CYS 14 2HB CYS 14 3.586 0.156 -1.561
92 2HB CYS 14 1HB CYS 14 4.507 -0.760 -0.367
93 H LYS 15 H LYS 15 5.217 2.544 -1.830
94 HA LYS 15 HA LYS 15 7.930 1.628 -1.622
95 1HB LYS 15 2HB LYS 15 6.594 3.889 -3.111
96 2HB LYS 15 1HB LYS 15 8.345 3.680 -3.154
97 1HG LYS 15 2HG LYS 15 6.474 1.391 -3.770
98 2HG LYS 15 1HG LYS 15 6.973 2.531 -5.019
99 1HD LYS 15 2HD LYS 15 9.378 1.936 -3.848
100 2HD LYS 15 1HD LYS 15 8.526 0.402 -3.688
101 1HE LYS 15 2HE LYS 15 9.435 0.150 -5.809
102 2HE LYS 15 1HE LYS 15 7.877 0.867 -6.216
103 1HZ LYS 15 1HZ LYS 15 9.562 2.051 -7.378
104 2HZ LYS 15 2HZ LYS 15 10.483 2.266 -5.967
105 3HZ LYS 15 3HZ LYS 15 8.995 3.067 -6.145
106 H SER 16 H SER 16 6.314 4.652 -0.563
107 HA SER 16 HA SER 16 8.680 5.909 0.453
108 1HB SER 16 2HB SER 16 6.957 7.119 1.988
109 2HB SER 16 1HB SER 16 6.853 7.372 0.251
110 HG SER 16 HG SER 16 5.297 5.648 1.883
111 H ILE 17 H ILE 17 6.577 3.419 1.764
112 HA ILE 17 HA ILE 17 7.644 3.601 4.480
113 HB ILE 17 HB ILE 17 6.077 1.374 3.132
114 1HG1 ILE 17 2HG1 ILE 17 4.998 3.387 5.102
115 2HG1 ILE 17 1HG1 ILE 17 5.049 3.760 3.379
116 1HG2 ILE 17 1HG2 ILE 17 7.415 0.790 5.219
117 2HG2 ILE 17 2HG2 ILE 17 5.675 0.523 5.339
118 3HG2 ILE 17 3HG2 ILE 17 6.402 1.945 6.088
119 1HD1 ILE 17 1HD1 ILE 17 2.969 2.481 4.567
120 2HD1 ILE 17 2HD1 ILE 17 3.947 1.100 4.074
121 3HD1 ILE 17 3HD1 ILE 17 3.400 2.267 2.871
122 HA PRO 18 HA PRO 18 11.322 1.344 3.456
123 1HB PRO 18 2HB PRO 18 12.250 1.119 6.037
124 2HB PRO 18 1HB PRO 18 12.388 2.592 5.061
125 1HG PRO 18 2HG PRO 18 10.530 2.004 7.321
126 2HG PRO 18 1HG PRO 18 11.163 3.563 6.764
127 1HD PRO 18 2HD PRO 18 8.580 2.551 6.234
128 2HD PRO 18 1HD PRO 18 9.354 3.913 5.396
129 H GLY 19 H GLY 19 11.916 -0.816 3.384
130 1HA GLY 19 2HA GLY 19 12.005 -3.100 4.080
131 2HA GLY 19 1HA GLY 19 10.789 -2.753 5.306
132 H ARG 20 H ARG 20 10.042 -1.570 2.135
133 HA ARG 20 HA ARG 20 8.476 -4.012 1.482
134 1HB ARG 20 2HB ARG 20 7.114 -1.356 1.183
135 2HB ARG 20 1HB ARG 20 6.405 -2.955 1.383
136 1HG ARG 20 2HG ARG 20 8.016 -1.780 3.632
137 2HG ARG 20 1HG ARG 20 6.361 -1.234 3.380
138 1HD ARG 20 2HD ARG 20 6.059 -3.950 3.179
139 2HD ARG 20 1HD ARG 20 7.351 -3.831 4.374
140 HE ARG 20 HE ARG 20 4.589 -2.797 4.703
141 1HH1 ARG 20 1HH2 ARG 20 7.110 -1.201 5.782
142 2HH1 ARG 20 2HH2 ARG 20 7.033 -1.664 7.447
143 1HH2 ARG 20 2HH1 ARG 20 4.792 -4.263 6.894
144 2HH2 ARG 20 1HH1 ARG 20 5.716 -3.403 8.080
145 H CYS 21 H CYS 21 8.143 -4.292 -0.748
146 HA CYS 21 HA CYS 21 9.686 -2.430 -2.490
147 1HB CYS 21 2HB CYS 21 9.503 -5.251 -2.382
148 2HB CYS 21 1HB CYS 21 8.699 -4.764 -3.875
149 H GLY 22 H GLY 22 6.550 -4.142 -2.371
150 1HA GLY 22 2HA GLY 22 5.364 -1.897 -3.930
151 2HA GLY 22 1HA GLY 22 5.054 -3.558 -4.433
152 H GLY 23 H GLY 23 2.753 -2.645 -3.978
153 1HA GLY 23 2HA GLY 23 1.813 -3.828 -1.513
154 2HA GLY 23 1HA GLY 23 1.763 -2.072 -1.419
155 H TYR 24 H TYR 24 -0.567 -3.535 -1.244
156 HA TYR 24 HA TYR 24 -2.003 -2.650 -3.690
157 1HB TYR 24 2HB TYR 24 -3.206 -4.743 -3.900
158 2HB TYR 24 1HB TYR 24 -1.483 -5.115 -3.895
159 HD1 TYR 24 HD1 TYR 24 -4.650 -5.450 -2.109
160 HD2 TYR 24 HD2 TYR 24 -0.402 -6.030 -1.833
161 HE1 TYR 24 HE1 TYR 24 -4.977 -6.913 -0.135
162 HE2 TYR 24 HE2 TYR 24 -0.732 -7.494 0.142
163 HH TYR 24 HH TYR 24 -3.343 -7.553 1.964
164 H CYS 25 H CYS 25 -4.410 -2.576 -3.277
165 HA CYS 25 HA CYS 25 -4.914 -1.595 -0.535
166 1HB CYS 25 2HB CYS 25 -6.565 -1.548 -3.076
167 2HB CYS 25 1HB CYS 25 -7.160 -0.955 -1.526
168 H GLY 26 H GLY 26 -5.453 -3.162 0.928
169 1HA GLY 26 2HA GLY 26 -7.784 -4.832 0.508
170 2HA GLY 26 1HA GLY 26 -6.297 -5.773 0.425
171 H GLY 27 H GLY 27 -8.508 -5.729 2.462
172 1HA GLY 27 2HA GLY 27 -7.737 -6.536 4.769
173 2HA GLY 27 1HA GLY 27 -6.898 -4.989 4.873
174 H TRP 28 H TRP 28 -8.151 -3.063 5.083
175 HA TRP 28 HA TRP 28 -10.761 -3.504 6.379
176 1HB TRP 28 2HB TRP 28 -9.028 -1.964 7.353
177 2HB TRP 28 1HB TRP 28 -9.257 -0.903 5.965
178 HD1 TRP 28 HD1 TRP 28 -11.219 -2.363 8.943
179 HE1 TRP 28 HE1 TRP 28 -13.153 -0.759 9.504
180 HE3 TRP 28 HE3 TRP 28 -10.741 0.975 5.107
181 HZ2 TRP 28 HZ2 TRP 28 -14.342 1.625 8.468
182 HZ3 TRP 28 HZ3 TRP 28 -12.286 2.902 4.921
183 HH2 TRP 28 HH2 TRP 28 -14.087 3.230 6.593
184 H HIS 29 H HIS 29 -12.153 -4.005 4.665
185 HA HIS 29 HA HIS 29 -13.610 -3.592 2.887
186 1HB HIS 29 2HB HIS 29 -13.052 -0.691 3.579
187 2HB HIS 29 1HB HIS 29 -14.450 -1.303 2.702
188 HD1 HIS 29 HD1 HIS 29 -14.502 0.195 5.545
189 HD2 HIS 29 HD2 HIS 29 -14.852 -3.909 4.923
190 HE1 HIS 29 HE1 HIS 29 -15.649 -0.744 7.598
191 H ARG 30 H ARG 30 -10.709 -3.814 2.329
192 HA ARG 30 HA ARG 30 -9.257 -3.595 0.508
193 1HB ARG 30 2HB ARG 30 -11.397 -4.279 -0.685
194 2HB ARG 30 1HB ARG 30 -11.672 -2.567 -1.004
195 1HG ARG 30 2HG ARG 30 -9.931 -2.421 -2.508
196 2HG ARG 30 1HG ARG 30 -8.988 -3.670 -1.696
197 1HD ARG 30 2HD ARG 30 -11.563 -4.358 -3.104
198 2HD ARG 30 1HD ARG 30 -10.049 -4.241 -3.999
199 HE ARG 30 HE ARG 30 -10.808 -6.479 -2.443
200 1HH1 ARG 30 1HH2 ARG 30 -8.255 -5.729 -4.216
201 2HH1 ARG 30 2HH2 ARG 30 -7.017 -6.240 -3.118
202 1HH2 ARG 30 2HH1 ARG 30 -9.173 -6.534 -0.407
203 2HH2 ARG 30 1HH1 ARG 30 -7.539 -6.702 -0.958
204 H LEU 31 H LEU 31 -9.803 -1.276 2.353
205 HA LEU 31 HA LEU 31 -9.061 0.964 0.523
206 1HB LEU 31 2HB LEU 31 -10.307 1.035 3.285
207 2HB LEU 31 1HB LEU 31 -9.835 2.460 2.361
208 HG LEU 31 HG LEU 31 -11.678 0.408 1.151
209 1HD1 LEU 31 1HD1 LEU 31 -13.597 1.675 1.992
210 2HD1 LEU 31 2HD1 LEU 31 -12.519 2.769 2.859
211 3HD1 LEU 31 3HD1 LEU 31 -12.637 1.079 3.346
212 1HD2 LEU 31 1HD2 LEU 31 -11.235 3.387 0.776
213 2HD2 LEU 31 2HD2 LEU 31 -12.464 2.447 -0.072
214 3HD2 LEU 31 3HD2 LEU 31 -10.754 2.105 -0.336
215 H ARG 32 H ARG 32 -7.801 -1.145 2.902
216 HA ARG 32 HA ARG 32 -5.785 0.783 3.877
217 1HB ARG 32 2HB ARG 32 -6.926 -1.093 5.281
218 2HB ARG 32 1HB ARG 32 -5.788 -2.172 4.474
219 1HG ARG 32 2HG ARG 32 -3.926 -0.651 5.226
220 2HG ARG 32 1HG ARG 32 -5.112 0.244 6.176
221 1HD ARG 32 2HD ARG 32 -4.841 -2.742 6.480
222 2HD ARG 32 1HD ARG 32 -3.769 -1.648 7.353
223 HE ARG 32 HE ARG 32 -6.622 -1.026 7.652
224 1HH1 ARG 32 1HH2 ARG 32 -5.826 -3.882 8.602
225 2HH1 ARG 32 2HH2 ARG 32 -5.570 -3.582 10.289
226 1HH2 ARG 32 2HH1 ARG 32 -5.437 -0.127 9.920
227 2HH2 ARG 32 1HH1 ARG 32 -5.349 -1.446 11.037
228 H CYS 33 H CYS 33 -3.570 0.632 3.367
229 HA CYS 33 HA CYS 33 -2.978 -0.846 0.866
230 1HB CYS 33 2HB CYS 33 -1.786 1.498 2.284
231 2HB CYS 33 1HB CYS 33 -0.725 0.528 1.263
232 H THR 34 H THR 34 -2.340 -2.922 1.244
233 HA THR 34 HA THR 34 -0.614 -3.523 3.584
234 HB THR 34 HB THR 34 -1.983 -5.352 1.583
235 HG1 THR 34 HG1 THR 34 -2.541 -4.824 4.316
236 1HG2 THR 34 1HG2 THR 34 -0.057 -6.506 2.401
237 2HG2 THR 34 2HG2 THR 34 -1.415 -7.098 3.358
238 3HG2 THR 34 3HG2 THR 34 -0.308 -5.906 4.040
239 H CYS 35 H CYS 35 1.545 -3.345 3.227
240 HA CYS 35 HA CYS 35 2.601 -3.724 0.473
241 1HB CYS 35 2HB CYS 35 4.264 -2.820 2.807
242 2HB CYS 35 1HB CYS 35 4.446 -2.430 1.100
243 H TYR 36 H TYR 36 4.632 -4.979 0.215
244 HA TYR 36 HA TYR 36 4.933 -7.138 2.259
245 1HB TYR 36 2HB TYR 36 5.468 -8.618 0.167
246 2HB TYR 36 1HB TYR 36 3.787 -8.309 0.590
247 HD1 TYR 36 HD1 TYR 36 6.546 -7.370 -1.707
248 HD2 TYR 36 HD2 TYR 36 2.363 -6.958 -0.811
249 HE1 TYR 36 HE1 TYR 36 6.168 -6.347 -3.935
250 HE2 TYR 36 HE2 TYR 36 1.987 -5.935 -3.037
251 HH TYR 36 HH TYR 36 3.510 -6.185 -5.457
252 H ARG 37 H ARG 37 7.050 -8.151 2.293
253 HA ARG 37 HA ARG 37 9.232 -6.301 2.012
254 1HB ARG 37 2HB ARG 37 9.211 -9.309 2.406
255 2HB ARG 37 1HB ARG 37 10.656 -8.306 2.516
256 1HG ARG 37 2HG ARG 37 8.519 -7.183 4.122
257 2HG ARG 37 1HG ARG 37 8.822 -8.858 4.581
258 1HD ARG 37 2HD ARG 37 11.377 -7.836 4.268
259 2HD ARG 37 1HD ARG 37 10.496 -6.483 4.980
260 HE ARG 37 HE ARG 37 10.605 -9.203 6.233
261 1HH1 ARG 37 2HH1 ARG 37 12.529 -7.271 7.327
262 2HH1 ARG 37 1HH1 ARG 37 11.648 -6.516 8.612
263 1HH2 ARG 37 1HH2 ARG 37 8.546 -7.585 7.465
264 2HH2 ARG 37 2HH2 ARG 37 9.385 -6.696 8.691
265 H CYS 38 H CYS 38 11.121 -6.568 0.614
266 HA CYS 38 HA CYS 38 10.335 -7.323 -2.132
267 1HB CYS 38 2HB CYS 38 11.675 -5.181 -1.328
268 2HB CYS 38 1HB CYS 38 13.056 -6.269 -1.458
269 H GLY 39 HN GLY 39 10.880 -9.256 -2.987
270 1HA GLY 39 2HA GLY 39 12.756 -11.016 -1.533
271 2HA GLY 39 1HA GLY 39 11.704 -11.501 -2.863
Start of MODEL 3
1 1H GLY 1 1H GLY 1 -8.176 4.566 1.369
2 2H GLY 1 2H GLY 1 -8.483 4.449 3.035
3 3H GLY 1 3H GLY 1 -7.357 3.408 2.301
4 1HA GLY 1 2HA GLY 1 -7.017 6.353 2.325
5 2HA GLY 1 1HA GLY 1 -6.394 5.320 3.610
6 H PHE 2 H PHE 2 -4.494 6.674 2.347
7 HA PHE 2 HA PHE 2 -2.488 6.477 1.153
8 1HB PHE 2 2HB PHE 2 -3.077 3.510 1.060
9 2HB PHE 2 1HB PHE 2 -1.502 4.296 1.021
10 HD1 PHE 2 HD1 PHE 2 -3.820 2.646 3.090
11 HD2 PHE 2 HD2 PHE 2 -1.033 5.915 3.105
12 HE1 PHE 2 HE1 PHE 2 -3.713 2.543 5.565
13 HE2 PHE 2 HE2 PHE 2 -0.928 5.812 5.581
14 HZ PHE 2 HZ PHE 2 -2.268 4.125 6.810
15 H GLY 3 H GLY 3 -5.024 6.847 -0.328
16 1HA GLY 3 2HA GLY 3 -5.609 7.078 -2.582
17 2HA GLY 3 1HA GLY 3 -4.020 6.445 -3.006
18 H CYS 4 H CYS 4 -6.635 4.912 -1.110
19 HA CYS 4 HA CYS 4 -6.499 2.595 -2.980
20 1HB CYS 4 2HB CYS 4 -7.285 2.916 -0.099
21 2HB CYS 4 1HB CYS 4 -7.946 1.569 -1.024
22 HA PRO 5 HA PRO 5 -7.856 0.738 -2.852
23 1HB PRO 5 2HB PRO 5 -9.249 -0.504 -4.864
24 2HB PRO 5 1HB PRO 5 -9.825 -0.397 -3.192
25 1HG PRO 5 2HG PRO 5 -10.769 1.084 -5.596
26 2HG PRO 5 1HG PRO 5 -11.636 0.707 -4.098
27 1HD PRO 5 2HD PRO 5 -10.459 3.205 -4.783
28 2HD PRO 5 1HD PRO 5 -11.110 2.741 -3.198
29 H ASN 6 H ASN 6 -7.380 3.205 -4.878
30 HA ASN 6 HA ASN 6 -6.557 2.156 -7.379
31 1HB ASN 6 2HB ASN 6 -6.722 4.626 -6.564
32 2HB ASN 6 1HB ASN 6 -5.061 4.390 -6.018
33 1HD2 ASN 6 1HD2 ASN 6 -6.976 5.169 -8.752
34 2HD2 ASN 6 2HD2 ASN 6 -5.765 5.010 -9.930
35 H ASN 7 H ASN 7 -4.892 0.844 -7.931
36 HA ASN 7 HA ASN 7 -3.043 -0.134 -5.902
37 1HB ASN 7 2HB ASN 7 -3.513 -0.706 -8.814
38 2HB ASN 7 1HB ASN 7 -2.038 -1.285 -8.038
39 1HD2 ASN 7 1HD2 ASN 7 -2.395 -2.623 -5.974
40 2HD2 ASN 7 2HD2 ASN 7 -3.787 -3.589 -5.890
41 H TYR 8 H TYR 8 -2.875 2.197 -8.552
42 HA TYR 8 HA TYR 8 -0.012 2.428 -8.644
43 1HB TYR 8 2HB TYR 8 -1.574 3.327 -10.395
44 2HB TYR 8 1HB TYR 8 -2.073 4.574 -9.253
45 HD1 TYR 8 HD1 TYR 8 -0.727 6.501 -8.853
46 HD2 TYR 8 HD2 TYR 8 0.840 3.214 -11.133
47 HE1 TYR 8 HE1 TYR 8 1.222 7.885 -9.507
48 HE2 TYR 8 HE2 TYR 8 2.790 4.599 -11.786
49 HH TYR 8 HH TYR 8 3.681 7.365 -10.257
50 H GLN 9 H GLN 9 -2.501 4.372 -6.950
51 HA GLN 9 HA GLN 9 -0.602 5.994 -5.517
52 1HB GLN 9 2HB GLN 9 -3.510 5.334 -4.973
53 2HB GLN 9 1HB GLN 9 -2.580 6.498 -4.029
54 1HG GLN 9 2HG GLN 9 -2.428 6.861 -6.962
55 2HG GLN 9 1HG GLN 9 -4.016 7.156 -6.255
56 1HE2 GLN 9 1HE2 GLN 9 -4.191 9.394 -5.949
57 2HE2 GLN 9 2HE2 GLN 9 -2.987 10.372 -5.261
58 H CYS 10 H CYS 10 -2.340 2.984 -4.729
59 HA CYS 10 HA CYS 10 -1.453 2.732 -2.028
60 1HB CYS 10 2HB CYS 10 -3.214 1.322 -3.261
61 2HB CYS 10 1HB CYS 10 -1.859 0.399 -3.908
62 H HIS 11 H HIS 11 -0.028 1.646 -5.101
63 HA HIS 11 HA HIS 11 2.239 0.296 -4.002
64 1HB HIS 11 2HB HIS 11 1.603 0.007 -6.345
65 2HB HIS 11 1HB HIS 11 1.875 1.718 -6.659
66 HD1 HIS 11 HD1 HIS 11 4.168 -0.558 -4.664
67 HD2 HIS 11 HD2 HIS 11 4.147 1.531 -8.268
68 HE1 HIS 11 HE1 HIS 11 6.502 -0.764 -5.619
69 H ARG 12 H ARG 12 1.709 3.679 -4.968
70 HA ARG 12 HA ARG 12 4.358 4.640 -4.565
71 1HB ARG 12 2HB ARG 12 2.292 5.836 -5.590
72 2HB ARG 12 1HB ARG 12 1.901 6.274 -3.928
73 1HG ARG 12 2HG ARG 12 3.916 7.507 -3.663
74 2HG ARG 12 1HG ARG 12 4.634 6.794 -5.107
75 1HD ARG 12 2HD ARG 12 3.807 8.472 -6.353
76 2HD ARG 12 1HD ARG 12 2.170 8.025 -5.872
77 HE ARG 12 HE ARG 12 2.205 9.775 -4.263
78 1HH1 ARG 12 2HH1 ARG 12 4.132 10.914 -6.433
79 2HH1 ARG 12 1HH1 ARG 12 5.377 11.564 -5.418
80 1HH2 ARG 12 1HH2 ARG 12 4.315 9.855 -2.581
81 2HH2 ARG 12 2HH2 ARG 12 5.483 10.958 -3.228
82 H HIS 13 H HIS 13 1.631 4.300 -2.290
83 HA HIS 13 HA HIS 13 2.947 5.503 -0.038
84 1HB HIS 13 2HB HIS 13 0.541 5.221 -0.001
85 2HB HIS 13 1HB HIS 13 0.695 3.476 -0.204
86 HD1 HIS 13 HD1 HIS 13 2.129 6.036 2.259
87 HD2 HIS 13 HD2 HIS 13 0.417 2.237 2.234
88 HE1 HIS 13 HE1 HIS 13 2.070 5.260 4.670
89 H CYS 14 H CYS 14 2.665 2.105 -1.116
90 HA CYS 14 HA CYS 14 4.079 0.930 1.065
91 1HB CYS 14 2HB CYS 14 3.787 0.054 -1.818
92 2HB CYS 14 1HB CYS 14 4.536 -0.941 -0.569
93 H LYS 15 H LYS 15 5.227 2.389 -1.962
94 HA LYS 15 HA LYS 15 7.979 1.605 -1.668
95 1HB LYS 15 2HB LYS 15 6.557 3.750 -3.236
96 2HB LYS 15 1HB LYS 15 8.320 3.699 -3.188
97 1HG LYS 15 2HG LYS 15 8.119 1.233 -3.855
98 2HG LYS 15 1HG LYS 15 6.427 1.575 -4.215
99 1HD LYS 15 2HD LYS 15 8.662 3.242 -5.377
100 2HD LYS 15 1HD LYS 15 8.099 1.769 -6.166
101 1HE LYS 15 2HE LYS 15 6.274 2.814 -6.975
102 2HE LYS 15 1HE LYS 15 5.854 3.431 -5.377
103 1HZ LYS 15 1HZ LYS 15 7.564 4.655 -7.445
104 2HZ LYS 15 2HZ LYS 15 7.756 5.083 -5.810
105 3HZ LYS 15 3HZ LYS 15 6.267 5.337 -6.590
106 H SER 16 H SER 16 6.096 4.385 -0.508
107 HA SER 16 HA SER 16 8.329 5.900 0.481
108 1HB SER 16 2HB SER 16 6.728 7.273 1.566
109 2HB SER 16 1HB SER 16 5.898 6.690 0.131
110 HG SER 16 HG SER 16 5.019 5.012 1.512
111 H ILE 17 H ILE 17 6.524 3.169 1.747
112 HA ILE 17 HA ILE 17 7.576 3.400 4.462
113 HB ILE 17 HB ILE 17 6.278 1.028 3.074
114 1HG1 ILE 17 2HG1 ILE 17 4.911 2.841 5.046
115 2HG1 ILE 17 1HG1 ILE 17 4.999 3.315 3.350
116 1HG2 ILE 17 1HG2 ILE 17 7.464 0.298 5.042
117 2HG2 ILE 17 2HG2 ILE 17 5.754 0.387 5.468
118 3HG2 ILE 17 3HG2 ILE 17 6.859 1.663 5.980
119 1HD1 ILE 17 1HD1 ILE 17 4.218 0.517 3.680
120 2HD1 ILE 17 2HD1 ILE 17 3.441 1.796 2.745
121 3HD1 ILE 17 3HD1 ILE 17 3.094 1.626 4.466
122 HA PRO 18 HA PRO 18 11.464 1.550 3.384
123 1HB PRO 18 2HB PRO 18 12.424 1.395 5.957
124 2HB PRO 18 1HB PRO 18 12.404 2.886 5.001
125 1HG PRO 18 2HG PRO 18 10.632 2.081 7.262
126 2HG PRO 18 1HG PRO 18 11.093 3.703 6.721
127 1HD PRO 18 2HD PRO 18 8.629 2.429 6.191
128 2HD PRO 18 1HD PRO 18 9.248 3.879 5.371
129 H GLY 19 H GLY 19 12.041 -0.571 3.103
130 1HA GLY 19 2HA GLY 19 12.404 -2.841 3.849
131 2HA GLY 19 1HA GLY 19 11.175 -2.605 5.088
132 H ARG 20 H ARG 20 9.661 -1.271 2.555
133 HA ARG 20 HA ARG 20 8.459 -3.879 1.727
134 1HB ARG 20 2HB ARG 20 7.189 -1.147 1.460
135 2HB ARG 20 1HB ARG 20 6.402 -2.717 1.335
136 1HG ARG 20 2HG ARG 20 7.818 -1.961 3.880
137 2HG ARG 20 1HG ARG 20 6.193 -1.352 3.565
138 1HD ARG 20 2HD ARG 20 5.776 -3.928 2.943
139 2HD ARG 20 1HD ARG 20 7.104 -4.144 4.084
140 HE ARG 20 HE ARG 20 4.741 -2.515 4.894
141 1HH1 ARG 20 1HH2 ARG 20 4.024 -5.336 5.112
142 2HH1 ARG 20 2HH2 ARG 20 4.608 -5.786 6.679
143 1HH2 ARG 20 2HH1 ARG 20 6.723 -3.036 6.963
144 2HH2 ARG 20 1HH1 ARG 20 6.148 -4.476 7.732
145 H CYS 21 H CYS 21 7.997 -4.222 -0.498
146 HA CYS 21 HA CYS 21 9.586 -2.501 -2.353
147 1HB CYS 21 2HB CYS 21 9.360 -5.340 -2.065
148 2HB CYS 21 1HB CYS 21 8.681 -4.897 -3.631
149 H GLY 22 H GLY 22 6.568 -4.431 -2.338
150 1HA GLY 22 2HA GLY 22 5.245 -2.221 -3.834
151 2HA GLY 22 1HA GLY 22 5.086 -3.879 -4.410
152 H GLY 23 H GLY 23 2.714 -2.877 -3.900
153 1HA GLY 23 2HA GLY 23 1.774 -4.379 -1.594
154 2HA GLY 23 1HA GLY 23 1.660 -2.641 -1.343
155 H TYR 24 H TYR 24 -0.689 -3.530 -1.206
156 HA TYR 24 HA TYR 24 -2.052 -2.769 -3.692
157 1HB TYR 24 2HB TYR 24 -3.287 -4.840 -3.963
158 2HB TYR 24 1HB TYR 24 -1.569 -5.236 -3.946
159 HD1 TYR 24 HD1 TYR 24 -4.761 -5.644 -2.270
160 HD2 TYR 24 HD2 TYR 24 -0.515 -6.123 -1.825
161 HE1 TYR 24 HE1 TYR 24 -5.133 -7.129 -0.321
162 HE2 TYR 24 HE2 TYR 24 -0.890 -7.609 0.126
163 HH TYR 24 HH TYR 24 -3.576 -7.744 1.838
164 H CYS 25 H CYS 25 -4.483 -2.713 -3.303
165 HA CYS 25 HA CYS 25 -4.997 -1.794 -0.534
166 1HB CYS 25 2HB CYS 25 -6.671 -1.639 -3.059
167 2HB CYS 25 1HB CYS 25 -7.173 -1.001 -1.493
168 H GLY 26 H GLY 26 -5.598 -3.392 0.862
169 1HA GLY 26 2HA GLY 26 -7.962 -4.990 0.365
170 2HA GLY 26 1HA GLY 26 -6.501 -5.966 0.245
171 H GLY 27 H GLY 27 -8.766 -5.798 2.300
172 1HA GLY 27 2HA GLY 27 -8.072 -6.766 4.572
173 2HA GLY 27 1HA GLY 27 -7.082 -5.315 4.727
174 H TRP 28 H TRP 28 -8.130 -3.290 5.054
175 HA TRP 28 HA TRP 28 -10.728 -3.503 6.394
176 1HB TRP 28 2HB TRP 28 -8.836 -2.067 7.246
177 2HB TRP 28 1HB TRP 28 -9.084 -1.011 5.857
178 HD1 TRP 28 HD1 TRP 28 -10.915 -2.292 8.990
179 HE1 TRP 28 HE1 TRP 28 -12.729 -0.580 9.631
180 HE3 TRP 28 HE3 TRP 28 -10.548 0.910 5.030
181 HZ2 TRP 28 HZ2 TRP 28 -13.873 1.830 8.604
182 HZ3 TRP 28 HZ3 TRP 28 -12.009 2.906 4.888
183 HH2 TRP 28 HH2 TRP 28 -13.672 3.368 6.667
184 H HIS 29 H HIS 29 -12.182 -3.975 4.701
185 HA HIS 29 HA HIS 29 -13.668 -3.501 2.962
186 1HB HIS 29 2HB HIS 29 -12.972 -0.616 3.588
187 2HB HIS 29 1HB HIS 29 -14.438 -1.200 2.808
188 HD1 HIS 29 HD1 HIS 29 -14.230 0.360 5.628
189 HD2 HIS 29 HD2 HIS 29 -14.842 -3.727 5.097
190 HE1 HIS 29 HE1 HIS 29 -15.303 -0.487 7.761
191 H ARG 30 H ARG 30 -10.786 -3.843 2.343
192 HA ARG 30 HA ARG 30 -9.351 -3.667 0.505
193 1HB ARG 30 2HB ARG 30 -11.529 -4.323 -0.645
194 2HB ARG 30 1HB ARG 30 -11.761 -2.610 -0.994
195 1HG ARG 30 2HG ARG 30 -10.039 -2.542 -2.523
196 2HG ARG 30 1HG ARG 30 -9.112 -3.788 -1.691
197 1HD ARG 30 2HD ARG 30 -9.889 -4.767 -3.739
198 2HD ARG 30 1HD ARG 30 -10.872 -5.455 -2.447
199 HE ARG 30 HE ARG 30 -12.728 -4.498 -3.516
200 1HH1 ARG 30 2HH1 ARG 30 -10.469 -3.787 -5.684
201 2HH1 ARG 30 1HH1 ARG 30 -10.981 -2.178 -6.067
202 1HH2 ARG 30 1HH2 ARG 30 -13.158 -1.947 -3.366
203 2HH2 ARG 30 2HH2 ARG 30 -12.519 -1.137 -4.757
204 H LEU 31 H LEU 31 -9.721 -1.364 2.338
205 HA LEU 31 HA LEU 31 -8.996 0.862 0.479
206 1HB LEU 31 2HB LEU 31 -10.228 0.974 3.247
207 2HB LEU 31 1HB LEU 31 -9.719 2.386 2.320
208 HG LEU 31 HG LEU 31 -11.636 0.377 1.143
209 1HD1 LEU 31 1HD1 LEU 31 -12.532 1.169 3.340
210 2HD1 LEU 31 2HD1 LEU 31 -13.499 1.708 1.968
211 3HD1 LEU 31 3HD1 LEU 31 -12.392 2.828 2.759
212 1HD2 LEU 31 1HD2 LEU 31 -11.036 3.317 0.685
213 2HD2 LEU 31 2HD2 LEU 31 -12.346 2.442 -0.110
214 3HD2 LEU 31 3HD2 LEU 31 -10.670 1.978 -0.406
215 H ARG 32 H ARG 32 -7.773 -1.243 2.894
216 HA ARG 32 HA ARG 32 -5.719 0.650 3.845
217 1HB ARG 32 2HB ARG 32 -6.833 -1.147 5.305
218 2HB ARG 32 1HB ARG 32 -5.851 -2.316 4.422
219 1HG ARG 32 2HG ARG 32 -3.821 -0.926 5.047
220 2HG ARG 32 1HG ARG 32 -4.875 -0.008 6.123
221 1HD ARG 32 2HD ARG 32 -5.233 -1.829 7.544
222 2HD ARG 32 1HD ARG 32 -4.828 -3.009 6.296
223 HE ARG 32 HE ARG 32 -2.440 -1.706 6.659
224 1HH1 ARG 32 2HH1 ARG 32 -3.422 -4.466 7.809
225 2HH1 ARG 32 1HH1 ARG 32 -2.863 -4.313 9.441
226 1HH2 ARG 32 1HH2 ARG 32 -2.288 -0.890 9.197
227 2HH2 ARG 32 2HH2 ARG 32 -2.219 -2.278 10.230
228 H CYS 33 H CYS 33 -3.540 0.538 3.266
229 HA CYS 33 HA CYS 33 -2.959 -0.940 0.772
230 1HB CYS 33 2HB CYS 33 -1.757 1.373 2.217
231 2HB CYS 33 1HB CYS 33 -0.671 0.386 1.239
232 H THR 34 H THR 34 -2.513 -3.067 1.254
233 HA THR 34 HA THR 34 -0.753 -3.719 3.537
234 HB THR 34 HB THR 34 -2.187 -5.473 1.517
235 HG1 THR 34 HG1 THR 34 -2.620 -5.027 4.287
236 1HG2 THR 34 1HG2 THR 34 -0.160 -6.593 2.270
237 2HG2 THR 34 2HG2 THR 34 -1.551 -7.330 3.064
238 3HG2 THR 34 3HG2 THR 34 -0.530 -6.198 3.948
239 H CYS 35 H CYS 35 1.384 -3.431 3.154
240 HA CYS 35 HA CYS 35 2.465 -4.017 0.437
241 1HB CYS 35 2HB CYS 35 4.043 -2.708 2.640
242 2HB CYS 35 1HB CYS 35 4.225 -2.536 0.895
243 H TYR 36 H TYR 36 4.335 -5.375 0.230
244 HA TYR 36 HA TYR 36 4.736 -7.206 2.561
245 1HB TYR 36 2HB TYR 36 5.676 -8.732 0.602
246 2HB TYR 36 1HB TYR 36 3.951 -8.662 0.948
247 HD1 TYR 36 HD1 TYR 36 2.402 -7.646 -0.591
248 HD2 TYR 36 HD2 TYR 36 6.634 -7.438 -1.304
249 HE1 TYR 36 HE1 TYR 36 1.974 -6.833 -2.891
250 HE2 TYR 36 HE2 TYR 36 6.203 -6.626 -3.607
251 HH TYR 36 HH TYR 36 3.172 -5.522 -4.634
252 H ARG 37 H ARG 37 6.893 -7.996 2.949
253 HA ARG 37 HA ARG 37 8.939 -5.980 2.702
254 1HB ARG 37 2HB ARG 37 9.062 -8.889 3.546
255 2HB ARG 37 1HB ARG 37 10.431 -7.782 3.646
256 1HG ARG 37 2HG ARG 37 9.072 -6.275 5.091
257 2HG ARG 37 1HG ARG 37 7.760 -7.451 5.044
258 1HD ARG 37 2HD ARG 37 8.731 -8.349 6.885
259 2HD ARG 37 1HD ARG 37 9.918 -9.013 5.764
260 HE ARG 37 HE ARG 37 10.636 -7.262 7.767
261 1HH1 ARG 37 2HH1 ARG 37 12.257 -8.183 5.243
262 2HH1 ARG 37 1HH1 ARG 37 12.866 -6.651 4.712
263 1HH2 ARG 37 1HH2 ARG 37 10.688 -4.806 6.702
264 2HH2 ARG 37 2HH2 ARG 37 11.969 -4.730 5.540
265 H CYS 38 H CYS 38 10.809 -5.973 1.406
266 HA CYS 38 HA CYS 38 10.562 -7.443 -1.143
267 1HB CYS 38 2HB CYS 38 11.266 -4.918 -0.741
268 2HB CYS 38 1HB CYS 38 12.866 -5.629 -0.537
269 H GLY 39 HN GLY 39 11.611 -9.330 -1.477
270 1HA GLY 39 2HA GLY 39 13.943 -9.996 0.272
271 2HA GLY 39 1HA GLY 39 12.858 -11.197 -0.427
Start of MODEL 4
1 1H GLY 1 1H GLY 1 -7.465 3.402 2.546
2 2H GLY 1 2H GLY 1 -8.317 4.545 1.621
3 3H GLY 1 3H GLY 1 -8.609 4.411 3.289
4 1HA GLY 1 2HA GLY 1 -7.176 6.347 2.525
5 2HA GLY 1 1HA GLY 1 -6.577 5.369 3.865
6 H PHE 2 H PHE 2 -4.600 6.627 2.720
7 HA PHE 2 HA PHE 2 -2.554 6.402 1.601
8 1HB PHE 2 2HB PHE 2 -3.254 3.455 1.505
9 2HB PHE 2 1HB PHE 2 -1.643 4.165 1.425
10 HD1 PHE 2 HD1 PHE 2 -4.187 2.864 3.581
11 HD2 PHE 2 HD2 PHE 2 -0.878 5.601 3.449
12 HE1 PHE 2 HE1 PHE 2 -4.042 2.809 6.055
13 HE2 PHE 2 HE2 PHE 2 -0.734 5.546 5.925
14 HZ PHE 2 HZ PHE 2 -2.316 4.149 7.228
15 H GLY 3 H GLY 3 -5.062 6.794 0.019
16 1HA GLY 3 2HA GLY 3 -5.518 7.081 -2.260
17 2HA GLY 3 1HA GLY 3 -3.925 6.415 -2.620
18 H CYS 4 H CYS 4 -6.562 4.858 -0.795
19 HA CYS 4 HA CYS 4 -6.469 2.614 -2.753
20 1HB CYS 4 2HB CYS 4 -7.281 2.828 0.138
21 2HB CYS 4 1HB CYS 4 -7.870 1.493 -0.848
22 HA PRO 5 HA PRO 5 -7.912 0.742 -2.558
23 1HB PRO 5 2HB PRO 5 -9.333 -0.451 -4.582
24 2HB PRO 5 1HB PRO 5 -9.911 -0.334 -2.912
25 1HG PRO 5 2HG PRO 5 -10.796 1.193 -5.312
26 2HG PRO 5 1HG PRO 5 -11.685 0.824 -3.826
27 1HD PRO 5 2HD PRO 5 -10.448 3.298 -4.471
28 2HD PRO 5 1HD PRO 5 -11.099 2.826 -2.887
29 H ASN 6 H ASN 6 -7.408 3.200 -4.603
30 HA ASN 6 HA ASN 6 -6.555 2.119 -7.078
31 1HB ASN 6 2HB ASN 6 -6.742 4.599 -6.289
32 2HB ASN 6 1HB ASN 6 -5.085 4.377 -5.727
33 1HD2 ASN 6 1HD2 ASN 6 -6.908 5.278 -8.434
34 2HD2 ASN 6 2HD2 ASN 6 -5.716 5.052 -9.621
35 H ASN 7 H ASN 7 -5.007 0.634 -7.457
36 HA ASN 7 HA ASN 7 -3.109 -0.181 -5.420
37 1HB ASN 7 2HB ASN 7 -3.593 -0.949 -8.290
38 2HB ASN 7 1HB ASN 7 -2.162 -1.530 -7.439
39 1HD2 ASN 7 1HD2 ASN 7 -2.443 -3.271 -5.978
40 2HD2 ASN 7 2HD2 ASN 7 -3.953 -3.927 -5.571
41 H TYR 8 H TYR 8 -2.981 1.957 -8.220
42 HA TYR 8 HA TYR 8 -0.115 2.155 -8.387
43 1HB TYR 8 2HB TYR 8 -1.831 2.951 -10.118
44 2HB TYR 8 1HB TYR 8 -2.081 4.353 -9.079
45 HD1 TYR 8 HD1 TYR 8 -0.520 6.151 -9.029
46 HD2 TYR 8 HD2 TYR 8 0.483 2.486 -11.031
47 HE1 TYR 8 HE1 TYR 8 1.489 7.231 -9.999
48 HE2 TYR 8 HE2 TYR 8 2.494 3.565 -12.000
49 HH TYR 8 HH TYR 8 3.919 6.096 -10.924
50 H GLN 9 H GLN 9 -2.567 4.225 -6.793
51 HA GLN 9 HA GLN 9 -0.671 5.971 -5.526
52 1HB GLN 9 2HB GLN 9 -3.450 5.276 -4.531
53 2HB GLN 9 1HB GLN 9 -2.530 6.736 -4.172
54 1HG GLN 9 2HG GLN 9 -2.572 6.639 -6.962
55 2HG GLN 9 1HG GLN 9 -4.191 6.121 -6.496
56 1HE2 GLN 9 1HE2 GLN 9 -1.911 8.831 -6.371
57 2HE2 GLN 9 2HE2 GLN 9 -3.040 9.983 -5.843
58 H CYS 10 H CYS 10 -2.328 3.005 -4.425
59 HA CYS 10 HA CYS 10 -1.273 2.955 -1.770
60 1HB CYS 10 2HB CYS 10 -3.115 1.476 -2.683
61 2HB CYS 10 1HB CYS 10 -1.868 0.539 -3.500
62 H HIS 11 H HIS 11 -0.024 1.672 -4.847
63 HA HIS 11 HA HIS 11 2.275 0.357 -3.778
64 1HB HIS 11 2HB HIS 11 1.294 0.250 -6.180
65 2HB HIS 11 1HB HIS 11 2.251 1.699 -6.481
66 HD1 HIS 11 HD1 HIS 11 3.007 -0.838 -7.995
67 HD2 HIS 11 HD2 HIS 11 4.647 0.150 -4.292
68 HE1 HIS 11 HE1 HIS 11 5.190 -2.112 -7.809
69 H ARG 12 H ARG 12 1.802 3.686 -4.975
70 HA ARG 12 HA ARG 12 4.485 4.588 -4.687
71 1HB ARG 12 2HB ARG 12 2.188 5.739 -5.563
72 2HB ARG 12 1HB ARG 12 2.326 6.504 -3.980
73 1HG ARG 12 2HG ARG 12 4.748 6.360 -5.746
74 2HG ARG 12 1HG ARG 12 3.518 7.580 -6.079
75 1HD ARG 12 2HD ARG 12 4.995 7.190 -3.457
76 2HD ARG 12 1HD ARG 12 5.224 8.517 -4.594
77 HE ARG 12 HE ARG 12 2.638 8.890 -4.067
78 1HH1 ARG 12 1HH2 ARG 12 4.524 10.479 -2.430
79 2HH1 ARG 12 2HH2 ARG 12 4.099 10.034 -0.810
80 1HH2 ARG 12 2HH1 ARG 12 2.357 7.186 -1.776
81 2HH2 ARG 12 1HH1 ARG 12 2.862 8.164 -0.439
82 H HIS 13 H HIS 13 1.811 4.420 -2.355
83 HA HIS 13 HA HIS 13 3.155 5.711 -0.174
84 1HB HIS 13 2HB HIS 13 0.748 5.413 -0.103
85 2HB HIS 13 1HB HIS 13 0.917 3.663 -0.230
86 HD1 HIS 13 HD1 HIS 13 2.405 6.313 2.100
87 HD2 HIS 13 HD2 HIS 13 0.603 2.559 2.265
88 HE1 HIS 13 HE1 HIS 13 2.345 5.654 4.545
89 H CYS 14 H CYS 14 2.835 2.265 -1.083
90 HA CYS 14 HA CYS 14 4.312 1.168 1.089
91 1HB CYS 14 2HB CYS 14 3.988 0.210 -1.769
92 2HB CYS 14 1HB CYS 14 4.746 -0.749 -0.497
93 H LYS 15 H LYS 15 5.379 2.503 -2.024
94 HA LYS 15 HA LYS 15 8.141 1.771 -1.812
95 1HB LYS 15 2HB LYS 15 6.820 4.102 -3.239
96 2HB LYS 15 1HB LYS 15 8.504 3.629 -3.454
97 1HG LYS 15 2HG LYS 15 7.039 1.252 -3.774
98 2HG LYS 15 1HG LYS 15 6.116 2.479 -4.642
99 1HD LYS 15 2HD LYS 15 8.353 3.192 -5.688
100 2HD LYS 15 1HD LYS 15 8.998 1.673 -5.063
101 1HE LYS 15 2HE LYS 15 6.472 1.192 -6.380
102 2HE LYS 15 1HE LYS 15 7.554 2.062 -7.466
103 1HZ LYS 15 1HZ LYS 15 7.748 -0.423 -7.500
104 2HZ LYS 15 2HZ LYS 15 8.397 -0.332 -5.933
105 3HZ LYS 15 3HZ LYS 15 9.201 0.410 -7.232
106 H SER 16 H SER 16 6.317 4.615 -0.682
107 HA SER 16 HA SER 16 8.576 6.117 0.240
108 1HB SER 16 2HB SER 16 7.013 7.532 1.319
109 2HB SER 16 1HB SER 16 6.139 6.910 -0.074
110 HG SER 16 HG SER 16 5.224 5.332 1.336
111 H ILE 17 H ILE 17 6.770 3.445 1.645
112 HA ILE 17 HA ILE 17 7.870 3.772 4.325
113 HB ILE 17 HB ILE 17 6.579 1.335 3.050
114 1HG1 ILE 17 2HG1 ILE 17 5.209 3.223 4.951
115 2HG1 ILE 17 1HG1 ILE 17 5.290 3.629 3.238
116 1HG2 ILE 17 1HG2 ILE 17 7.925 0.924 5.128
117 2HG2 ILE 17 2HG2 ILE 17 6.206 0.596 5.337
118 3HG2 ILE 17 3HG2 ILE 17 6.901 2.086 5.972
119 1HD1 ILE 17 1HD1 ILE 17 3.858 1.375 4.585
120 2HD1 ILE 17 2HD1 ILE 17 4.478 1.115 2.954
121 3HD1 ILE 17 3HD1 ILE 17 3.322 2.410 3.262
122 HA PRO 18 HA PRO 18 11.767 1.913 3.302
123 1HB PRO 18 2HB PRO 18 12.732 1.850 5.878
124 2HB PRO 18 1HB PRO 18 12.699 3.309 4.874
125 1HG PRO 18 2HG PRO 18 10.933 2.564 7.162
126 2HG PRO 18 1HG PRO 18 11.385 4.172 6.569
127 1HD PRO 18 2HD PRO 18 8.927 2.869 6.081
128 2HD PRO 18 1HD PRO 18 9.539 4.292 5.213
129 H GLY 19 H GLY 19 12.390 -0.215 3.122
130 1HA GLY 19 2HA GLY 19 12.715 -2.479 3.836
131 2HA GLY 19 1HA GLY 19 11.618 -2.190 5.184
132 H ARG 20 H ARG 20 10.569 -1.140 2.040
133 HA ARG 20 HA ARG 20 8.917 -3.600 1.715
134 1HB ARG 20 2HB ARG 20 7.914 -0.741 1.544
135 2HB ARG 20 1HB ARG 20 6.966 -2.171 1.140
136 1HG ARG 20 2HG ARG 20 8.212 -1.672 3.862
137 2HG ARG 20 1HG ARG 20 6.534 -1.307 3.461
138 1HD ARG 20 2HD ARG 20 6.661 -3.875 2.606
139 2HD ARG 20 1HD ARG 20 7.846 -3.936 3.907
140 HE ARG 20 HE ARG 20 5.005 -3.815 4.272
141 1HH1 ARG 20 2HH1 ARG 20 7.182 -4.607 6.286
142 2HH1 ARG 20 1HH1 ARG 20 6.945 -3.409 7.513
143 1HH2 ARG 20 1HH2 ARG 20 5.031 -1.335 5.481
144 2HH2 ARG 20 2HH2 ARG 20 5.709 -1.553 7.060
145 H CYS 21 H CYS 21 7.936 -3.683 -0.537
146 HA CYS 21 HA CYS 21 9.687 -2.299 -2.530
147 1HB CYS 21 2HB CYS 21 9.584 -5.064 -2.020
148 2HB CYS 21 1HB CYS 21 8.653 -4.834 -3.500
149 H GLY 22 H GLY 22 6.647 -4.184 -2.286
150 1HA GLY 22 2HA GLY 22 5.268 -2.035 -3.794
151 2HA GLY 22 1HA GLY 22 5.161 -3.680 -4.417
152 H GLY 23 H GLY 23 2.770 -2.614 -3.800
153 1HA GLY 23 2HA GLY 23 1.882 -4.276 -1.567
154 2HA GLY 23 1HA GLY 23 1.734 -2.552 -1.245
155 H TYR 24 H TYR 24 -0.594 -3.432 -1.108
156 HA TYR 24 HA TYR 24 -1.997 -2.648 -3.567
157 1HB TYR 24 2HB TYR 24 -3.266 -4.722 -3.791
158 2HB TYR 24 1HB TYR 24 -1.546 -5.089 -3.897
159 HD1 TYR 24 HD1 TYR 24 -4.609 -5.529 -1.975
160 HD2 TYR 24 HD2 TYR 24 -0.348 -6.071 -1.926
161 HE1 TYR 24 HE1 TYR 24 -4.831 -7.079 -0.054
162 HE2 TYR 24 HE2 TYR 24 -0.569 -7.623 -0.004
163 HH TYR 24 HH TYR 24 -3.192 -9.143 0.840
164 H CYS 25 H CYS 25 -4.490 -2.868 -3.103
165 HA CYS 25 HA CYS 25 -4.943 -1.880 -0.327
166 1HB CYS 25 2HB CYS 25 -6.630 -1.614 -2.834
167 2HB CYS 25 1HB CYS 25 -7.088 -0.993 -1.250
168 H GLY 26 H GLY 26 -5.830 -3.320 1.078
169 1HA GLY 26 2HA GLY 26 -8.118 -4.949 0.403
170 2HA GLY 26 1HA GLY 26 -6.657 -5.933 0.471
171 H GLY 27 H GLY 27 -9.132 -5.648 2.278
172 1HA GLY 27 2HA GLY 27 -8.617 -6.541 4.653
173 2HA GLY 27 1HA GLY 27 -7.722 -5.034 4.841
174 H TRP 28 H TRP 28 -8.881 -3.073 5.022
175 HA TRP 28 HA TRP 28 -11.660 -3.391 5.954
176 1HB TRP 28 2HB TRP 28 -9.989 -2.033 7.238
177 2HB TRP 28 1HB TRP 28 -9.923 -0.904 5.887
178 HD1 TRP 28 HD1 TRP 28 -12.413 -2.293 8.480
179 HE1 TRP 28 HE1 TRP 28 -14.267 -0.542 8.840
180 HE3 TRP 28 HE3 TRP 28 -11.106 1.127 4.919
181 HZ2 TRP 28 HZ2 TRP 28 -15.088 1.977 7.766
182 HZ3 TRP 28 HZ3 TRP 28 -12.439 3.192 4.612
183 HH2 TRP 28 HH2 TRP 28 -14.428 3.620 6.027
184 H HIS 29 H HIS 29 -12.892 -3.672 4.088
185 HA HIS 29 HA HIS 29 -14.057 -3.072 2.155
186 1HB HIS 29 2HB HIS 29 -13.347 -0.263 3.060
187 2HB HIS 29 1HB HIS 29 -14.654 -0.703 1.964
188 HD1 HIS 29 HD1 HIS 29 -14.990 0.672 4.848
189 HD2 HIS 29 HD2 HIS 29 -15.591 -3.355 3.963
190 HE1 HIS 29 HE1 HIS 29 -16.491 -0.245 6.670
191 H ARG 30 H ARG 30 -11.172 -3.582 1.927
192 HA ARG 30 HA ARG 30 -9.469 -3.434 0.334
193 1HB ARG 30 2HB ARG 30 -11.599 -3.790 -1.108
194 2HB ARG 30 1HB ARG 30 -11.452 -2.076 -1.485
195 1HG ARG 30 2HG ARG 30 -9.508 -2.364 -2.695
196 2HG ARG 30 1HG ARG 30 -8.996 -3.751 -1.736
197 1HD ARG 30 2HD ARG 30 -9.596 -4.637 -3.868
198 2HD ARG 30 1HD ARG 30 -10.939 -5.028 -2.796
199 HE ARG 30 HE ARG 30 -10.986 -3.009 -4.964
200 1HH1 ARG 30 2HH1 ARG 30 -12.848 -5.432 -4.022
201 2HH1 ARG 30 1HH1 ARG 30 -14.282 -4.532 -3.659
202 1HH2 ARG 30 1HH2 ARG 30 -12.682 -1.446 -3.741
203 2HH2 ARG 30 2HH2 ARG 30 -14.187 -2.268 -3.500
204 H LEU 31 H LEU 31 -9.961 -1.171 2.209
205 HA LEU 31 HA LEU 31 -8.874 1.080 0.579
206 1HB LEU 31 2HB LEU 31 -10.452 1.032 3.152
207 2HB LEU 31 1HB LEU 31 -9.575 2.467 2.621
208 HG LEU 31 HG LEU 31 -11.647 1.011 0.951
209 1HD1 LEU 31 1HD1 LEU 31 -12.857 2.012 2.728
210 2HD1 LEU 31 2HD1 LEU 31 -12.946 3.186 1.415
211 3HD1 LEU 31 3HD1 LEU 31 -11.815 3.434 2.745
212 1HD2 LEU 31 1HD2 LEU 31 -11.393 3.575 -0.011
213 2HD2 LEU 31 2HD2 LEU 31 -10.566 2.170 -0.684
214 3HD2 LEU 31 3HD2 LEU 31 -9.736 3.210 0.473
215 H ARG 32 H ARG 32 -8.079 -1.213 3.025
216 HA ARG 32 HA ARG 32 -5.963 0.375 4.276
217 1HB ARG 32 2HB ARG 32 -7.170 -1.464 5.477
218 2HB ARG 32 1HB ARG 32 -6.432 -2.624 4.371
219 1HG ARG 32 2HG ARG 32 -4.191 -1.430 5.140
220 2HG ARG 32 1HG ARG 32 -5.160 -1.002 6.550
221 1HD ARG 32 2HD ARG 32 -5.126 -3.122 7.343
222 2HD ARG 32 1HD ARG 32 -5.484 -3.806 5.758
223 HE ARG 32 HE ARG 32 -3.131 -3.979 5.334
224 1HH1 ARG 32 1HH2 ARG 32 -3.548 -4.332 8.483
225 2HH1 ARG 32 2HH2 ARG 32 -2.096 -3.560 9.026
226 1HH2 ARG 32 2HH1 ARG 32 -1.389 -2.135 5.934
227 2HH2 ARG 32 1HH1 ARG 32 -0.869 -2.311 7.578
228 H CYS 33 H CYS 33 -3.778 0.337 3.727
229 HA CYS 33 HA CYS 33 -3.107 -0.957 1.147
230 1HB CYS 33 2HB CYS 33 -2.045 1.333 2.708
231 2HB CYS 33 1HB CYS 33 -0.858 0.399 1.800
232 H THR 34 H THR 34 -2.032 -2.845 1.102
233 HA THR 34 HA THR 34 -0.504 -3.679 3.533
234 HB THR 34 HB THR 34 -1.830 -5.377 1.397
235 HG1 THR 34 HG1 THR 34 -3.427 -5.573 2.769
236 1HG2 THR 34 1HG2 THR 34 -0.655 -6.347 3.998
237 2HG2 THR 34 2HG2 THR 34 0.333 -6.225 2.543
238 3HG2 THR 34 3HG2 THR 34 -1.077 -7.285 2.567
239 H CYS 35 H CYS 35 1.647 -3.387 3.168
240 HA CYS 35 HA CYS 35 2.699 -3.761 0.401
241 1HB CYS 35 2HB CYS 35 4.258 -2.565 2.688
242 2HB CYS 35 1HB CYS 35 4.482 -2.324 0.956
243 H TYR 36 H TYR 36 4.482 -5.154 0.042
244 HA TYR 36 HA TYR 36 5.027 -7.067 2.276
245 1HB TYR 36 2HB TYR 36 5.805 -8.555 0.245
246 2HB TYR 36 1HB TYR 36 4.092 -8.423 0.633
247 HD1 TYR 36 HD1 TYR 36 6.771 -7.217 -1.639
248 HD2 TYR 36 HD2 TYR 36 2.550 -7.332 -0.850
249 HE1 TYR 36 HE1 TYR 36 6.320 -6.322 -3.907
250 HE2 TYR 36 HE2 TYR 36 2.100 -6.437 -3.117
251 HH TYR 36 HH TYR 36 4.120 -6.514 -5.557
252 H ARG 37 H ARG 37 7.204 -7.853 2.516
253 HA ARG 37 HA ARG 37 9.228 -5.818 2.072
254 1HB ARG 37 2HB ARG 37 9.237 -8.585 3.261
255 2HB ARG 37 1HB ARG 37 10.754 -7.741 2.958
256 1HG ARG 37 2HG ARG 37 9.285 -5.778 4.185
257 2HG ARG 37 1HG ARG 37 8.687 -7.220 5.004
258 1HD ARG 37 2HD ARG 37 11.644 -6.933 4.629
259 2HD ARG 37 1HD ARG 37 10.863 -5.958 5.873
260 HE ARG 37 HE ARG 37 10.075 -8.747 6.046
261 1HH1 ARG 37 2HH1 ARG 37 13.079 -8.848 5.986
262 2HH1 ARG 37 1HH1 ARG 37 13.480 -8.684 7.663
263 1HH2 ARG 37 1HH2 ARG 37 10.341 -7.490 8.563
264 2HH2 ARG 37 2HH2 ARG 37 11.923 -7.911 9.128
265 H CYS 38 H CYS 38 11.032 -5.924 0.695
266 HA CYS 38 HA CYS 38 10.615 -7.404 -1.793
267 1HB CYS 38 2HB CYS 38 11.764 -4.999 -1.215
268 2HB CYS 38 1HB CYS 38 13.193 -6.019 -1.366
269 H GLY 39 HN GLY 39 11.702 -9.235 -2.442
270 1HA GLY 39 2HA GLY 39 13.413 -10.579 -0.435
271 2HA GLY 39 1HA GLY 39 12.729 -11.329 -1.878
Start of MODEL 5
1 1H GLY 1 1H GLY 1 -7.791 3.377 2.104
2 2H GLY 1 2H GLY 1 -8.672 4.608 1.329
3 3H GLY 1 3H GLY 1 -8.922 4.290 2.980
4 1HA GLY 1 2HA GLY 1 -7.519 6.309 2.401
5 2HA GLY 1 1HA GLY 1 -6.881 5.195 3.608
6 H PHE 2 H PHE 2 -5.082 6.767 2.330
7 HA PHE 2 HA PHE 2 -3.104 6.744 1.082
8 1HB PHE 2 2HB PHE 2 -3.547 3.772 1.473
9 2HB PHE 2 1HB PHE 2 -2.080 4.449 0.767
10 HD1 PHE 2 HD1 PHE 2 -3.722 3.561 3.801
11 HD2 PHE 2 HD2 PHE 2 -0.886 6.329 2.146
12 HE1 PHE 2 HE1 PHE 2 -2.842 4.019 6.073
13 HE2 PHE 2 HE2 PHE 2 -0.006 6.786 4.418
14 HZ PHE 2 HZ PHE 2 -0.984 5.631 6.382
15 H GLY 3 H GLY 3 -5.639 6.861 -0.398
16 1HA GLY 3 2HA GLY 3 -6.251 6.952 -2.652
17 2HA GLY 3 1HA GLY 3 -4.614 6.448 -3.060
18 H CYS 4 H CYS 4 -7.292 4.854 -1.276
19 HA CYS 4 HA CYS 4 -6.855 2.454 -2.996
20 1HB CYS 4 2HB CYS 4 -7.838 2.818 -0.176
21 2HB CYS 4 1HB CYS 4 -8.288 1.376 -1.083
22 HA PRO 5 HA PRO 5 -8.128 0.500 -2.808
23 1HB PRO 5 2HB PRO 5 -9.312 -0.906 -4.848
24 2HB PRO 5 1HB PRO 5 -9.999 -0.768 -3.221
25 1HG PRO 5 2HG PRO 5 -10.864 0.566 -5.741
26 2HG PRO 5 1HG PRO 5 -11.809 0.181 -4.294
27 1HD PRO 5 2HD PRO 5 -10.761 2.728 -4.982
28 2HD PRO 5 1HD PRO 5 -11.461 2.266 -3.417
29 H ASN 6 H ASN 6 -7.733 2.897 -4.967
30 HA ASN 6 HA ASN 6 -6.639 1.783 -7.326
31 1HB ASN 6 2HB ASN 6 -7.067 4.275 -6.653
32 2HB ASN 6 1HB ASN 6 -5.425 4.208 -6.014
33 1HD2 ASN 6 1HD2 ASN 6 -7.087 5.066 -8.757
34 2HD2 ASN 6 2HD2 ASN 6 -5.876 4.797 -9.915
35 H ASN 7 H ASN 7 -4.768 0.672 -7.718
36 HA ASN 7 HA ASN 7 -3.001 0.041 -5.460
37 1HB ASN 7 2HB ASN 7 -3.289 -0.941 -8.280
38 2HB ASN 7 1HB ASN 7 -1.787 -1.252 -7.412
39 1HD2 ASN 7 1HD2 ASN 7 -3.910 -3.221 -8.217
40 2HD2 ASN 7 2HD2 ASN 7 -4.410 -3.963 -6.775
41 H TYR 8 H TYR 8 -3.010 2.281 -8.119
42 HA TYR 8 HA TYR 8 -0.162 2.634 -8.368
43 1HB TYR 8 2HB TYR 8 -1.957 3.448 -9.998
44 2HB TYR 8 1HB TYR 8 -2.272 4.755 -8.859
45 HD1 TYR 8 HD1 TYR 8 -0.778 6.616 -8.645
46 HD2 TYR 8 HD2 TYR 8 0.311 3.226 -11.050
47 HE1 TYR 8 HE1 TYR 8 1.136 7.889 -9.573
48 HE2 TYR 8 HE2 TYR 8 2.227 4.500 -11.977
49 HH TYR 8 HH TYR 8 3.645 6.787 -10.818
50 H GLN 9 H GLN 9 -2.632 4.603 -6.659
51 HA GLN 9 HA GLN 9 -0.717 6.241 -5.276
52 1HB GLN 9 2HB GLN 9 -3.568 5.557 -4.487
53 2HB GLN 9 1HB GLN 9 -2.615 6.896 -3.848
54 1HG GLN 9 2HG GLN 9 -2.939 6.685 -6.818
55 2HG GLN 9 1HG GLN 9 -4.304 7.269 -5.869
56 1HE2 GLN 9 1HE2 GLN 9 -0.954 8.003 -6.810
57 2HE2 GLN 9 2HE2 GLN 9 -0.978 9.610 -6.265
58 H CYS 10 H CYS 10 -2.418 3.236 -4.421
59 HA CYS 10 HA CYS 10 -1.472 3.013 -1.732
60 1HB CYS 10 2HB CYS 10 -3.283 1.613 -2.907
61 2HB CYS 10 1HB CYS 10 -1.956 0.669 -3.580
62 H HIS 11 H HIS 11 -0.132 1.885 -4.833
63 HA HIS 11 HA HIS 11 2.135 0.518 -3.752
64 1HB HIS 11 2HB HIS 11 1.349 0.292 -6.115
65 2HB HIS 11 1HB HIS 11 1.919 1.930 -6.430
66 HD1 HIS 11 HD1 HIS 11 3.194 -1.517 -5.544
67 HD2 HIS 11 HD2 HIS 11 4.701 2.160 -6.794
68 HE1 HIS 11 HE1 HIS 11 5.638 -1.894 -6.092
69 H ARG 12 H ARG 12 1.629 3.904 -4.733
70 HA ARG 12 HA ARG 12 4.304 4.823 -4.461
71 1HB ARG 12 2HB ARG 12 2.084 6.035 -5.270
72 2HB ARG 12 1HB ARG 12 2.029 6.571 -3.590
73 1HG ARG 12 2HG ARG 12 4.650 7.034 -4.178
74 2HG ARG 12 1HG ARG 12 3.907 7.322 -5.752
75 1HD ARG 12 2HD ARG 12 2.619 9.100 -4.970
76 2HD ARG 12 1HD ARG 12 2.658 8.528 -3.303
77 HE ARG 12 HE ARG 12 5.308 9.155 -3.869
78 1HH1 ARG 12 2HH1 ARG 12 3.526 10.638 -1.897
79 2HH1 ARG 12 1HH1 ARG 12 3.615 12.256 -2.507
80 1HH2 ARG 12 1HH2 ARG 12 4.895 11.300 -5.594
81 2HH2 ARG 12 2HH2 ARG 12 4.396 12.633 -4.609
82 H HIS 13 H HIS 13 1.705 4.503 -2.040
83 HA HIS 13 HA HIS 13 3.138 5.647 0.163
84 1HB HIS 13 2HB HIS 13 0.743 5.321 0.338
85 2HB HIS 13 1HB HIS 13 0.907 3.589 0.055
86 HD1 HIS 13 HD1 HIS 13 2.437 6.065 2.546
87 HD2 HIS 13 HD2 HIS 13 0.763 2.250 2.450
88 HE1 HIS 13 HE1 HIS 13 2.496 5.199 4.924
89 H CYS 14 H CYS 14 2.847 2.283 -0.998
90 HA CYS 14 HA CYS 14 4.511 1.134 1.054
91 1HB CYS 14 2HB CYS 14 3.899 0.162 -1.755
92 2HB CYS 14 1HB CYS 14 4.667 -0.807 -0.499
93 H LYS 15 H LYS 15 5.168 2.628 -2.072
94 HA LYS 15 HA LYS 15 7.875 1.789 -2.394
95 1HB LYS 15 2HB LYS 15 6.311 4.177 -3.370
96 2HB LYS 15 1HB LYS 15 8.027 4.000 -3.738
97 1HG LYS 15 2HG LYS 15 6.655 1.501 -4.221
98 2HG LYS 15 1HG LYS 15 5.859 2.806 -5.098
99 1HD LYS 15 2HD LYS 15 7.518 2.152 -6.612
100 2HD LYS 15 1HD LYS 15 8.297 3.492 -5.771
101 1HE LYS 15 2HE LYS 15 8.666 0.933 -4.393
102 2HE LYS 15 1HE LYS 15 9.328 0.926 -6.028
103 1HZ LYS 15 1HZ LYS 15 10.484 3.016 -5.481
104 2HZ LYS 15 2HZ LYS 15 10.981 1.718 -4.504
105 3HZ LYS 15 3HZ LYS 15 9.924 2.895 -3.883
106 H SER 16 H SER 16 6.492 4.674 -0.772
107 HA SER 16 HA SER 16 9.048 5.783 -0.042
108 1HB SER 16 2HB SER 16 7.704 7.118 1.619
109 2HB SER 16 1HB SER 16 7.120 7.232 -0.037
110 HG SER 16 HG SER 16 6.058 5.813 2.157
111 H ILE 17 H ILE 17 7.106 3.220 1.323
112 HA ILE 17 HA ILE 17 8.333 3.299 3.963
113 HB ILE 17 HB ILE 17 6.776 1.107 2.555
114 1HG1 ILE 17 2HG1 ILE 17 5.838 2.885 4.811
115 2HG1 ILE 17 1HG1 ILE 17 5.683 3.395 3.130
116 1HG2 ILE 17 1HG2 ILE 17 7.618 1.411 5.457
117 2HG2 ILE 17 2HG2 ILE 17 8.195 0.181 4.330
118 3HG2 ILE 17 3HG2 ILE 17 6.510 0.179 4.851
119 1HD1 ILE 17 1HD1 ILE 17 4.691 0.868 2.963
120 2HD1 ILE 17 2HD1 ILE 17 3.690 2.290 3.253
121 3HD1 ILE 17 3HD1 ILE 17 4.214 1.289 4.606
122 HA PRO 18 HA PRO 18 12.063 1.285 2.612
123 1HB PRO 18 2HB PRO 18 13.248 1.278 5.092
124 2HB PRO 18 1HB PRO 18 13.176 2.703 4.043
125 1HG PRO 18 2HG PRO 18 11.620 2.114 6.513
126 2HG PRO 18 1HG PRO 18 12.037 3.679 5.797
127 1HD PRO 18 2HD PRO 18 9.526 2.369 5.612
128 2HD PRO 18 1HD PRO 18 10.043 3.784 4.674
129 H GLY 19 H GLY 19 12.862 -0.848 2.681
130 1HA GLY 19 2HA GLY 19 13.145 -3.052 3.592
131 2HA GLY 19 1HA GLY 19 11.896 -2.697 4.784
132 H ARG 20 H ARG 20 10.370 -1.572 2.218
133 HA ARG 20 HA ARG 20 9.310 -4.246 1.412
134 1HB ARG 20 2HB ARG 20 7.977 -1.688 2.150
135 2HB ARG 20 1HB ARG 20 7.239 -2.630 0.855
136 1HG ARG 20 2HG ARG 20 6.228 -3.435 2.852
137 2HG ARG 20 1HG ARG 20 7.432 -4.649 2.425
138 1HD ARG 20 2HD ARG 20 8.909 -3.974 4.115
139 2HD ARG 20 1HD ARG 20 8.166 -2.381 4.260
140 HE ARG 20 HE ARG 20 7.284 -4.805 5.619
141 1HH1 ARG 20 2HH1 ARG 20 7.154 -1.909 6.592
142 2HH1 ARG 20 1HH1 ARG 20 5.443 -1.639 6.612
143 1HH2 ARG 20 1HH2 ARG 20 4.725 -4.401 4.619
144 2HH2 ARG 20 2HH2 ARG 20 4.060 -3.055 5.483
145 H CYS 21 H CYS 21 7.989 -3.935 -0.768
146 HA CYS 21 HA CYS 21 9.652 -2.304 -2.644
147 1HB CYS 21 2HB CYS 21 9.222 -5.176 -2.580
148 2HB CYS 21 1HB CYS 21 8.649 -4.490 -4.101
149 H GLY 22 H GLY 22 6.554 -4.109 -2.417
150 1HA GLY 22 2HA GLY 22 5.193 -1.755 -3.606
151 2HA GLY 22 1HA GLY 22 4.980 -3.319 -4.388
152 H GLY 23 H GLY 23 2.654 -2.481 -3.688
153 1HA GLY 23 2HA GLY 23 1.840 -4.182 -1.462
154 2HA GLY 23 1HA GLY 23 1.637 -2.465 -1.123
155 H TYR 24 H TYR 24 -0.676 -3.448 -1.005
156 HA TYR 24 HA TYR 24 -2.058 -2.695 -3.493
157 1HB TYR 24 2HB TYR 24 -3.288 -4.786 -3.707
158 2HB TYR 24 1HB TYR 24 -1.562 -5.140 -3.755
159 HD1 TYR 24 HD1 TYR 24 -0.414 -6.091 -1.745
160 HD2 TYR 24 HD2 TYR 24 -4.672 -5.539 -1.895
161 HE1 TYR 24 HE1 TYR 24 -0.682 -7.600 0.206
162 HE2 TYR 24 HE2 TYR 24 -4.939 -7.047 0.054
163 HH TYR 24 HH TYR 24 -2.533 -7.862 2.090
164 H CYS 25 H CYS 25 -4.495 -2.728 -3.109
165 HA CYS 25 HA CYS 25 -5.029 -1.713 -0.379
166 1HB CYS 25 2HB CYS 25 -6.654 -1.672 -2.935
167 2HB CYS 25 1HB CYS 25 -7.256 -1.067 -1.393
168 H GLY 26 H GLY 26 -5.505 -3.328 1.052
169 1HA GLY 26 2HA GLY 26 -7.895 -4.910 0.729
170 2HA GLY 26 1HA GLY 26 -6.461 -5.909 0.483
171 H GLY 27 H GLY 27 -8.506 -5.827 2.709
172 1HA GLY 27 2HA GLY 27 -7.530 -6.766 4.914
173 2HA GLY 27 1HA GLY 27 -6.699 -5.214 5.010
174 H TRP 28 H TRP 28 -8.461 -3.354 4.408
175 HA TRP 28 HA TRP 28 -10.843 -3.844 6.145
176 1HB TRP 28 2HB TRP 28 -9.150 -2.401 7.263
177 2HB TRP 28 1HB TRP 28 -9.245 -1.272 5.914
178 HD1 TRP 28 HD1 TRP 28 -11.411 -2.714 8.752
179 HE1 TRP 28 HE1 TRP 28 -13.296 -1.037 9.271
180 HE3 TRP 28 HE3 TRP 28 -10.627 0.685 5.020
181 HZ2 TRP 28 HZ2 TRP 28 -14.335 1.420 8.245
182 HZ3 TRP 28 HZ3 TRP 28 -12.078 2.683 4.817
183 HH2 TRP 28 HH2 TRP 28 -13.931 3.053 6.421
184 H HIS 29 H HIS 29 -12.270 -4.192 4.427
185 HA HIS 29 HA HIS 29 -13.713 -3.643 2.676
186 1HB HIS 29 2HB HIS 29 -13.054 -0.813 3.553
187 2HB HIS 29 1HB HIS 29 -14.439 -1.292 2.578
188 HD1 HIS 29 HD1 HIS 29 -14.559 0.000 5.512
189 HD2 HIS 29 HD2 HIS 29 -15.041 -4.034 4.588
190 HE1 HIS 29 HE1 HIS 29 -15.825 -1.032 7.448
191 H ARG 30 H ARG 30 -10.837 -3.955 2.073
192 HA ARG 30 HA ARG 30 -9.374 -3.674 0.265
193 1HB ARG 30 2HB ARG 30 -11.696 -4.147 -0.861
194 2HB ARG 30 1HB ARG 30 -11.636 -2.439 -1.284
195 1HG ARG 30 2HG ARG 30 -9.839 -2.709 -2.715
196 2HG ARG 30 1HG ARG 30 -9.208 -4.095 -1.827
197 1HD ARG 30 2HD ARG 30 -10.846 -5.563 -2.753
198 2HD ARG 30 1HD ARG 30 -11.804 -4.220 -3.373
199 HE ARG 30 HE ARG 30 -10.379 -4.148 -5.257
200 1HH1 ARG 30 1HH2 ARG 30 -7.790 -3.816 -3.830
201 2HH1 ARG 30 2HH2 ARG 30 -6.946 -5.277 -4.230
202 1HH2 ARG 30 2HH1 ARG 30 -9.810 -6.954 -5.267
203 2HH2 ARG 30 1HH1 ARG 30 -8.095 -7.059 -5.048
204 H LEU 31 H LEU 31 -9.893 -1.417 2.211
205 HA LEU 31 HA LEU 31 -9.029 0.860 0.480
206 1HB LEU 31 2HB LEU 31 -10.596 0.809 3.062
207 2HB LEU 31 1HB LEU 31 -9.838 2.279 2.452
208 HG LEU 31 HG LEU 31 -11.814 0.589 0.889
209 1HD1 LEU 31 1HD1 LEU 31 -13.445 2.309 1.362
210 2HD1 LEU 31 2HD1 LEU 31 -12.239 3.293 2.192
211 3HD1 LEU 31 3HD1 LEU 31 -12.773 1.770 2.900
212 1HD2 LEU 31 1HD2 LEU 31 -10.318 3.157 0.358
213 2HD2 LEU 31 2HD2 LEU 31 -11.858 2.834 -0.438
214 3HD2 LEU 31 3HD2 LEU 31 -10.493 1.747 -0.687
215 H ARG 32 H ARG 32 -7.968 -1.339 2.848
216 HA ARG 32 HA ARG 32 -6.036 0.497 4.103
217 1HB ARG 32 2HB ARG 32 -7.248 -1.574 5.186
218 2HB ARG 32 1HB ARG 32 -5.962 -2.494 4.405
219 1HG ARG 32 2HG ARG 32 -4.681 -1.998 6.195
220 2HG ARG 32 1HG ARG 32 -4.626 -0.346 5.580
221 1HD ARG 32 2HD ARG 32 -6.016 0.422 7.197
222 2HD ARG 32 1HD ARG 32 -7.102 -0.960 7.040
223 HE ARG 32 HE ARG 32 -5.174 -2.181 8.371
224 1HH1 ARG 32 2HH1 ARG 32 -3.767 0.453 8.864
225 2HH1 ARG 32 1HH1 ARG 32 -4.366 0.882 10.432
226 1HH2 ARG 32 1HH2 ARG 32 -7.014 -1.369 10.321
227 2HH2 ARG 32 2HH2 ARG 32 -6.212 -0.154 11.261
228 H CYS 33 H CYS 33 -3.875 0.628 3.531
229 HA CYS 33 HA CYS 33 -3.082 -0.730 1.031
230 1HB CYS 33 2HB CYS 33 -2.136 1.629 2.578
231 2HB CYS 33 1HB CYS 33 -0.915 0.746 1.661
232 H THR 34 H THR 34 -2.304 -2.765 1.291
233 HA THR 34 HA THR 34 -0.615 -3.364 3.671
234 HB THR 34 HB THR 34 -1.934 -5.247 1.689
235 HG1 THR 34 HG1 THR 34 -3.608 -4.959 2.899
236 1HG2 THR 34 1HG2 THR 34 -1.406 -6.909 3.566
237 2HG2 THR 34 2HG2 THR 34 -0.326 -5.675 4.212
238 3HG2 THR 34 3HG2 THR 34 -0.033 -6.352 2.611
239 H CYS 35 H CYS 35 1.520 -3.092 3.268
240 HA CYS 35 HA CYS 35 2.574 -3.559 0.527
241 1HB CYS 35 2HB CYS 35 4.148 -2.484 2.870
242 2HB CYS 35 1HB CYS 35 4.455 -2.257 1.148
243 H TYR 36 H TYR 36 4.110 -5.164 0.098
244 HA TYR 36 HA TYR 36 4.566 -7.110 2.317
245 1HB TYR 36 2HB TYR 36 5.223 -8.652 0.327
246 2HB TYR 36 1HB TYR 36 3.518 -8.306 0.592
247 HD1 TYR 36 HD1 TYR 36 6.480 -7.476 -1.484
248 HD2 TYR 36 HD2 TYR 36 2.237 -7.014 -0.985
249 HE1 TYR 36 HE1 TYR 36 6.307 -6.551 -3.777
250 HE2 TYR 36 HE2 TYR 36 2.065 -6.088 -3.278
251 HH TYR 36 HH TYR 36 4.873 -5.232 -5.132
252 H ARG 37 H ARG 37 6.664 -8.013 2.623
253 HA ARG 37 HA ARG 37 8.844 -6.183 2.416
254 1HB ARG 37 2HB ARG 37 8.603 -9.093 3.104
255 2HB ARG 37 1HB ARG 37 10.202 -8.384 2.883
256 1HG ARG 37 2HG ARG 37 9.879 -6.826 4.648
257 2HG ARG 37 1HG ARG 37 8.139 -7.113 4.686
258 1HD ARG 37 2HD ARG 37 9.669 -9.569 5.093
259 2HD ARG 37 1HD ARG 37 10.028 -8.349 6.314
260 HE ARG 37 HE ARG 37 7.186 -9.042 5.724
261 1HH1 ARG 37 2HH1 ARG 37 8.364 -7.205 7.950
262 2HH1 ARG 37 1HH1 ARG 37 8.139 -8.225 9.331
263 1HH2 ARG 37 1HH2 ARG 37 7.559 -11.089 7.448
264 2HH2 ARG 37 2HH2 ARG 37 7.682 -10.434 9.046
265 H CYS 38 H CYS 38 10.704 -6.228 1.080
266 HA CYS 38 HA CYS 38 10.221 -7.346 -1.620
267 1HB CYS 38 2HB CYS 38 11.041 -4.928 -1.101
268 2HB CYS 38 1HB CYS 38 12.614 -5.685 -0.848
269 H GLY 39 HN GLY 39 11.115 -9.251 -2.190
270 1HA GLY 39 2HA GLY 39 13.254 -10.421 -0.511
271 2HA GLY 39 1HA GLY 39 12.317 -11.280 -1.733
Start of MODEL 6
1 1H GLY 1 1H GLY 1 -8.695 4.731 1.329
2 2H GLY 1 2H GLY 1 -8.888 4.308 2.963
3 3H GLY 1 3H GLY 1 -7.781 3.462 1.988
4 1HA GLY 1 2HA GLY 1 -7.503 6.370 2.427
5 2HA GLY 1 1HA GLY 1 -6.862 5.214 3.593
6 H PHE 2 H PHE 2 -5.089 6.852 2.326
7 HA PHE 2 HA PHE 2 -3.124 6.872 1.054
8 1HB PHE 2 2HB PHE 2 -3.478 3.864 1.272
9 2HB PHE 2 1HB PHE 2 -1.992 4.683 0.791
10 HD1 PHE 2 HD1 PHE 2 -1.439 6.776 2.518
11 HD2 PHE 2 HD2 PHE 2 -3.501 3.130 3.476
12 HE1 PHE 2 HE1 PHE 2 -0.821 7.052 4.904
13 HE2 PHE 2 HE2 PHE 2 -2.882 3.407 5.860
14 HZ PHE 2 HZ PHE 2 -1.543 5.368 6.574
15 H GLY 3 H GLY 3 -5.709 6.918 -0.392
16 1HA GLY 3 2HA GLY 3 -6.388 6.960 -2.628
17 2HA GLY 3 1HA GLY 3 -4.717 6.619 -3.071
18 H CYS 4 H CYS 4 -7.379 4.862 -1.429
19 HA CYS 4 HA CYS 4 -6.681 2.475 -3.087
20 1HB CYS 4 2HB CYS 4 -7.653 2.777 -0.263
21 2HB CYS 4 1HB CYS 4 -8.055 1.312 -1.157
22 HA PRO 5 HA PRO 5 -7.740 0.444 -3.013
23 1HB PRO 5 2HB PRO 5 -8.814 -1.008 -5.079
24 2HB PRO 5 1HB PRO 5 -9.487 -0.980 -3.441
25 1HG PRO 5 2HG PRO 5 -10.515 0.327 -5.909
26 2HG PRO 5 1HG PRO 5 -11.395 -0.178 -4.458
27 1HD PRO 5 2HD PRO 5 -10.591 2.472 -5.102
28 2HD PRO 5 1HD PRO 5 -11.238 1.912 -3.544
29 H ASN 6 H ASN 6 -7.419 2.952 -4.957
30 HA ASN 6 HA ASN 6 -6.417 2.143 -7.458
31 1HB ASN 6 2HB ASN 6 -6.720 4.528 -6.505
32 2HB ASN 6 1HB ASN 6 -5.103 4.321 -5.833
33 1HD2 ASN 6 1HD2 ASN 6 -6.830 5.174 -8.684
34 2HD2 ASN 6 2HD2 ASN 6 -5.509 5.180 -9.749
35 H ASN 7 H ASN 7 -4.593 1.098 -8.113
36 HA ASN 7 HA ASN 7 -2.830 -0.100 -6.119
37 1HB ASN 7 2HB ASN 7 -3.115 -0.257 -9.104
38 2HB ASN 7 1HB ASN 7 -1.629 -0.838 -8.355
39 1HD2 ASN 7 1HD2 ASN 7 -2.057 -2.397 -6.385
40 2HD2 ASN 7 2HD2 ASN 7 -3.326 -3.508 -6.577
41 H TYR 8 H TYR 8 -2.485 2.388 -8.656
42 HA TYR 8 HA TYR 8 0.316 2.827 -8.348
43 1HB TYR 8 2HB TYR 8 -1.313 3.727 -10.162
44 2HB TYR 8 1HB TYR 8 -1.635 5.030 -9.020
45 HD1 TYR 8 HD1 TYR 8 -0.413 6.965 -9.412
46 HD2 TYR 8 HD2 TYR 8 1.401 3.155 -10.218
47 HE1 TYR 8 HE1 TYR 8 1.667 8.107 -10.131
48 HE2 TYR 8 HE2 TYR 8 3.480 4.297 -10.937
49 HH TYR 8 HH TYR 8 3.923 6.848 -11.940
50 H GLN 9 H GLN 9 -2.460 4.536 -6.855
51 HA GLN 9 HA GLN 9 -0.934 6.306 -5.228
52 1HB GLN 9 2HB GLN 9 -3.715 5.169 -5.026
53 2HB GLN 9 1HB GLN 9 -3.068 6.170 -3.728
54 1HG GLN 9 2HG GLN 9 -2.679 7.242 -6.461
55 2HG GLN 9 1HG GLN 9 -4.352 7.177 -5.907
56 1HE2 GLN 9 1HE2 GLN 9 -1.116 8.429 -4.987
57 2HE2 GLN 9 2HE2 GLN 9 -1.708 9.679 -4.005
58 H CYS 10 H CYS 10 -2.294 3.086 -4.476
59 HA CYS 10 HA CYS 10 -1.298 2.933 -1.801
60 1HB CYS 10 2HB CYS 10 -3.002 1.403 -3.033
61 2HB CYS 10 1HB CYS 10 -1.580 0.529 -3.599
62 H HIS 11 H HIS 11 0.107 1.998 -4.923
63 HA HIS 11 HA HIS 11 2.447 0.712 -3.931
64 1HB HIS 11 2HB HIS 11 1.597 0.696 -6.326
65 2HB HIS 11 1HB HIS 11 2.271 2.317 -6.492
66 HD1 HIS 11 HD1 HIS 11 3.418 -1.183 -5.508
67 HD2 HIS 11 HD2 HIS 11 4.966 2.332 -7.129
68 HE1 HIS 11 HE1 HIS 11 5.825 -1.679 -6.124
69 H ARG 12 H ARG 12 1.830 4.137 -4.753
70 HA ARG 12 HA ARG 12 4.485 5.084 -4.313
71 1HB ARG 12 2HB ARG 12 2.290 6.282 -5.234
72 2HB ARG 12 1HB ARG 12 2.156 6.803 -3.552
73 1HG ARG 12 2HG ARG 12 4.503 7.648 -3.665
74 2HG ARG 12 1HG ARG 12 4.543 7.221 -5.377
75 1HD ARG 12 2HD ARG 12 2.308 8.674 -5.425
76 2HD ARG 12 1HD ARG 12 3.044 9.413 -4.001
77 HE ARG 12 HE ARG 12 5.117 9.559 -5.707
78 1HH1 ARG 12 1HH2 ARG 12 3.161 9.030 -7.968
79 2HH1 ARG 12 2HH2 ARG 12 2.762 10.640 -8.466
80 1HH2 ARG 12 2HH1 ARG 12 4.015 12.118 -5.577
81 2HH2 ARG 12 1HH1 ARG 12 3.253 12.398 -7.107
82 H HIS 13 H HIS 13 1.725 4.738 -2.081
83 HA HIS 13 HA HIS 13 3.049 5.823 0.223
84 1HB HIS 13 2HB HIS 13 0.611 5.564 0.148
85 2HB HIS 13 1HB HIS 13 0.779 3.814 0.023
86 HD1 HIS 13 HD1 HIS 13 2.098 6.502 2.407
87 HD2 HIS 13 HD2 HIS 13 0.496 2.656 2.500
88 HE1 HIS 13 HE1 HIS 13 1.979 5.835 4.848
89 H CYS 14 H CYS 14 2.642 2.464 -0.935
90 HA CYS 14 HA CYS 14 4.087 1.237 1.214
91 1HB CYS 14 2HB CYS 14 3.438 0.371 -1.604
92 2HB CYS 14 1HB CYS 14 4.384 -0.647 -0.517
93 H LYS 15 H LYS 15 5.124 2.630 -1.874
94 HA LYS 15 HA LYS 15 7.827 1.648 -1.773
95 1HB LYS 15 2HB LYS 15 6.385 3.779 -3.306
96 2HB LYS 15 1HB LYS 15 8.149 3.794 -3.302
97 1HG LYS 15 2HG LYS 15 7.643 1.139 -3.749
98 2HG LYS 15 1HG LYS 15 6.287 1.894 -4.587
99 1HD LYS 15 2HD LYS 15 7.617 2.755 -6.213
100 2HD LYS 15 1HD LYS 15 8.865 3.233 -5.064
101 1HE LYS 15 2HE LYS 15 8.451 0.325 -5.724
102 2HE LYS 15 1HE LYS 15 9.409 1.351 -6.791
103 1HZ LYS 15 1HZ LYS 15 10.838 0.314 -5.187
104 2HZ LYS 15 2HZ LYS 15 9.884 0.873 -3.897
105 3HZ LYS 15 3HZ LYS 15 10.761 1.975 -4.848
106 H SER 16 H SER 16 6.301 4.680 -0.632
107 HA SER 16 HA SER 16 8.716 5.973 0.178
108 1HB SER 16 2HB SER 16 7.307 7.416 1.536
109 2HB SER 16 1HB SER 16 6.488 7.103 0.010
110 HG SER 16 HG SER 16 5.893 6.245 2.595
111 H ILE 17 H ILE 17 6.799 3.439 1.672
112 HA ILE 17 HA ILE 17 8.149 3.637 4.265
113 HB ILE 17 HB ILE 17 6.374 1.461 3.104
114 1HG1 ILE 17 2HG1 ILE 17 5.522 3.321 5.284
115 2HG1 ILE 17 1HG1 ILE 17 5.566 3.958 3.641
116 1HG2 ILE 17 1HG2 ILE 17 7.725 0.534 4.882
117 2HG2 ILE 17 2HG2 ILE 17 6.116 0.836 5.539
118 3HG2 ILE 17 3HG2 ILE 17 7.438 1.946 5.902
119 1HD1 ILE 17 1HD1 ILE 17 4.301 1.694 3.084
120 2HD1 ILE 17 2HD1 ILE 17 3.417 3.096 3.684
121 3HD1 ILE 17 3HD1 ILE 17 3.850 1.789 4.786
122 HA PRO 18 HA PRO 18 11.629 1.268 2.843
123 1HB PRO 18 2HB PRO 18 12.876 1.120 5.290
124 2HB PRO 18 1HB PRO 18 12.913 2.556 4.252
125 1HG PRO 18 2HG PRO 18 11.361 2.088 6.756
126 2HG PRO 18 1HG PRO 18 11.926 3.613 6.054
127 1HD PRO 18 2HD PRO 18 9.288 2.599 5.912
128 2HD PRO 18 1HD PRO 18 9.945 3.939 4.947
129 H GLY 19 H GLY 19 12.202 -0.926 2.841
130 1HA GLY 19 2HA GLY 19 12.327 -3.149 3.780
131 2HA GLY 19 1HA GLY 19 11.076 -2.705 4.937
132 H ARG 20 H ARG 20 9.734 -1.446 2.315
133 HA ARG 20 HA ARG 20 8.483 -4.029 1.465
134 1HB ARG 20 2HB ARG 20 7.113 -1.347 1.298
135 2HB ARG 20 1HB ARG 20 6.386 -2.951 1.272
136 1HG ARG 20 2HG ARG 20 7.914 -2.011 3.695
137 2HG ARG 20 1HG ARG 20 6.228 -1.554 3.466
138 1HD ARG 20 2HD ARG 20 6.045 -4.200 2.946
139 2HD ARG 20 1HD ARG 20 7.400 -4.215 4.074
140 HE ARG 20 HE ARG 20 4.695 -3.111 4.718
141 1HH1 ARG 20 1HH2 ARG 20 5.422 -5.738 5.881
142 2HH1 ARG 20 2HH2 ARG 20 6.084 -5.308 7.423
143 1HH2 ARG 20 2HH1 ARG 20 6.561 -1.967 6.580
144 2HH2 ARG 20 1HH1 ARG 20 6.735 -3.169 7.816
145 H CYS 21 H CYS 21 8.063 -4.303 -0.758
146 HA CYS 21 HA CYS 21 9.564 -2.444 -2.542
147 1HB CYS 21 2HB CYS 21 9.255 -5.310 -2.450
148 2HB CYS 21 1HB CYS 21 8.668 -4.706 -3.999
149 H GLY 22 H GLY 22 6.472 -4.237 -2.405
150 1HA GLY 22 2HA GLY 22 5.224 -2.012 -3.947
151 2HA GLY 22 1HA GLY 22 4.913 -3.685 -4.405
152 H GLY 23 H GLY 23 2.628 -2.661 -3.887
153 1HA GLY 23 2HA GLY 23 1.776 -3.826 -1.363
154 2HA GLY 23 1HA GLY 23 1.690 -2.067 -1.342
155 H TYR 24 H TYR 24 -0.579 -3.677 -1.076
156 HA TYR 24 HA TYR 24 -2.096 -2.893 -3.511
157 1HB TYR 24 2HB TYR 24 -3.222 -5.017 -3.641
158 2HB TYR 24 1HB TYR 24 -1.495 -5.363 -3.581
159 HD1 TYR 24 HD1 TYR 24 -0.443 -6.069 -1.393
160 HD2 TYR 24 HD2 TYR 24 -4.695 -5.741 -1.906
161 HE1 TYR 24 HE1 TYR 24 -0.795 -7.434 0.646
162 HE2 TYR 24 HE2 TYR 24 -5.045 -7.107 0.131
163 HH TYR 24 HH TYR 24 -3.800 -7.682 2.199
164 H CYS 25 H CYS 25 -4.451 -2.744 -3.071
165 HA CYS 25 HA CYS 25 -4.937 -1.746 -0.333
166 1HB CYS 25 2HB CYS 25 -6.643 -1.696 -2.840
167 2HB CYS 25 1HB CYS 25 -7.121 -0.988 -1.297
168 H GLY 26 H GLY 26 -5.458 -3.323 1.112
169 1HA GLY 26 2HA GLY 26 -7.871 -4.877 0.811
170 2HA GLY 26 1HA GLY 26 -6.452 -5.895 0.578
171 H GLY 27 H GLY 27 -8.476 -5.808 2.802
172 1HA GLY 27 2HA GLY 27 -7.530 -6.712 5.018
173 2HA GLY 27 1HA GLY 27 -6.645 -5.188 5.088
174 H TRP 28 H TRP 28 -8.357 -3.282 4.454
175 HA TRP 28 HA TRP 28 -10.704 -3.653 6.265
176 1HB TRP 28 2HB TRP 28 -8.877 -2.151 7.167
177 2HB TRP 28 1HB TRP 28 -9.193 -1.065 5.815
178 HD1 TRP 28 HD1 TRP 28 -10.917 -2.543 8.919
179 HE1 TRP 28 HE1 TRP 28 -12.828 -0.966 9.621
180 HE3 TRP 28 HE3 TRP 28 -10.786 0.784 5.047
181 HZ2 TRP 28 HZ2 TRP 28 -14.129 1.395 8.670
182 HZ3 TRP 28 HZ3 TRP 28 -12.370 2.686 4.972
183 HH2 TRP 28 HH2 TRP 28 -14.042 2.995 6.776
184 H HIS 29 H HIS 29 -12.059 -4.183 4.480
185 HA HIS 29 HA HIS 29 -13.548 -3.726 2.738
186 1HB HIS 29 2HB HIS 29 -13.056 -0.825 3.479
187 2HB HIS 29 1HB HIS 29 -14.470 -1.482 2.660
188 HD1 HIS 29 HD1 HIS 29 -14.333 -0.022 5.567
189 HD2 HIS 29 HD2 HIS 29 -14.793 -4.096 4.823
190 HE1 HIS 29 HE1 HIS 29 -15.388 -1.014 7.646
191 H ARG 30 H ARG 30 -10.652 -3.881 2.161
192 HA ARG 30 HA ARG 30 -9.206 -3.568 0.348
193 1HB ARG 30 2HB ARG 30 -11.374 -4.195 -0.867
194 2HB ARG 30 1HB ARG 30 -11.596 -2.469 -1.143
195 1HG ARG 30 2HG ARG 30 -9.375 -2.378 -2.253
196 2HG ARG 30 1HG ARG 30 -9.202 -4.115 -2.017
197 1HD ARG 30 2HD ARG 30 -11.651 -3.062 -3.398
198 2HD ARG 30 1HD ARG 30 -10.139 -3.187 -4.298
199 HE ARG 30 HE ARG 30 -10.168 -5.656 -3.514
200 1HH1 ARG 30 1HH2 ARG 30 -12.768 -5.415 -2.029
201 2HH1 ARG 30 2HH2 ARG 30 -13.909 -5.988 -3.199
202 1HH2 ARG 30 2HH1 ARG 30 -11.719 -5.658 -5.879
203 2HH2 ARG 30 1HH1 ARG 30 -13.312 -6.129 -5.389
204 H LEU 31 H LEU 31 -9.702 -1.392 2.312
205 HA LEU 31 HA LEU 31 -8.986 0.956 0.609
206 1HB LEU 31 2HB LEU 31 -10.352 0.865 3.311
207 2HB LEU 31 1HB LEU 31 -9.830 2.347 2.511
208 HG LEU 31 HG LEU 31 -11.695 0.352 1.206
209 1HD1 LEU 31 1HD1 LEU 31 -12.764 1.198 3.242
210 2HD1 LEU 31 2HD1 LEU 31 -13.516 1.924 1.822
211 3HD1 LEU 31 3HD1 LEU 31 -12.367 2.854 2.783
212 1HD2 LEU 31 1HD2 LEU 31 -12.267 2.543 -0.061
213 2HD2 LEU 31 2HD2 LEU 31 -10.736 1.755 -0.440
214 3HD2 LEU 31 3HD2 LEU 31 -10.764 3.163 0.620
215 H ARG 32 H ARG 32 -7.830 -1.226 3.005
216 HA ARG 32 HA ARG 32 -5.865 0.665 4.117
217 1HB ARG 32 2HB ARG 32 -7.051 -1.388 5.304
218 2HB ARG 32 1HB ARG 32 -5.724 -2.294 4.578
219 1HG ARG 32 2HG ARG 32 -4.267 -0.308 5.575
220 2HG ARG 32 1HG ARG 32 -5.637 -0.155 6.674
221 1HD ARG 32 2HD ARG 32 -4.460 -1.725 7.861
222 2HD ARG 32 1HD ARG 32 -5.308 -2.827 6.776
223 HE ARG 32 HE ARG 32 -3.019 -2.223 5.365
224 1HH1 ARG 32 2HH1 ARG 32 -3.571 -4.894 6.726
225 2HH1 ARG 32 1HH1 ARG 32 -2.161 -5.067 7.717
226 1HH2 ARG 32 1HH2 ARG 32 -1.244 -1.723 7.449
227 2HH2 ARG 32 2HH2 ARG 32 -0.836 -3.265 8.125
228 H CYS 33 H CYS 33 -3.715 0.745 3.525
229 HA CYS 33 HA CYS 33 -2.974 -0.679 1.046
230 1HB CYS 33 2HB CYS 33 -2.039 1.734 2.494
231 2HB CYS 33 1HB CYS 33 -0.785 0.814 1.661
232 H THR 34 H THR 34 -2.394 -2.774 1.519
233 HA THR 34 HA THR 34 -0.569 -3.287 3.802
234 HB THR 34 HB THR 34 -2.001 -5.204 1.934
235 HG1 THR 34 HG1 THR 34 -3.595 -4.749 3.209
236 1HG2 THR 34 1HG2 THR 34 -0.320 -5.644 4.414
237 2HG2 THR 34 2HG2 THR 34 -0.019 -6.271 2.794
238 3HG2 THR 34 3HG2 THR 34 -1.385 -6.873 3.732
239 H CYS 35 H CYS 35 1.568 -3.119 3.349
240 HA CYS 35 HA CYS 35 2.517 -3.627 0.578
241 1HB CYS 35 2HB CYS 35 4.267 -2.588 2.787
242 2HB CYS 35 1HB CYS 35 4.363 -2.276 1.055
243 H TYR 36 H TYR 36 4.051 -5.219 0.117
244 HA TYR 36 HA TYR 36 4.502 -7.207 2.290
245 1HB TYR 36 2HB TYR 36 5.334 -8.606 0.208
246 2HB TYR 36 1HB TYR 36 3.614 -8.442 0.540
247 HD1 TYR 36 HD1 TYR 36 6.408 -7.287 -1.598
248 HD2 TYR 36 HD2 TYR 36 2.170 -7.135 -0.897
249 HE1 TYR 36 HE1 TYR 36 6.071 -6.261 -3.831
250 HE2 TYR 36 HE2 TYR 36 1.837 -6.108 -3.128
251 HH TYR 36 HH TYR 36 3.541 -6.247 -5.488
252 H ARG 37 H ARG 37 6.638 -8.203 2.475
253 HA ARG 37 HA ARG 37 8.764 -6.237 2.440
254 1HB ARG 37 2HB ARG 37 8.943 -9.230 2.898
255 2HB ARG 37 1HB ARG 37 10.164 -8.036 3.331
256 1HG ARG 37 2HG ARG 37 9.126 -7.650 5.287
257 2HG ARG 37 1HG ARG 37 7.646 -7.208 4.435
258 1HD ARG 37 2HD ARG 37 6.803 -9.404 4.502
259 2HD ARG 37 1HD ARG 37 8.393 -10.104 4.801
260 HE ARG 37 HE ARG 37 6.624 -8.901 6.824
261 1HH1 ARG 37 2HH1 ARG 37 7.955 -11.506 7.271
262 2HH1 ARG 37 1HH1 ARG 37 9.282 -11.090 8.302
263 1HH2 ARG 37 1HH2 ARG 37 9.115 -7.693 7.580
264 2HH2 ARG 37 2HH2 ARG 37 9.943 -8.920 8.478
265 H CYS 38 H CYS 38 10.664 -6.234 1.175
266 HA CYS 38 HA CYS 38 10.350 -7.453 -1.507
267 1HB CYS 38 2HB CYS 38 11.060 -4.982 -0.978
268 2HB CYS 38 1HB CYS 38 12.653 -5.691 -0.713
269 H GLY 39 HN GLY 39 11.422 -9.283 -2.049
270 1HA GLY 39 2HA GLY 39 13.432 -10.387 -0.187
271 2HA GLY 39 1HA GLY 39 12.698 -11.244 -1.543
Start of MODEL 7
1 1H GLY 1 1H GLY 1 -7.302 3.502 2.275
2 2H GLY 1 2H GLY 1 -8.217 4.639 1.404
3 3H GLY 1 3H GLY 1 -8.377 4.529 3.093
4 1HA GLY 1 2HA GLY 1 -7.003 6.447 2.208
5 2HA GLY 1 1HA GLY 1 -6.289 5.468 3.488
6 H PHE 2 H PHE 2 -4.486 6.791 2.067
7 HA PHE 2 HA PHE 2 -2.549 6.566 0.772
8 1HB PHE 2 2HB PHE 2 -3.124 3.594 0.771
9 2HB PHE 2 1HB PHE 2 -1.556 4.391 0.646
10 HD1 PHE 2 HD1 PHE 2 -3.768 2.766 2.849
11 HD2 PHE 2 HD2 PHE 2 -1.009 6.054 2.672
12 HE1 PHE 2 HE1 PHE 2 -3.553 2.719 5.319
13 HE2 PHE 2 HE2 PHE 2 -0.795 6.008 5.143
14 HZ PHE 2 HZ PHE 2 -2.068 4.340 6.467
15 H GLY 3 H GLY 3 -5.235 6.808 -0.546
16 1HA GLY 3 2HA GLY 3 -5.991 6.956 -2.751
17 2HA GLY 3 1HA GLY 3 -4.376 6.489 -3.272
18 H CYS 4 H CYS 4 -6.909 4.804 -1.376
19 HA CYS 4 HA CYS 4 -6.528 2.444 -3.160
20 1HB CYS 4 2HB CYS 4 -7.399 2.779 -0.306
21 2HB CYS 4 1HB CYS 4 -7.941 1.364 -1.207
22 HA PRO 5 HA PRO 5 -7.734 0.508 -3.019
23 1HB PRO 5 2HB PRO 5 -9.031 -0.914 -4.975
24 2HB PRO 5 1HB PRO 5 -9.616 -0.781 -3.308
25 1HG PRO 5 2HG PRO 5 -10.666 0.519 -5.769
26 2HG PRO 5 1HG PRO 5 -11.501 0.153 -4.251
27 1HD PRO 5 2HD PRO 5 -10.489 2.692 -5.064
28 2HD PRO 5 1HD PRO 5 -11.132 2.268 -3.463
29 H ASN 6 H ASN 6 -7.269 2.924 -5.010
30 HA ASN 6 HA ASN 6 -6.480 1.897 -7.540
31 1HB ASN 6 2HB ASN 6 -6.673 4.354 -6.805
32 2HB ASN 6 1HB ASN 6 -5.052 4.159 -6.137
33 1HD2 ASN 6 1HD2 ASN 6 -6.830 3.569 -9.226
34 2HD2 ASN 6 2HD2 ASN 6 -5.510 3.953 -10.222
35 H ASN 7 H ASN 7 -4.612 0.936 -8.272
36 HA ASN 7 HA ASN 7 -2.857 -0.295 -6.278
37 1HB ASN 7 2HB ASN 7 -2.981 -0.429 -9.299
38 2HB ASN 7 1HB ASN 7 -1.756 -1.275 -8.354
39 1HD2 ASN 7 1HD2 ASN 7 -5.116 -1.326 -9.332
40 2HD2 ASN 7 2HD2 ASN 7 -5.536 -2.748 -8.508
41 H TYR 8 H TYR 8 -2.508 2.174 -8.837
42 HA TYR 8 HA TYR 8 0.316 2.523 -8.576
43 1HB TYR 8 2HB TYR 8 -0.760 3.482 -10.496
44 2HB TYR 8 1HB TYR 8 -1.881 4.398 -9.490
45 HD1 TYR 8 HD1 TYR 8 -1.395 6.630 -9.002
46 HD2 TYR 8 HD2 TYR 8 1.807 3.962 -10.044
47 HE1 TYR 8 HE1 TYR 8 0.207 8.520 -8.921
48 HE2 TYR 8 HE2 TYR 8 3.408 5.854 -9.965
49 HH TYR 8 HH TYR 8 2.866 8.735 -10.272
50 H GLN 9 H GLN 9 -2.370 4.402 -7.116
51 HA GLN 9 HA GLN 9 -0.743 6.078 -5.490
52 1HB GLN 9 2HB GLN 9 -3.574 5.082 -5.078
53 2HB GLN 9 1HB GLN 9 -2.820 6.339 -4.099
54 1HG GLN 9 2HG GLN 9 -2.378 7.623 -6.218
55 2HG GLN 9 1HG GLN 9 -3.342 6.424 -7.081
56 1HE2 GLN 9 1HE2 GLN 9 -5.631 6.585 -6.935
57 2HE2 GLN 9 2HE2 GLN 9 -6.427 7.766 -6.014
58 H CYS 10 H CYS 10 -2.285 2.943 -4.758
59 HA CYS 10 HA CYS 10 -1.404 2.743 -2.050
60 1HB CYS 10 2HB CYS 10 -3.095 1.253 -3.295
61 2HB CYS 10 1HB CYS 10 -1.694 0.382 -3.916
62 H HIS 11 H HIS 11 0.089 1.721 -5.111
63 HA HIS 11 HA HIS 11 2.388 0.441 -4.012
64 1HB HIS 11 2HB HIS 11 1.650 0.323 -6.417
65 2HB HIS 11 1HB HIS 11 2.233 1.974 -6.624
66 HD1 HIS 11 HD1 HIS 11 3.578 -1.404 -5.460
67 HD2 HIS 11 HD2 HIS 11 4.917 2.105 -7.268
68 HE1 HIS 11 HE1 HIS 11 6.015 -1.780 -6.041
69 H ARG 12 H ARG 12 1.778 3.840 -4.904
70 HA ARG 12 HA ARG 12 4.394 4.856 -4.455
71 1HB ARG 12 2HB ARG 12 2.385 6.090 -5.450
72 2HB ARG 12 1HB ARG 12 1.840 6.343 -3.792
73 1HG ARG 12 2HG ARG 12 4.676 7.034 -4.364
74 2HG ARG 12 1HG ARG 12 3.456 8.087 -5.080
75 1HD ARG 12 2HD ARG 12 3.246 7.313 -2.180
76 2HD ARG 12 1HD ARG 12 4.336 8.610 -2.665
77 HE ARG 12 HE ARG 12 1.443 8.701 -3.415
78 1HH1 ARG 12 1HH2 ARG 12 3.390 10.885 -4.178
79 2HH1 ARG 12 2HH2 ARG 12 3.099 12.062 -2.943
80 1HH2 ARG 12 2HH1 ARG 12 1.442 9.838 -0.848
81 2HH2 ARG 12 1HH1 ARG 12 1.989 11.468 -1.051
82 H HIS 13 H HIS 13 1.647 4.483 -2.191
83 HA HIS 13 HA HIS 13 2.967 5.547 0.108
84 1HB HIS 13 2HB HIS 13 0.554 5.205 0.113
85 2HB HIS 13 1HB HIS 13 0.765 3.467 -0.102
86 HD1 HIS 13 HD1 HIS 13 2.256 6.001 2.353
87 HD2 HIS 13 HD2 HIS 13 0.415 2.261 2.346
88 HE1 HIS 13 HE1 HIS 13 2.208 5.221 4.763
89 H CYS 14 H CYS 14 2.633 2.155 -1.014
90 HA CYS 14 HA CYS 14 4.176 0.974 1.075
91 1HB CYS 14 2HB CYS 14 3.705 0.103 -1.788
92 2HB CYS 14 1HB CYS 14 4.523 -0.898 -0.588
93 H LYS 15 H LYS 15 5.137 2.422 -2.021
94 HA LYS 15 HA LYS 15 7.893 1.629 -1.933
95 1HB LYS 15 2HB LYS 15 6.352 3.771 -3.370
96 2HB LYS 15 1HB LYS 15 8.115 3.796 -3.410
97 1HG LYS 15 2HG LYS 15 7.857 1.253 -4.031
98 2HG LYS 15 1HG LYS 15 6.228 1.733 -4.511
99 1HD LYS 15 2HD LYS 15 6.990 2.719 -6.390
100 2HD LYS 15 1HD LYS 15 8.207 3.626 -5.491
101 1HE LYS 15 2HE LYS 15 8.624 0.692 -5.994
102 2HE LYS 15 1HE LYS 15 8.971 1.851 -7.276
103 1HZ LYS 15 1HZ LYS 15 10.180 1.703 -4.577
104 2HZ LYS 15 2HZ LYS 15 10.327 3.078 -5.563
105 3HZ LYS 15 3HZ LYS 15 10.959 1.588 -6.078
106 H SER 16 H SER 16 6.180 4.509 -0.693
107 HA SER 16 HA SER 16 8.526 5.899 0.193
108 1HB SER 16 2HB SER 16 7.032 7.300 1.460
109 2HB SER 16 1HB SER 16 6.214 6.899 -0.045
110 HG SER 16 HG SER 16 5.074 5.286 1.095
111 H ILE 17 H ILE 17 6.697 3.236 1.554
112 HA ILE 17 HA ILE 17 7.880 3.458 4.221
113 HB ILE 17 HB ILE 17 6.433 1.117 2.933
114 1HG1 ILE 17 2HG1 ILE 17 5.203 2.992 4.934
115 2HG1 ILE 17 1HG1 ILE 17 5.265 3.474 3.239
116 1HG2 ILE 17 1HG2 ILE 17 7.181 1.785 5.792
117 2HG2 ILE 17 2HG2 ILE 17 7.664 0.369 4.858
118 3HG2 ILE 17 3HG2 ILE 17 5.987 0.558 5.371
119 1HD1 ILE 17 1HD1 ILE 17 3.542 2.118 2.746
120 2HD1 ILE 17 2HD1 ILE 17 3.391 1.742 4.461
121 3HD1 ILE 17 3HD1 ILE 17 4.397 0.733 3.423
122 HA PRO 18 HA PRO 18 11.636 1.446 2.954
123 1HB PRO 18 2HB PRO 18 12.767 1.388 5.460
124 2HB PRO 18 1HB PRO 18 12.720 2.833 4.437
125 1HG PRO 18 2HG PRO 18 11.096 2.192 6.854
126 2HG PRO 18 1HG PRO 18 11.548 3.772 6.192
127 1HD PRO 18 2HD PRO 18 9.028 2.513 5.909
128 2HD PRO 18 1HD PRO 18 9.602 3.923 4.992
129 H GLY 19 H GLY 19 11.949 -0.722 2.652
130 1HA GLY 19 2HA GLY 19 12.390 -2.938 3.659
131 2HA GLY 19 1HA GLY 19 11.086 -2.614 4.799
132 H ARG 20 H ARG 20 9.350 -1.455 2.665
133 HA ARG 20 HA ARG 20 8.397 -4.042 1.556
134 1HB ARG 20 2HB ARG 20 6.950 -1.397 1.379
135 2HB ARG 20 1HB ARG 20 6.271 -3.019 1.280
136 1HG ARG 20 2HG ARG 20 7.688 -2.138 3.785
137 2HG ARG 20 1HG ARG 20 6.011 -1.672 3.508
138 1HD ARG 20 2HD ARG 20 5.925 -4.335 2.880
139 2HD ARG 20 1HD ARG 20 7.145 -4.322 4.153
140 HE ARG 20 HE ARG 20 4.323 -3.939 4.553
141 1HH1 ARG 20 2HH1 ARG 20 6.254 -4.824 6.672
142 2HH1 ARG 20 1HH1 ARG 20 6.266 -3.468 7.746
143 1HH2 ARG 20 1HH2 ARG 20 4.840 -1.297 5.436
144 2HH2 ARG 20 2HH2 ARG 20 5.458 -1.463 7.046
145 H CYS 21 H CYS 21 8.020 -4.318 -0.681
146 HA CYS 21 HA CYS 21 9.491 -2.396 -2.428
147 1HB CYS 21 2HB CYS 21 9.419 -5.253 -2.304
148 2HB CYS 21 1HB CYS 21 8.730 -4.758 -3.850
149 H GLY 22 H GLY 22 6.543 -4.429 -2.458
150 1HA GLY 22 2HA GLY 22 5.201 -2.282 -4.044
151 2HA GLY 22 1HA GLY 22 4.989 -3.983 -4.456
152 H GLY 23 H GLY 23 2.650 -2.929 -3.998
153 1HA GLY 23 2HA GLY 23 1.744 -4.162 -1.532
154 2HA GLY 23 1HA GLY 23 1.670 -2.406 -1.448
155 H TYR 24 H TYR 24 -0.633 -3.897 -1.242
156 HA TYR 24 HA TYR 24 -2.098 -3.063 -3.689
157 1HB TYR 24 2HB TYR 24 -3.264 -5.171 -3.868
158 2HB TYR 24 1HB TYR 24 -1.539 -5.531 -3.832
159 HD1 TYR 24 HD1 TYR 24 -4.724 -5.852 -2.086
160 HD2 TYR 24 HD2 TYR 24 -0.475 -6.383 -1.729
161 HE1 TYR 24 HE1 TYR 24 -5.070 -7.264 -0.078
162 HE2 TYR 24 HE2 TYR 24 -0.824 -7.797 0.280
163 HH TYR 24 HH TYR 24 -3.462 -9.269 1.056
164 H CYS 25 H CYS 25 -4.412 -2.762 -3.274
165 HA CYS 25 HA CYS 25 -4.928 -1.871 -0.517
166 1HB CYS 25 2HB CYS 25 -6.635 -1.774 -3.023
167 2HB CYS 25 1HB CYS 25 -7.100 -1.078 -1.470
168 H GLY 26 H GLY 26 -5.640 -3.336 0.950
169 1HA GLY 26 2HA GLY 26 -7.979 -4.941 0.566
170 2HA GLY 26 1HA GLY 26 -6.553 -5.954 0.358
171 H GLY 27 H GLY 27 -8.687 -5.706 2.557
172 1HA GLY 27 2HA GLY 27 -7.840 -6.693 4.785
173 2HA GLY 27 1HA GLY 27 -6.852 -5.235 4.872
174 H TRP 28 H TRP 28 -8.017 -3.152 4.922
175 HA TRP 28 HA TRP 28 -10.523 -3.390 6.489
176 1HB TRP 28 2HB TRP 28 -8.609 -2.000 7.344
177 2HB TRP 28 1HB TRP 28 -8.833 -0.927 5.964
178 HD1 TRP 28 HD1 TRP 28 -10.683 -2.180 9.095
179 HE1 TRP 28 HE1 TRP 28 -12.450 -0.426 9.755
180 HE3 TRP 28 HE3 TRP 28 -10.254 1.040 5.153
181 HZ2 TRP 28 HZ2 TRP 28 -13.538 2.018 8.751
182 HZ3 TRP 28 HZ3 TRP 28 -11.667 3.072 5.032
183 HH2 TRP 28 HH2 TRP 28 -13.309 3.564 6.823
184 H HIS 29 H HIS 29 -12.030 -3.798 4.824
185 HA HIS 29 HA HIS 29 -13.537 -3.264 3.117
186 1HB HIS 29 2HB HIS 29 -12.744 -0.410 3.778
187 2HB HIS 29 1HB HIS 29 -14.231 -0.929 2.989
188 HD1 HIS 29 HD1 HIS 29 -13.974 0.568 5.838
189 HD2 HIS 29 HD2 HIS 29 -14.707 -3.490 5.232
190 HE1 HIS 29 HE1 HIS 29 -15.064 -0.288 7.959
191 H ARG 30 H ARG 30 -10.675 -3.673 2.453
192 HA ARG 30 HA ARG 30 -9.250 -3.513 0.613
193 1HB ARG 30 2HB ARG 30 -11.494 -4.114 -0.490
194 2HB ARG 30 1HB ARG 30 -11.608 -2.406 -0.914
195 1HG ARG 30 2HG ARG 30 -9.883 -2.521 -2.430
196 2HG ARG 30 1HG ARG 30 -9.030 -3.766 -1.521
197 1HD ARG 30 2HD ARG 30 -11.336 -5.076 -2.266
198 2HD ARG 30 1HD ARG 30 -11.023 -4.047 -3.665
199 HE ARG 30 HE ARG 30 -9.235 -6.197 -2.666
200 1HH1 ARG 30 1HH2 ARG 30 -7.845 -3.658 -3.709
201 2HH1 ARG 30 2HH2 ARG 30 -7.559 -4.098 -5.359
202 1HH2 ARG 30 2HH1 ARG 30 -9.774 -6.779 -5.298
203 2HH2 ARG 30 1HH1 ARG 30 -8.657 -5.873 -6.262
204 H LEU 31 H LEU 31 -9.690 -1.154 2.423
205 HA LEU 31 HA LEU 31 -8.896 1.033 0.553
206 1HB LEU 31 2HB LEU 31 -10.167 1.118 3.299
207 2HB LEU 31 1HB LEU 31 -9.525 2.545 2.487
208 HG LEU 31 HG LEU 31 -11.546 0.733 1.158
209 1HD1 LEU 31 1HD1 LEU 31 -12.161 3.259 2.716
210 2HD1 LEU 31 2HD1 LEU 31 -12.404 1.634 3.359
211 3HD1 LEU 31 3HD1 LEU 31 -13.315 2.169 1.947
212 1HD2 LEU 31 1HD2 LEU 31 -11.963 2.750 -0.194
213 2HD2 LEU 31 2HD2 LEU 31 -10.254 2.318 -0.253
214 3HD2 LEU 31 3HD2 LEU 31 -10.792 3.650 0.769
215 H ARG 32 H ARG 32 -7.743 -1.076 3.011
216 HA ARG 32 HA ARG 32 -5.618 0.729 3.942
217 1HB ARG 32 2HB ARG 32 -6.850 -1.262 5.213
218 2HB ARG 32 1HB ARG 32 -5.572 -2.218 4.465
219 1HG ARG 32 2HG ARG 32 -4.308 -1.588 6.239
220 2HG ARG 32 1HG ARG 32 -4.187 -0.029 5.422
221 1HD ARG 32 2HD ARG 32 -6.341 0.630 6.602
222 2HD ARG 32 1HD ARG 32 -6.165 -0.837 7.567
223 HE ARG 32 HE ARG 32 -4.184 1.408 7.575
224 1HH1 ARG 32 1HH2 ARG 32 -6.145 1.061 9.843
225 2HH1 ARG 32 2HH2 ARG 32 -5.201 0.178 10.995
226 1HH2 ARG 32 2HH1 ARG 32 -2.780 -0.760 8.683
227 2HH2 ARG 32 1HH1 ARG 32 -3.288 -0.857 10.337
228 H CYS 33 H CYS 33 -3.431 0.547 3.354
229 HA CYS 33 HA CYS 33 -2.937 -0.917 0.822
230 1HB CYS 33 2HB CYS 33 -1.721 1.427 2.195
231 2HB CYS 33 1HB CYS 33 -0.631 0.419 1.241
232 H THR 34 H THR 34 -2.462 -3.034 1.291
233 HA THR 34 HA THR 34 -0.670 -3.683 3.547
234 HB THR 34 HB THR 34 -2.056 -5.472 1.523
235 HG1 THR 34 HG1 THR 34 -3.689 -5.194 2.790
236 1HG2 THR 34 1HG2 THR 34 -1.523 -7.231 3.289
237 2HG2 THR 34 2HG2 THR 34 -0.416 -6.054 3.996
238 3HG2 THR 34 3HG2 THR 34 -0.146 -6.644 2.356
239 H CYS 35 H CYS 35 1.470 -3.418 3.153
240 HA CYS 35 HA CYS 35 2.520 -3.931 0.416
241 1HB CYS 35 2HB CYS 35 4.147 -2.749 2.651
242 2HB CYS 35 1HB CYS 35 4.312 -2.506 0.913
243 H TYR 36 H TYR 36 4.313 -5.334 0.104
244 HA TYR 36 HA TYR 36 4.762 -7.257 2.349
245 1HB TYR 36 2HB TYR 36 5.583 -8.744 0.327
246 2HB TYR 36 1HB TYR 36 3.865 -8.608 0.687
247 HD1 TYR 36 HD1 TYR 36 2.358 -7.416 -0.783
248 HD2 TYR 36 HD2 TYR 36 6.582 -7.485 -1.566
249 HE1 TYR 36 HE1 TYR 36 1.951 -6.506 -3.052
250 HE2 TYR 36 HE2 TYR 36 6.173 -6.574 -3.836
251 HH TYR 36 HH TYR 36 3.384 -6.656 -5.377
252 H ARG 37 H ARG 37 6.941 -8.184 2.512
253 HA ARG 37 HA ARG 37 9.004 -6.180 2.385
254 1HB ARG 37 2HB ARG 37 8.922 -9.110 3.046
255 2HB ARG 37 1HB ARG 37 10.481 -8.310 2.837
256 1HG ARG 37 2HG ARG 37 10.099 -6.826 4.631
257 2HG ARG 37 1HG ARG 37 8.360 -7.125 4.624
258 1HD ARG 37 2HD ARG 37 9.939 -9.562 5.048
259 2HD ARG 37 1HD ARG 37 10.186 -8.351 6.307
260 HE ARG 37 HE ARG 37 7.481 -9.398 5.555
261 1HH1 ARG 37 1HH2 ARG 37 7.545 -6.919 7.209
262 2HH1 ARG 37 2HH2 ARG 37 7.484 -7.543 8.824
263 1HH2 ARG 37 2HH1 ARG 37 8.387 -10.768 7.885
264 2HH2 ARG 37 1HH1 ARG 37 7.964 -9.734 9.208
265 H CYS 38 H CYS 38 10.987 -6.283 1.152
266 HA CYS 38 HA CYS 38 10.547 -7.301 -1.606
267 1HB CYS 38 2HB CYS 38 11.315 -4.868 -0.959
268 2HB CYS 38 1HB CYS 38 12.902 -5.619 -0.800
269 H GLY 39 HN GLY 39 11.617 -9.085 -2.306
270 1HA GLY 39 2HA GLY 39 14.050 -9.963 -0.801
271 2HA GLY 39 1HA GLY 39 12.819 -11.112 -1.326
Start of MODEL 8
1 1H GLY 1 1H GLY 1 -8.481 4.434 3.334
2 2H GLY 1 2H GLY 1 -7.358 3.420 2.558
3 3H GLY 1 3H GLY 1 -8.264 4.539 1.654
4 1HA GLY 1 2HA GLY 1 -7.109 6.372 2.508
5 2HA GLY 1 1HA GLY 1 -6.410 5.394 3.798
6 H PHE 2 H PHE 2 -4.593 6.759 2.435
7 HA PHE 2 HA PHE 2 -2.624 6.581 1.183
8 1HB PHE 2 2HB PHE 2 -3.154 3.599 1.188
9 2HB PHE 2 1HB PHE 2 -1.597 4.412 1.053
10 HD1 PHE 2 HD1 PHE 2 -3.763 2.770 3.277
11 HD2 PHE 2 HD2 PHE 2 -1.096 6.131 3.059
12 HE1 PHE 2 HE1 PHE 2 -3.551 2.763 5.747
13 HE2 PHE 2 HE2 PHE 2 -0.883 6.122 5.530
14 HZ PHE 2 HZ PHE 2 -2.111 4.437 6.874
15 H GLY 3 H GLY 3 -5.260 6.803 -0.208
16 1HA GLY 3 2HA GLY 3 -5.931 6.977 -2.440
17 2HA GLY 3 1HA GLY 3 -4.317 6.451 -2.911
18 H CYS 4 H CYS 4 -6.902 4.824 -1.027
19 HA CYS 4 HA CYS 4 -6.578 2.469 -2.826
20 1HB CYS 4 2HB CYS 4 -7.505 2.813 0.013
21 2HB CYS 4 1HB CYS 4 -8.028 1.403 -0.907
22 HA PRO 5 HA PRO 5 -7.825 0.564 -2.768
23 1HB PRO 5 2HB PRO 5 -9.084 -0.746 -4.827
24 2HB PRO 5 1HB PRO 5 -9.718 -0.675 -3.175
25 1HG PRO 5 2HG PRO 5 -10.665 0.756 -5.605
26 2HG PRO 5 1HG PRO 5 -11.556 0.330 -4.134
27 1HD PRO 5 2HD PRO 5 -10.494 2.889 -4.783
28 2HD PRO 5 1HD PRO 5 -11.172 2.389 -3.219
29 H ASN 6 H ASN 6 -7.445 3.058 -4.784
30 HA ASN 6 HA ASN 6 -6.483 2.101 -7.260
31 1HB ASN 6 2HB ASN 6 -6.784 4.539 -6.399
32 2HB ASN 6 1HB ASN 6 -5.140 4.364 -5.789
33 1HD2 ASN 6 1HD2 ASN 6 -6.980 5.116 -8.585
34 2HD2 ASN 6 2HD2 ASN 6 -5.711 5.058 -9.711
35 H ASN 7 H ASN 7 -4.815 0.759 -7.718
36 HA ASN 7 HA ASN 7 -2.942 -0.096 -5.664
37 1HB ASN 7 2HB ASN 7 -3.185 -0.681 -8.621
38 2HB ASN 7 1HB ASN 7 -1.882 -1.340 -7.633
39 1HD2 ASN 7 1HD2 ASN 7 -5.122 -1.867 -8.616
40 2HD2 ASN 7 2HD2 ASN 7 -5.514 -3.067 -7.483
41 H TYR 8 H TYR 8 -2.855 2.196 -8.344
42 HA TYR 8 HA TYR 8 -0.003 2.562 -8.414
43 1HB TYR 8 2HB TYR 8 -1.864 3.372 -10.083
44 2HB TYR 8 1HB TYR 8 -1.947 4.780 -9.025
45 HD1 TYR 8 HD1 TYR 8 0.299 2.773 -11.201
46 HD2 TYR 8 HD2 TYR 8 -0.212 6.432 -9.007
47 HE1 TYR 8 HE1 TYR 8 2.318 3.709 -12.293
48 HE2 TYR 8 HE2 TYR 8 1.808 7.368 -10.100
49 HH TYR 8 HH TYR 8 4.065 5.973 -11.291
50 H GLN 9 H GLN 9 -2.619 4.339 -6.737
51 HA GLN 9 HA GLN 9 -0.864 6.156 -5.354
52 1HB GLN 9 2HB GLN 9 -3.642 5.205 -4.589
53 2HB GLN 9 1HB GLN 9 -2.819 6.613 -3.921
54 1HG GLN 9 2HG GLN 9 -2.732 7.634 -6.165
55 2HG GLN 9 1HG GLN 9 -3.557 6.228 -6.838
56 1HE2 GLN 9 1HE2 GLN 9 -4.004 9.027 -4.668
57 2HE2 GLN 9 2HE2 GLN 9 -5.700 8.977 -4.690
58 H CYS 10 H CYS 10 -2.379 3.060 -4.458
59 HA CYS 10 HA CYS 10 -1.389 2.889 -1.791
60 1HB CYS 10 2HB CYS 10 -3.107 1.370 -2.924
61 2HB CYS 10 1HB CYS 10 -1.742 0.534 -3.661
62 H HIS 11 H HIS 11 0.006 1.843 -4.896
63 HA HIS 11 HA HIS 11 2.351 0.596 -3.878
64 1HB HIS 11 2HB HIS 11 1.505 0.533 -6.275
65 2HB HIS 11 1HB HIS 11 2.173 2.154 -6.471
66 HD1 HIS 11 HD1 HIS 11 3.289 -1.365 -5.558
67 HD2 HIS 11 HD2 HIS 11 4.913 2.204 -6.973
68 HE1 HIS 11 HE1 HIS 11 5.706 -1.857 -6.137
69 H ARG 12 H ARG 12 1.695 3.994 -4.735
70 HA ARG 12 HA ARG 12 4.328 5.008 -4.329
71 1HB ARG 12 2HB ARG 12 2.159 6.161 -5.270
72 2HB ARG 12 1HB ARG 12 1.888 6.605 -3.585
73 1HG ARG 12 2HG ARG 12 4.613 7.076 -4.719
74 2HG ARG 12 1HG ARG 12 3.315 8.159 -5.225
75 1HD ARG 12 2HD ARG 12 2.781 8.273 -2.655
76 2HD ARG 12 1HD ARG 12 4.445 7.717 -2.474
77 HE ARG 12 HE ARG 12 3.671 10.262 -3.844
78 1HH1 ARG 12 1HH2 ARG 12 4.807 10.594 -1.175
79 2HH1 ARG 12 2HH2 ARG 12 6.506 10.755 -1.471
80 1HH2 ARG 12 2HH1 ARG 12 6.333 9.443 -4.687
81 2HH2 ARG 12 1HH1 ARG 12 7.374 10.099 -3.468
82 H HIS 13 H HIS 13 1.606 4.571 -2.066
83 HA HIS 13 HA HIS 13 2.923 5.691 0.229
84 1HB HIS 13 2HB HIS 13 0.510 5.413 0.238
85 2HB HIS 13 1HB HIS 13 0.666 3.675 -0.010
86 HD1 HIS 13 HD1 HIS 13 2.079 6.171 2.524
87 HD2 HIS 13 HD2 HIS 13 0.369 2.373 2.394
88 HE1 HIS 13 HE1 HIS 13 2.001 5.338 4.915
89 H CYS 14 H CYS 14 2.596 2.322 -0.939
90 HA CYS 14 HA CYS 14 4.105 1.149 1.209
91 1HB CYS 14 2HB CYS 14 3.466 0.216 -1.596
92 2HB CYS 14 1HB CYS 14 4.400 -0.764 -0.466
93 H LYS 15 H LYS 15 5.026 2.518 -1.927
94 HA LYS 15 HA LYS 15 7.750 1.613 -1.918
95 1HB LYS 15 2HB LYS 15 6.231 3.766 -3.350
96 2HB LYS 15 1HB LYS 15 7.993 3.776 -3.420
97 1HG LYS 15 2HG LYS 15 7.423 1.124 -3.886
98 2HG LYS 15 1HG LYS 15 6.077 1.935 -4.688
99 1HD LYS 15 2HD LYS 15 7.409 2.575 -6.384
100 2HD LYS 15 1HD LYS 15 8.529 3.344 -5.261
101 1HE LYS 15 2HE LYS 15 8.974 0.599 -4.920
102 2HE LYS 15 1HE LYS 15 8.785 0.804 -6.661
103 1HZ LYS 15 1HZ LYS 15 11.090 1.112 -5.862
104 2HZ LYS 15 2HZ LYS 15 10.579 2.465 -4.972
105 3HZ LYS 15 3HZ LYS 15 10.476 2.472 -6.668
106 H SER 16 H SER 16 6.201 4.573 -0.641
107 HA SER 16 HA SER 16 8.635 5.894 0.098
108 1HB SER 16 2HB SER 16 7.253 7.327 1.480
109 2HB SER 16 1HB SER 16 6.382 6.997 -0.012
110 HG SER 16 HG SER 16 5.872 6.181 2.595
111 H ILE 17 H ILE 17 6.774 3.335 1.622
112 HA ILE 17 HA ILE 17 8.161 3.536 4.190
113 HB ILE 17 HB ILE 17 6.487 1.268 3.052
114 1HG1 ILE 17 2HG1 ILE 17 5.510 3.180 5.143
115 2HG1 ILE 17 1HG1 ILE 17 5.514 3.718 3.463
116 1HG2 ILE 17 1HG2 ILE 17 7.875 0.505 4.892
117 2HG2 ILE 17 2HG2 ILE 17 6.225 0.692 5.486
118 3HG2 ILE 17 3HG2 ILE 17 7.440 1.915 5.859
119 1HD1 ILE 17 1HD1 ILE 17 3.972 1.470 4.724
120 2HD1 ILE 17 2HD1 ILE 17 4.377 1.393 3.009
121 3HD1 ILE 17 3HD1 ILE 17 3.408 2.729 3.627
122 HA PRO 18 HA PRO 18 11.696 1.287 2.717
123 1HB PRO 18 2HB PRO 18 12.954 1.114 5.156
124 2HB PRO 18 1HB PRO 18 12.951 2.573 4.151
125 1HG PRO 18 2HG PRO 18 11.414 2.008 6.645
126 2HG PRO 18 1HG PRO 18 11.947 3.563 5.982
127 1HD PRO 18 2HD PRO 18 9.330 2.506 5.815
128 2HD PRO 18 1HD PRO 18 9.964 3.872 4.874
129 H GLY 19 H GLY 19 12.411 -0.883 2.733
130 1HA GLY 19 2HA GLY 19 12.558 -3.135 3.530
131 2HA GLY 19 1HA GLY 19 11.375 -2.748 4.778
132 H ARG 20 H ARG 20 9.988 -1.470 2.097
133 HA ARG 20 HA ARG 20 8.655 -4.047 1.367
134 1HB ARG 20 2HB ARG 20 7.243 -1.401 1.154
135 2HB ARG 20 1HB ARG 20 6.555 -3.012 1.330
136 1HG ARG 20 2HG ARG 20 8.261 -1.963 3.557
137 2HG ARG 20 1HG ARG 20 6.630 -1.319 3.382
138 1HD ARG 20 2HD ARG 20 5.950 -3.848 3.177
139 2HD ARG 20 1HD ARG 20 7.495 -4.134 3.976
140 HE ARG 20 HE ARG 20 6.634 -2.610 5.818
141 1HH1 ARG 20 1HH2 ARG 20 5.148 -5.290 5.610
142 2HH1 ARG 20 2HH2 ARG 20 3.507 -4.767 5.781
143 1HH2 ARG 20 2HH1 ARG 20 4.237 -1.418 5.186
144 2HH2 ARG 20 1HH1 ARG 20 2.991 -2.562 5.553
145 H CYS 21 H CYS 21 8.206 -4.359 -0.841
146 HA CYS 21 HA CYS 21 9.640 -2.506 -2.677
147 1HB CYS 21 2HB CYS 21 9.317 -5.362 -2.564
148 2HB CYS 21 1HB CYS 21 8.659 -4.770 -4.089
149 H GLY 22 H GLY 22 6.503 -4.191 -2.367
150 1HA GLY 22 2HA GLY 22 5.241 -1.942 -3.837
151 2HA GLY 22 1HA GLY 22 4.957 -3.579 -4.419
152 H GLY 23 H GLY 23 2.656 -2.707 -3.866
153 1HA GLY 23 2HA GLY 23 1.781 -4.048 -1.456
154 2HA GLY 23 1HA GLY 23 1.692 -2.299 -1.275
155 H TYR 24 H TYR 24 -0.619 -3.741 -1.123
156 HA TYR 24 HA TYR 24 -2.083 -2.808 -3.530
157 1HB TYR 24 2HB TYR 24 -3.274 -4.910 -3.788
158 2HB TYR 24 1HB TYR 24 -1.543 -5.241 -3.856
159 HD1 TYR 24 HD1 TYR 24 -0.374 -6.228 -1.880
160 HD2 TYR 24 HD2 TYR 24 -4.639 -5.729 -1.981
161 HE1 TYR 24 HE1 TYR 24 -0.603 -7.792 0.030
162 HE2 TYR 24 HE2 TYR 24 -4.868 -7.293 -0.073
163 HH TYR 24 HH TYR 24 -2.716 -8.022 1.973
164 H CYS 25 H CYS 25 -4.455 -2.691 -3.105
165 HA CYS 25 HA CYS 25 -4.963 -1.906 -0.300
166 1HB CYS 25 2HB CYS 25 -6.656 -1.653 -2.806
167 2HB CYS 25 1HB CYS 25 -7.127 -1.053 -1.216
168 H GLY 26 H GLY 26 -5.913 -3.307 1.104
169 1HA GLY 26 2HA GLY 26 -8.149 -4.974 0.463
170 2HA GLY 26 1HA GLY 26 -6.686 -5.953 0.418
171 H GLY 27 H GLY 27 -9.096 -5.648 2.366
172 1HA GLY 27 2HA GLY 27 -8.512 -6.675 4.668
173 2HA GLY 27 1HA GLY 27 -7.522 -5.231 4.873
174 H TRP 28 H TRP 28 -8.541 -3.238 5.270
175 HA TRP 28 HA TRP 28 -11.254 -3.428 6.371
176 1HB TRP 28 2HB TRP 28 -9.413 -2.109 7.470
177 2HB TRP 28 1HB TRP 28 -9.472 -0.986 6.113
178 HD1 TRP 28 HD1 TRP 28 -11.685 -2.320 8.968
179 HE1 TRP 28 HE1 TRP 28 -13.467 -0.541 9.513
180 HE3 TRP 28 HE3 TRP 28 -10.729 1.057 5.258
181 HZ2 TRP 28 HZ2 TRP 28 -14.367 1.980 8.513
182 HZ3 TRP 28 HZ3 TRP 28 -12.061 3.138 5.081
183 HH2 TRP 28 HH2 TRP 28 -13.880 3.603 6.700
184 H HIS 29 H HIS 29 -12.609 -3.724 4.569
185 HA HIS 29 HA HIS 29 -13.903 -3.106 2.720
186 1HB HIS 29 2HB HIS 29 -13.096 -0.292 3.524
187 2HB HIS 29 1HB HIS 29 -14.510 -0.751 2.582
188 HD1 HIS 29 HD1 HIS 29 -14.492 0.691 5.468
189 HD2 HIS 29 HD2 HIS 29 -15.292 -3.328 4.715
190 HE1 HIS 29 HE1 HIS 29 -15.816 -0.160 7.453
191 H ARG 30 H ARG 30 -11.014 -3.616 2.362
192 HA ARG 30 HA ARG 30 -9.370 -3.454 0.718
193 1HB ARG 30 2HB ARG 30 -11.369 -4.059 -0.696
194 2HB ARG 30 1HB ARG 30 -11.601 -2.337 -1.004
195 1HG ARG 30 2HG ARG 30 -9.751 -2.186 -2.352
196 2HG ARG 30 1HG ARG 30 -8.863 -3.407 -1.447
197 1HD ARG 30 2HD ARG 30 -10.788 -4.980 -2.449
198 2HD ARG 30 1HD ARG 30 -10.781 -3.738 -3.702
199 HE ARG 30 HE ARG 30 -8.130 -4.801 -2.967
200 1HH1 ARG 30 1HH2 ARG 30 -9.125 -3.509 -5.605
201 2HH1 ARG 30 2HH2 ARG 30 -9.077 -4.882 -6.660
202 1HH2 ARG 30 2HH1 ARG 30 -8.826 -7.191 -4.071
203 2HH2 ARG 30 1HH1 ARG 30 -8.904 -6.974 -5.788
204 H LEU 31 H LEU 31 -9.801 -1.184 2.527
205 HA LEU 31 HA LEU 31 -8.896 1.069 0.789
206 1HB LEU 31 2HB LEU 31 -10.259 1.062 3.492
207 2HB LEU 31 1HB LEU 31 -9.557 2.508 2.767
208 HG LEU 31 HG LEU 31 -11.544 0.808 1.258
209 1HD1 LEU 31 1HD1 LEU 31 -13.322 2.294 2.039
210 2HD1 LEU 31 2HD1 LEU 31 -12.172 3.180 3.042
211 3HD1 LEU 31 3HD1 LEU 31 -12.563 1.502 3.420
212 1HD2 LEU 31 1HD2 LEU 31 -10.876 3.764 1.100
213 2HD2 LEU 31 2HD2 LEU 31 -11.857 2.835 -0.033
214 3HD2 LEU 31 3HD2 LEU 31 -10.125 2.532 0.084
215 H ARG 32 H ARG 32 -7.924 -1.125 3.287
216 HA ARG 32 HA ARG 32 -5.753 0.563 4.303
217 1HB ARG 32 2HB ARG 32 -7.077 -1.467 5.445
218 2HB ARG 32 1HB ARG 32 -5.766 -2.397 4.719
219 1HG ARG 32 2HG ARG 32 -4.162 -0.719 5.780
220 2HG ARG 32 1HG ARG 32 -5.544 -0.115 6.694
221 1HD ARG 32 2HD ARG 32 -5.305 -1.787 8.176
222 2HD ARG 32 1HD ARG 32 -5.536 -2.970 6.888
223 HE ARG 32 HE ARG 32 -2.928 -2.024 7.926
224 1HH1 ARG 32 1HH2 ARG 32 -3.743 -4.926 7.697
225 2HH1 ARG 32 2HH2 ARG 32 -2.873 -5.424 6.284
226 1HH2 ARG 32 2HH1 ARG 32 -2.226 -2.187 5.214
227 2HH2 ARG 32 1HH1 ARG 32 -2.020 -3.874 4.878
228 H CYS 33 H CYS 33 -3.616 0.480 3.631
229 HA CYS 33 HA CYS 33 -3.088 -0.983 1.112
230 1HB CYS 33 2HB CYS 33 -1.917 1.370 2.500
231 2HB CYS 33 1HB CYS 33 -0.801 0.387 1.553
232 H THR 34 H THR 34 -2.270 -2.994 1.274
233 HA THR 34 HA THR 34 -0.577 -3.696 3.616
234 HB THR 34 HB THR 34 -1.928 -5.456 1.544
235 HG1 THR 34 HG1 THR 34 -3.559 -5.185 2.818
236 1HG2 THR 34 1HG2 THR 34 0.018 -5.980 3.727
237 2HG2 THR 34 2HG2 THR 34 -0.263 -6.872 2.233
238 3HG2 THR 34 3HG2 THR 34 -1.340 -7.097 3.611
239 H CYS 35 H CYS 35 1.557 -3.382 3.238
240 HA CYS 35 HA CYS 35 2.620 -3.751 0.484
241 1HB CYS 35 2HB CYS 35 4.261 -2.731 2.788
242 2HB CYS 35 1HB CYS 35 4.407 -2.361 1.071
243 H TYR 36 H TYR 36 4.231 -5.273 0.037
244 HA TYR 36 HA TYR 36 4.682 -7.299 2.179
245 1HB TYR 36 2HB TYR 36 5.569 -8.637 0.071
246 2HB TYR 36 1HB TYR 36 3.845 -8.537 0.411
247 HD1 TYR 36 HD1 TYR 36 2.358 -7.210 -0.977
248 HD2 TYR 36 HD2 TYR 36 6.587 -7.290 -1.731
249 HE1 TYR 36 HE1 TYR 36 1.985 -6.147 -3.186
250 HE2 TYR 36 HE2 TYR 36 6.212 -6.227 -3.939
251 HH TYR 36 HH TYR 36 3.457 -6.171 -5.511
252 H ARG 37 H ARG 37 6.848 -8.293 2.296
253 HA ARG 37 HA ARG 37 8.935 -6.261 2.295
254 1HB ARG 37 2HB ARG 37 9.049 -9.242 2.857
255 2HB ARG 37 1HB ARG 37 10.370 -8.110 3.147
256 1HG ARG 37 2HG ARG 37 7.912 -7.122 4.328
257 2HG ARG 37 1HG ARG 37 8.272 -8.746 4.916
258 1HD ARG 37 2HD ARG 37 10.541 -8.039 5.537
259 2HD ARG 37 1HD ARG 37 10.223 -6.423 4.907
260 HE ARG 37 HE ARG 37 9.287 -7.486 7.464
261 1HH1 ARG 37 1HH2 ARG 37 10.017 -4.639 6.090
262 2HH1 ARG 37 2HH2 ARG 37 8.577 -3.787 6.533
263 1HH2 ARG 37 2HH1 ARG 37 6.879 -6.644 7.547
264 2HH2 ARG 37 1HH1 ARG 37 6.800 -4.922 7.374
265 H CYS 38 H CYS 38 10.809 -6.212 0.996
266 HA CYS 38 HA CYS 38 10.509 -7.517 -1.645
267 1HB CYS 38 2HB CYS 38 11.152 -5.006 -1.174
268 2HB CYS 38 1HB CYS 38 12.772 -5.668 -0.952
269 H GLY 39 HN GLY 39 11.608 -9.343 -2.123
270 1HA GLY 39 2HA GLY 39 13.727 -10.286 -0.286
271 2HA GLY 39 1HA GLY 39 12.948 -11.246 -1.545
Start of MODEL 9
1 1H GLY 1 1H GLY 1 -8.363 4.752 1.555
2 2H GLY 1 2H GLY 1 -8.588 4.445 3.211
3 3H GLY 1 3H GLY 1 -7.512 3.488 2.307
4 1HA GLY 1 2HA GLY 1 -7.107 6.405 2.564
5 2HA GLY 1 1HA GLY 1 -6.524 5.294 3.801
6 H PHE 2 H PHE 2 -4.592 6.675 2.583
7 HA PHE 2 HA PHE 2 -2.590 6.479 1.381
8 1HB PHE 2 2HB PHE 2 -3.154 3.525 1.127
9 2HB PHE 2 1HB PHE 2 -1.599 4.335 1.300
10 HD1 PHE 2 HD1 PHE 2 -1.366 5.795 3.535
11 HD2 PHE 2 HD2 PHE 2 -4.077 2.505 3.004
12 HE1 PHE 2 HE1 PHE 2 -1.502 5.509 5.994
13 HE2 PHE 2 HE2 PHE 2 -4.211 2.218 5.463
14 HZ PHE 2 HZ PHE 2 -2.925 3.720 6.958
15 H GLY 3 H GLY 3 -5.189 6.830 -0.086
16 1HA GLY 3 2HA GLY 3 -5.771 7.114 -2.335
17 2HA GLY 3 1HA GLY 3 -4.161 6.543 -2.771
18 H CYS 4 H CYS 4 -6.761 4.888 -0.946
19 HA CYS 4 HA CYS 4 -6.519 2.618 -2.859
20 1HB CYS 4 2HB CYS 4 -7.397 2.860 0.005
21 2HB CYS 4 1HB CYS 4 -7.976 1.506 -0.964
22 HA PRO 5 HA PRO 5 -7.831 0.716 -2.796
23 1HB PRO 5 2HB PRO 5 -9.148 -0.524 -4.860
24 2HB PRO 5 1HB PRO 5 -9.761 -0.463 -3.199
25 1HG PRO 5 2HG PRO 5 -10.694 1.034 -5.596
26 2HG PRO 5 1HG PRO 5 -11.581 0.608 -4.124
27 1HD PRO 5 2HD PRO 5 -10.458 3.149 -4.739
28 2HD PRO 5 1HD PRO 5 -11.129 2.639 -3.175
29 H ASN 6 H ASN 6 -7.399 3.230 -4.787
30 HA ASN 6 HA ASN 6 -6.464 2.206 -7.269
31 1HB ASN 6 2HB ASN 6 -6.814 4.662 -6.547
32 2HB ASN 6 1HB ASN 6 -5.197 4.555 -5.853
33 1HD2 ASN 6 1HD2 ASN 6 -6.952 5.006 -8.804
34 2HD2 ASN 6 2HD2 ASN 6 -5.616 4.976 -9.850
35 H ASN 7 H ASN 7 -4.699 0.993 -7.755
36 HA ASN 7 HA ASN 7 -2.853 0.187 -5.642
37 1HB ASN 7 2HB ASN 7 -3.044 -0.483 -8.585
38 2HB ASN 7 1HB ASN 7 -1.771 -1.118 -7.542
39 1HD2 ASN 7 1HD2 ASN 7 -4.886 -1.790 -8.682
40 2HD2 ASN 7 2HD2 ASN 7 -5.359 -2.898 -7.487
41 H TYR 8 H TYR 8 -2.801 2.509 -8.280
42 HA TYR 8 HA TYR 8 0.057 2.844 -8.414
43 1HB TYR 8 2HB TYR 8 -1.970 3.761 -9.931
44 2HB TYR 8 1HB TYR 8 -1.741 5.177 -8.908
45 HD1 TYR 8 HD1 TYR 8 -0.487 3.287 -11.701
46 HD2 TYR 8 HD2 TYR 8 0.620 6.167 -8.712
47 HE1 TYR 8 HE1 TYR 8 1.490 3.927 -13.052
48 HE2 TYR 8 HE2 TYR 8 2.599 6.808 -10.063
49 HH TYR 8 HH TYR 8 3.756 4.965 -12.619
50 H GLN 9 H GLN 9 -2.504 4.675 -6.708
51 HA GLN 9 HA GLN 9 -0.683 6.369 -5.252
52 1HB GLN 9 2HB GLN 9 -3.529 5.546 -4.580
53 2HB GLN 9 1HB GLN 9 -2.649 6.878 -3.834
54 1HG GLN 9 2HG GLN 9 -2.928 6.782 -6.826
55 2HG GLN 9 1HG GLN 9 -4.271 7.368 -5.845
56 1HE2 GLN 9 1HE2 GLN 9 -3.823 9.280 -4.419
57 2HE2 GLN 9 2HE2 GLN 9 -2.566 10.347 -4.826
58 H CYS 10 H CYS 10 -2.284 3.277 -4.546
59 HA CYS 10 HA CYS 10 -1.433 2.973 -1.841
60 1HB CYS 10 2HB CYS 10 -3.117 1.541 -3.137
61 2HB CYS 10 1HB CYS 10 -1.726 0.713 -3.835
62 H HIS 11 H HIS 11 0.089 2.044 -4.922
63 HA HIS 11 HA HIS 11 2.365 0.709 -3.861
64 1HB HIS 11 2HB HIS 11 1.644 0.757 -6.287
65 2HB HIS 11 1HB HIS 11 2.302 2.391 -6.382
66 HD1 HIS 11 HD1 HIS 11 3.431 -1.145 -5.545
67 HD2 HIS 11 HD2 HIS 11 5.045 2.483 -6.807
68 HE1 HIS 11 HE1 HIS 11 5.872 -1.587 -6.056
69 H ARG 12 H ARG 12 1.785 4.154 -4.561
70 HA ARG 12 HA ARG 12 4.411 5.107 -3.982
71 1HB ARG 12 2HB ARG 12 2.115 6.287 -4.846
72 2HB ARG 12 1HB ARG 12 2.132 6.827 -3.167
73 1HG ARG 12 2HG ARG 12 4.279 7.848 -3.415
74 2HG ARG 12 1HG ARG 12 4.552 7.059 -4.969
75 1HD ARG 12 2HD ARG 12 2.170 8.858 -4.643
76 2HD ARG 12 1HD ARG 12 3.760 9.575 -4.893
77 HE ARG 12 HE ARG 12 2.179 8.256 -6.918
78 1HH1 ARG 12 2HH1 ARG 12 4.357 10.346 -7.322
79 2HH1 ARG 12 1HH1 ARG 12 5.556 9.428 -8.170
80 1HH2 ARG 12 1HH2 ARG 12 4.159 6.353 -7.330
81 2HH2 ARG 12 2HH2 ARG 12 5.444 7.152 -8.175
82 H HIS 13 H HIS 13 1.559 4.640 -1.880
83 HA HIS 13 HA HIS 13 2.768 5.604 0.529
84 1HB HIS 13 2HB HIS 13 0.348 5.291 0.375
85 2HB HIS 13 1HB HIS 13 0.559 3.560 0.117
86 HD1 HIS 13 HD1 HIS 13 1.691 6.099 2.748
87 HD2 HIS 13 HD2 HIS 13 0.289 2.184 2.486
88 HE1 HIS 13 HE1 HIS 13 1.542 5.231 5.123
89 H CYS 14 H CYS 14 2.531 2.317 -0.857
90 HA CYS 14 HA CYS 14 3.929 1.005 1.279
91 1HB CYS 14 2HB CYS 14 3.419 0.289 -1.610
92 2HB CYS 14 1HB CYS 14 4.359 -0.761 -0.548
93 H LYS 15 H LYS 15 5.024 2.495 -1.757
94 HA LYS 15 HA LYS 15 7.765 1.665 -1.557
95 1HB LYS 15 2HB LYS 15 6.301 3.807 -3.067
96 2HB LYS 15 1HB LYS 15 8.064 3.841 -3.018
97 1HG LYS 15 2HG LYS 15 7.648 1.212 -3.576
98 2HG LYS 15 1HG LYS 15 6.247 1.928 -4.371
99 1HD LYS 15 2HD LYS 15 7.512 2.886 -5.992
100 2HD LYS 15 1HD LYS 15 8.744 3.408 -4.844
101 1HE LYS 15 2HE LYS 15 8.477 0.502 -5.605
102 2HE LYS 15 1HE LYS 15 9.403 1.617 -6.607
103 1HZ LYS 15 1HZ LYS 15 10.842 0.562 -5.015
104 2HZ LYS 15 2HZ LYS 15 9.849 1.049 -3.724
105 3HZ LYS 15 3HZ LYS 15 10.703 2.209 -4.626
106 H SER 16 H SER 16 6.020 4.540 -0.359
107 HA SER 16 HA SER 16 8.295 5.987 0.567
108 1HB SER 16 2HB SER 16 6.765 7.294 1.862
109 2HB SER 16 1HB SER 16 5.893 6.831 0.406
110 HG SER 16 HG SER 16 4.862 5.219 1.585
111 H ILE 17 H ILE 17 6.573 3.233 1.913
112 HA ILE 17 HA ILE 17 7.899 3.416 4.523
113 HB ILE 17 HB ILE 17 6.300 1.146 3.290
114 1HG1 ILE 17 2HG1 ILE 17 5.239 2.925 5.448
115 2HG1 ILE 17 1HG1 ILE 17 5.278 3.569 3.807
116 1HG2 ILE 17 1HG2 ILE 17 6.019 0.526 5.737
117 2HG2 ILE 17 2HG2 ILE 17 7.278 1.704 6.102
118 3HG2 ILE 17 3HG2 ILE 17 7.646 0.304 5.096
119 1HD1 ILE 17 1HD1 ILE 17 3.182 2.534 3.871
120 2HD1 ILE 17 2HD1 ILE 17 3.762 1.200 4.867
121 3HD1 ILE 17 3HD1 ILE 17 4.190 1.276 3.159
122 HA PRO 18 HA PRO 18 11.514 1.324 2.999
123 1HB PRO 18 2HB PRO 18 12.782 1.166 5.435
124 2HB PRO 18 1HB PRO 18 12.725 2.638 4.450
125 1HG PRO 18 2HG PRO 18 11.215 1.985 6.938
126 2HG PRO 18 1HG PRO 18 11.688 3.567 6.294
127 1HD PRO 18 2HD PRO 18 9.112 2.412 6.118
128 2HD PRO 18 1HD PRO 18 9.690 3.817 5.197
129 H GLY 19 H GLY 19 12.121 -0.841 2.849
130 1HA GLY 19 2HA GLY 19 12.413 -3.081 3.745
131 2HA GLY 19 1HA GLY 19 11.132 -2.751 4.908
132 H ARG 20 H ARG 20 9.648 -1.482 2.420
133 HA ARG 20 HA ARG 20 8.584 -4.096 1.436
134 1HB ARG 20 2HB ARG 20 7.044 -1.513 1.304
135 2HB ARG 20 1HB ARG 20 6.430 -3.164 1.312
136 1HG ARG 20 2HG ARG 20 7.941 -2.123 3.700
137 2HG ARG 20 1HG ARG 20 6.241 -1.714 3.488
138 1HD ARG 20 2HD ARG 20 6.440 -4.485 2.967
139 2HD ARG 20 1HD ARG 20 7.404 -4.195 4.412
140 HE ARG 20 HE ARG 20 4.629 -4.342 4.477
141 1HH1 ARG 20 2HH1 ARG 20 6.118 -3.739 6.962
142 2HH1 ARG 20 1HH1 ARG 20 5.566 -2.149 7.366
143 1HH2 ARG 20 1HH2 ARG 20 4.297 -1.496 4.199
144 2HH2 ARG 20 2HH2 ARG 20 4.538 -0.871 5.794
145 H CYS 21 H CYS 21 8.182 -4.331 -0.792
146 HA CYS 21 HA CYS 21 9.632 -2.390 -2.521
147 1HB CYS 21 2HB CYS 21 9.381 -5.240 -2.507
148 2HB CYS 21 1HB CYS 21 8.671 -4.639 -4.005
149 H GLY 22 H GLY 22 6.555 -4.229 -2.530
150 1HA GLY 22 2HA GLY 22 5.277 -1.904 -3.888
151 2HA GLY 22 1HA GLY 22 5.026 -3.531 -4.515
152 H GLY 23 H GLY 23 2.702 -2.689 -3.987
153 1HA GLY 23 2HA GLY 23 1.780 -4.117 -1.652
154 2HA GLY 23 1HA GLY 23 1.704 -2.378 -1.386
155 H TYR 24 H TYR 24 -0.623 -3.814 -1.348
156 HA TYR 24 HA TYR 24 -2.022 -2.761 -3.749
157 1HB TYR 24 2HB TYR 24 -3.303 -4.834 -4.016
158 2HB TYR 24 1HB TYR 24 -1.581 -5.179 -4.161
159 HD1 TYR 24 HD1 TYR 24 -4.610 -5.704 -2.188
160 HD2 TYR 24 HD2 TYR 24 -0.346 -6.235 -2.264
161 HE1 TYR 24 HE1 TYR 24 -4.778 -7.332 -0.325
162 HE2 TYR 24 HE2 TYR 24 -0.516 -7.862 -0.402
163 HH TYR 24 HH TYR 24 -2.758 -8.121 1.617
164 H CYS 25 H CYS 25 -4.387 -2.555 -3.361
165 HA CYS 25 HA CYS 25 -4.911 -1.772 -0.568
166 1HB CYS 25 2HB CYS 25 -6.541 -1.515 -3.110
167 2HB CYS 25 1HB CYS 25 -7.105 -0.973 -1.529
168 H GLY 26 H GLY 26 -5.631 -3.307 0.817
169 1HA GLY 26 2HA GLY 26 -7.988 -4.862 0.342
170 2HA GLY 26 1HA GLY 26 -6.571 -5.881 0.095
171 H GLY 27 H GLY 27 -8.743 -5.605 2.305
172 1HA GLY 27 2HA GLY 27 -7.868 -6.748 4.485
173 2HA GLY 27 1HA GLY 27 -6.930 -5.264 4.650
174 H TRP 28 H TRP 28 -8.048 -3.287 5.069
175 HA TRP 28 HA TRP 28 -10.616 -3.669 6.463
176 1HB TRP 28 2HB TRP 28 -8.768 -2.299 7.460
177 2HB TRP 28 1HB TRP 28 -8.964 -1.144 6.143
178 HD1 TRP 28 HD1 TRP 28 -10.897 -2.616 9.128
179 HE1 TRP 28 HE1 TRP 28 -12.709 -0.928 9.838
180 HE3 TRP 28 HE3 TRP 28 -10.382 0.849 5.412
181 HZ2 TRP 28 HZ2 TRP 28 -13.795 1.563 8.952
182 HZ3 TRP 28 HZ3 TRP 28 -11.818 2.869 5.371
183 HH2 TRP 28 HH2 TRP 28 -13.523 3.228 7.133
184 H HIS 29 H HIS 29 -12.118 -3.970 4.797
185 HA HIS 29 HA HIS 29 -13.614 -3.362 3.109
186 1HB HIS 29 2HB HIS 29 -12.855 -0.548 3.958
187 2HB HIS 29 1HB HIS 29 -14.318 -1.019 3.099
188 HD1 HIS 29 HD1 HIS 29 -14.182 0.290 6.031
189 HD2 HIS 29 HD2 HIS 29 -14.792 -3.740 5.166
190 HE1 HIS 29 HE1 HIS 29 -15.302 -0.719 8.067
191 H ARG 30 H ARG 30 -10.756 -3.718 2.412
192 HA ARG 30 HA ARG 30 -9.355 -3.455 0.554
193 1HB ARG 30 2HB ARG 30 -11.613 -3.953 -0.555
194 2HB ARG 30 1HB ARG 30 -11.747 -2.215 -0.820
195 1HG ARG 30 2HG ARG 30 -9.800 -2.175 -2.204
196 2HG ARG 30 1HG ARG 30 -9.333 -3.804 -1.715
197 1HD ARG 30 2HD ARG 30 -11.391 -4.693 -2.790
198 2HD ARG 30 1HD ARG 30 -11.791 -3.063 -3.330
199 HE ARG 30 HE ARG 30 -9.335 -3.328 -4.411
200 1HH1 ARG 30 2HH1 ARG 30 -9.457 -6.296 -4.092
201 2HH1 ARG 30 1HH1 ARG 30 -10.167 -6.802 -5.587
202 1HH2 ARG 30 1HH2 ARG 30 -11.354 -3.635 -6.394
203 2HH2 ARG 30 2HH2 ARG 30 -11.247 -5.289 -6.897
204 H LEU 31 H LEU 31 -9.729 -1.212 2.539
205 HA LEU 31 HA LEU 31 -8.967 1.086 0.790
206 1HB LEU 31 2HB LEU 31 -10.225 1.003 3.539
207 2HB LEU 31 1HB LEU 31 -9.573 2.478 2.827
208 HG LEU 31 HG LEU 31 -11.624 0.763 1.408
209 1HD1 LEU 31 1HD1 LEU 31 -12.543 1.547 3.573
210 2HD1 LEU 31 2HD1 LEU 31 -13.323 2.345 2.208
211 3HD1 LEU 31 3HD1 LEU 31 -12.102 3.200 3.150
212 1HD2 LEU 31 1HD2 LEU 31 -12.006 2.890 0.169
213 2HD2 LEU 31 2HD2 LEU 31 -10.346 2.321 0.003
214 3HD2 LEU 31 3HD2 LEU 31 -10.718 3.647 1.105
215 H ARG 32 H ARG 32 -7.692 -1.172 3.016
216 HA ARG 32 HA ARG 32 -5.595 0.661 4.009
217 1HB ARG 32 2HB ARG 32 -6.700 -1.186 5.419
218 2HB ARG 32 1HB ARG 32 -5.741 -2.323 4.470
219 1HG ARG 32 2HG ARG 32 -3.996 -1.930 5.837
220 2HG ARG 32 1HG ARG 32 -3.966 -0.264 5.261
221 1HD ARG 32 2HD ARG 32 -4.170 -0.332 7.717
222 2HD ARG 32 1HD ARG 32 -5.615 0.366 6.990
223 HE ARG 32 HE ARG 32 -6.818 -1.670 7.521
224 1HH1 ARG 32 2HH1 ARG 32 -4.336 -3.462 7.251
225 2HH1 ARG 32 1HH1 ARG 32 -4.129 -3.980 8.890
226 1HH2 ARG 32 1HH2 ARG 32 -6.225 -1.533 10.200
227 2HH2 ARG 32 2HH2 ARG 32 -5.204 -2.883 10.570
228 H CYS 33 H CYS 33 -3.401 0.465 3.425
229 HA CYS 33 HA CYS 33 -2.929 -0.894 0.835
230 1HB CYS 33 2HB CYS 33 -1.658 1.351 2.327
231 2HB CYS 33 1HB CYS 33 -0.608 0.382 1.293
232 H THR 34 H THR 34 -2.439 -3.030 1.166
233 HA THR 34 HA THR 34 -0.698 -3.813 3.422
234 HB THR 34 HB THR 34 -2.060 -5.474 1.275
235 HG1 THR 34 HG1 THR 34 -3.699 -5.183 2.541
236 1HG2 THR 34 1HG2 THR 34 -0.626 -7.088 1.937
237 2HG2 THR 34 2HG2 THR 34 -1.477 -7.076 3.482
238 3HG2 THR 34 3HG2 THR 34 -0.022 -6.102 3.268
239 H CYS 35 H CYS 35 1.453 -3.541 3.088
240 HA CYS 35 HA CYS 35 2.556 -3.907 0.346
241 1HB CYS 35 2HB CYS 35 4.177 -2.877 2.651
242 2HB CYS 35 1HB CYS 35 4.312 -2.493 0.937
243 H TYR 36 H TYR 36 4.519 -5.181 0.082
244 HA TYR 36 HA TYR 36 4.869 -7.253 2.213
245 1HB TYR 36 2HB TYR 36 5.667 -8.669 0.128
246 2HB TYR 36 1HB TYR 36 3.951 -8.531 0.504
247 HD1 TYR 36 HD1 TYR 36 6.666 -7.359 -1.724
248 HD2 TYR 36 HD2 TYR 36 2.449 -7.250 -0.903
249 HE1 TYR 36 HE1 TYR 36 6.256 -6.350 -3.952
250 HE2 TYR 36 HE2 TYR 36 2.042 -6.240 -3.130
251 HH TYR 36 HH TYR 36 3.547 -6.351 -5.502
252 H ARG 37 H ARG 37 7.031 -8.123 2.446
253 HA ARG 37 HA ARG 37 9.104 -6.136 2.252
254 1HB ARG 37 2HB ARG 37 9.048 -9.048 3.008
255 2HB ARG 37 1HB ARG 37 10.579 -8.183 2.868
256 1HG ARG 37 2HG ARG 37 10.264 -7.212 4.869
257 2HG ARG 37 1HG ARG 37 8.707 -6.571 4.350
258 1HD ARG 37 2HD ARG 37 7.750 -8.895 4.813
259 2HD ARG 37 1HD ARG 37 9.276 -9.258 5.619
260 HE ARG 37 HE ARG 37 7.185 -7.443 6.613
261 1HH1 ARG 37 1HH2 ARG 37 8.717 -9.511 8.229
262 2HH1 ARG 37 2HH2 ARG 37 9.758 -8.504 9.178
263 1HH2 ARG 37 2HH1 ARG 37 9.280 -5.691 7.191
264 2HH2 ARG 37 1HH1 ARG 37 10.078 -6.332 8.587
265 H CYS 38 H CYS 38 10.966 -6.120 0.942
266 HA CYS 38 HA CYS 38 10.602 -7.371 -1.718
267 1HB CYS 38 2HB CYS 38 11.319 -4.878 -1.168
268 2HB CYS 38 1HB CYS 38 12.924 -5.599 -1.044
269 H GLY 39 HN GLY 39 11.803 -9.101 -2.383
270 1HA GLY 39 2HA GLY 39 13.795 -10.224 -0.506
271 2HA GLY 39 1HA GLY 39 13.106 -11.056 -1.901
Start of MODEL 10
1 1H GLY 1 1H GLY 1 -8.274 4.696 1.716
2 2H GLY 1 2H GLY 1 -8.430 4.608 3.406
3 3H GLY 1 3H GLY 1 -7.380 3.547 2.589
4 1HA GLY 1 2HA GLY 1 -7.018 6.485 2.509
5 2HA GLY 1 1HA GLY 1 -6.311 5.492 3.782
6 H PHE 2 H PHE 2 -4.495 6.777 2.335
7 HA PHE 2 HA PHE 2 -2.577 6.503 1.021
8 1HB PHE 2 2HB PHE 2 -3.215 3.546 1.027
9 2HB PHE 2 1HB PHE 2 -1.633 4.310 0.897
10 HD1 PHE 2 HD1 PHE 2 -3.869 2.727 3.107
11 HD2 PHE 2 HD2 PHE 2 -1.044 5.959 2.926
12 HE1 PHE 2 HE1 PHE 2 -3.645 2.670 5.576
13 HE2 PHE 2 HE2 PHE 2 -0.820 5.901 5.395
14 HZ PHE 2 HZ PHE 2 -2.120 4.257 6.720
15 H GLY 3 H GLY 3 -5.281 6.786 -0.274
16 1HA GLY 3 2HA GLY 3 -6.037 6.957 -2.479
17 2HA GLY 3 1HA GLY 3 -4.440 6.434 -3.007
18 H CYS 4 H CYS 4 -7.080 4.877 -1.136
19 HA CYS 4 HA CYS 4 -6.769 2.486 -2.898
20 1HB CYS 4 2HB CYS 4 -7.680 2.844 -0.050
21 2HB CYS 4 1HB CYS 4 -8.158 1.414 -0.963
22 HA PRO 5 HA PRO 5 -8.019 0.601 -2.840
23 1HB PRO 5 2HB PRO 5 -9.355 -0.705 -4.849
24 2HB PRO 5 1HB PRO 5 -9.938 -0.618 -3.180
25 1HG PRO 5 2HG PRO 5 -10.945 0.805 -5.589
26 2HG PRO 5 1HG PRO 5 -11.794 0.402 -4.088
27 1HD PRO 5 2HD PRO 5 -10.713 2.943 -4.797
28 2HD PRO 5 1HD PRO 5 -11.367 2.470 -3.215
29 H ASN 6 H ASN 6 -7.493 3.078 -4.733
30 HA ASN 6 HA ASN 6 -6.735 2.189 -7.311
31 1HB ASN 6 2HB ASN 6 -6.777 4.594 -6.268
32 2HB ASN 6 1HB ASN 6 -5.105 4.240 -5.836
33 1HD2 ASN 6 1HD2 ASN 6 -7.190 5.178 -8.442
34 2HD2 ASN 6 2HD2 ASN 6 -6.019 5.140 -9.670
35 H ASN 7 H ASN 7 -4.942 1.141 -8.104
36 HA ASN 7 HA ASN 7 -3.204 -0.237 -6.184
37 1HB ASN 7 2HB ASN 7 -3.554 -0.327 -9.178
38 2HB ASN 7 1HB ASN 7 -2.178 -1.116 -8.410
39 1HD2 ASN 7 1HD2 ASN 7 -2.701 -2.826 -6.749
40 2HD2 ASN 7 2HD2 ASN 7 -4.175 -3.661 -6.863
41 H TYR 8 H TYR 8 -2.830 2.268 -8.697
42 HA TYR 8 HA TYR 8 0.018 2.497 -8.504
43 1HB TYR 8 2HB TYR 8 -1.651 3.489 -10.265
44 2HB TYR 8 1HB TYR 8 -1.748 4.847 -9.146
45 HD1 TYR 8 HD1 TYR 8 0.417 2.973 -11.450
46 HD2 TYR 8 HD2 TYR 8 0.214 6.249 -8.679
47 HE1 TYR 8 HE1 TYR 8 2.570 3.842 -12.320
48 HE2 TYR 8 HE2 TYR 8 2.367 7.118 -9.550
49 HH TYR 8 HH TYR 8 3.628 6.483 -12.299
50 H GLN 9 H GLN 9 -2.577 4.474 -7.008
51 HA GLN 9 HA GLN 9 -0.842 6.099 -5.429
52 1HB GLN 9 2HB GLN 9 -3.738 5.295 -5.109
53 2HB GLN 9 1HB GLN 9 -2.936 6.378 -3.971
54 1HG GLN 9 2HG GLN 9 -2.568 7.035 -6.841
55 2HG GLN 9 1HG GLN 9 -4.201 7.248 -6.211
56 1HE2 GLN 9 1HE2 GLN 9 -1.468 9.010 -6.720
57 2HE2 GLN 9 2HE2 GLN 9 -1.572 10.103 -5.426
58 H CYS 10 H CYS 10 -2.468 3.007 -4.687
59 HA CYS 10 HA CYS 10 -1.595 2.821 -1.966
60 1HB CYS 10 2HB CYS 10 -3.353 1.378 -3.104
61 2HB CYS 10 1HB CYS 10 -2.026 0.489 -3.849
62 H HIS 11 H HIS 11 -0.153 1.726 -5.027
63 HA HIS 11 HA HIS 11 2.114 0.407 -3.875
64 1HB HIS 11 2HB HIS 11 1.389 0.111 -6.244
65 2HB HIS 11 1HB HIS 11 1.906 1.762 -6.582
66 HD1 HIS 11 HD1 HIS 11 3.323 -1.584 -5.485
67 HD2 HIS 11 HD2 HIS 11 4.652 2.053 -7.026
68 HE1 HIS 11 HE1 HIS 11 5.779 -1.888 -6.019
69 H ARG 12 H ARG 12 1.598 3.752 -4.996
70 HA ARG 12 HA ARG 12 4.243 4.721 -4.631
71 1HB ARG 12 2HB ARG 12 2.057 5.868 -5.597
72 2HB ARG 12 1HB ARG 12 1.900 6.464 -3.943
73 1HG ARG 12 2HG ARG 12 4.184 7.397 -4.059
74 2HG ARG 12 1HG ARG 12 4.343 6.802 -5.711
75 1HD ARG 12 2HD ARG 12 3.396 8.704 -6.449
76 2HD ARG 12 1HD ARG 12 1.909 8.249 -5.620
77 HE ARG 12 HE ARG 12 3.570 10.398 -4.835
78 1HH1 ARG 12 2HH1 ARG 12 0.850 9.201 -3.712
79 2HH1 ARG 12 1HH1 ARG 12 1.253 9.148 -2.030
80 1HH2 ARG 12 1HH2 ARG 12 4.654 9.629 -2.558
81 2HH2 ARG 12 2HH2 ARG 12 3.415 9.382 -1.374
82 H HIS 13 H HIS 13 1.563 4.382 -2.310
83 HA HIS 13 HA HIS 13 2.864 5.680 -0.105
84 1HB HIS 13 2HB HIS 13 0.472 5.306 -0.023
85 2HB HIS 13 1HB HIS 13 0.688 3.566 -0.210
86 HD1 HIS 13 HD1 HIS 13 2.041 6.205 2.213
87 HD2 HIS 13 HD2 HIS 13 0.474 2.344 2.244
88 HE1 HIS 13 HE1 HIS 13 2.028 5.458 4.632
89 H CYS 14 H CYS 14 2.683 2.249 -1.092
90 HA CYS 14 HA CYS 14 4.288 1.252 1.080
91 1HB CYS 14 2HB CYS 14 3.758 0.119 -1.682
92 2HB CYS 14 1HB CYS 14 4.565 -0.761 -0.387
93 H LYS 15 H LYS 15 5.054 2.622 -2.075
94 HA LYS 15 HA LYS 15 7.791 1.791 -2.216
95 1HB LYS 15 2HB LYS 15 6.128 3.908 -3.520
96 2HB LYS 15 1HB LYS 15 7.884 4.044 -3.638
97 1HG LYS 15 2HG LYS 15 6.803 1.336 -4.146
98 2HG LYS 15 1HG LYS 15 6.364 2.552 -5.345
99 1HD LYS 15 2HD LYS 15 8.515 2.794 -6.087
100 2HD LYS 15 1HD LYS 15 9.204 2.566 -4.479
101 1HE LYS 15 2HE LYS 15 7.883 0.160 -5.529
102 2HE LYS 15 1HE LYS 15 9.249 0.689 -6.507
103 1HZ LYS 15 1HZ LYS 15 10.643 0.682 -4.561
104 2HZ LYS 15 2HZ LYS 15 9.893 -0.835 -4.712
105 3HZ LYS 15 3HZ LYS 15 9.329 0.282 -3.564
106 H SER 16 H SER 16 6.252 4.706 -0.811
107 HA SER 16 HA SER 16 8.752 5.946 -0.072
108 1HB SER 16 2HB SER 16 7.290 7.309 1.491
109 2HB SER 16 1HB SER 16 6.825 7.365 -0.204
110 HG SER 16 HG SER 16 5.640 5.957 1.940
111 H ILE 17 H ILE 17 6.788 3.441 1.378
112 HA ILE 17 HA ILE 17 7.984 3.665 4.033
113 HB ILE 17 HB ILE 17 6.396 1.419 2.745
114 1HG1 ILE 17 2HG1 ILE 17 5.385 3.243 4.904
115 2HG1 ILE 17 1HG1 ILE 17 5.410 3.830 3.241
116 1HG2 ILE 17 1HG2 ILE 17 7.242 1.897 5.621
117 2HG2 ILE 17 2HG2 ILE 17 7.738 0.556 4.587
118 3HG2 ILE 17 3HG2 ILE 17 6.062 0.686 5.119
119 1HD1 ILE 17 1HD1 ILE 17 3.622 1.889 4.490
120 2HD1 ILE 17 2HD1 ILE 17 4.358 1.262 3.016
121 3HD1 ILE 17 3HD1 ILE 17 3.438 2.765 2.971
122 HA PRO 18 HA PRO 18 11.675 1.489 2.849
123 1HB PRO 18 2HB PRO 18 12.797 1.495 5.360
124 2HB PRO 18 1HB PRO 18 12.796 2.900 4.280
125 1HG PRO 18 2HG PRO 18 11.154 2.407 6.718
126 2HG PRO 18 1HG PRO 18 11.646 3.944 5.988
127 1HD PRO 18 2HD PRO 18 9.096 2.728 5.756
128 2HD PRO 18 1HD PRO 18 9.695 4.097 4.796
129 H GLY 19 H GLY 19 12.215 -0.682 2.813
130 1HA GLY 19 2HA GLY 19 12.492 -2.865 3.857
131 2HA GLY 19 1HA GLY 19 11.181 -2.465 4.965
132 H ARG 20 H ARG 20 9.578 -1.347 2.643
133 HA ARG 20 HA ARG 20 8.616 -3.979 1.619
134 1HB ARG 20 2HB ARG 20 7.097 -1.365 1.609
135 2HB ARG 20 1HB ARG 20 6.450 -2.985 1.368
136 1HG ARG 20 2HG ARG 20 7.742 -2.019 3.939
137 2HG ARG 20 1HG ARG 20 6.002 -2.106 3.664
138 1HD ARG 20 2HD ARG 20 6.718 -4.619 2.935
139 2HD ARG 20 1HD ARG 20 7.953 -4.289 4.148
140 HE ARG 20 HE ARG 20 5.054 -4.540 4.647
141 1HH1 ARG 20 1HH2 ARG 20 7.587 -5.659 6.129
142 2HH1 ARG 20 2HH2 ARG 20 7.446 -4.808 7.631
143 1HH2 ARG 20 2HH1 ARG 20 5.118 -2.528 6.424
144 2HH2 ARG 20 1HH1 ARG 20 6.045 -3.030 7.798
145 H CYS 21 H CYS 21 8.147 -4.221 -0.601
146 HA CYS 21 HA CYS 21 9.591 -2.317 -2.375
147 1HB CYS 21 2HB CYS 21 9.309 -5.175 -2.312
148 2HB CYS 21 1HB CYS 21 8.630 -4.577 -3.825
149 H GLY 22 H GLY 22 6.534 -4.187 -2.338
150 1HA GLY 22 2HA GLY 22 5.189 -1.864 -3.622
151 2HA GLY 22 1HA GLY 22 4.995 -3.466 -4.333
152 H GLY 23 H GLY 23 2.649 -2.489 -3.654
153 1HA GLY 23 2HA GLY 23 1.821 -4.136 -1.377
154 2HA GLY 23 1HA GLY 23 1.613 -2.408 -1.115
155 H TYR 24 H TYR 24 -0.688 -3.415 -0.948
156 HA TYR 24 HA TYR 24 -2.120 -2.712 -3.406
157 1HB TYR 24 2HB TYR 24 -3.230 -4.856 -3.705
158 2HB TYR 24 1HB TYR 24 -1.488 -5.127 -3.739
159 HD1 TYR 24 HD1 TYR 24 -0.319 -6.047 -1.718
160 HD2 TYR 24 HD2 TYR 24 -4.599 -5.751 -1.955
161 HE1 TYR 24 HE1 TYR 24 -0.535 -7.606 0.199
162 HE2 TYR 24 HE2 TYR 24 -4.814 -7.311 -0.042
163 HH TYR 24 HH TYR 24 -3.287 -9.201 0.970
164 H CYS 25 H CYS 25 -4.447 -2.513 -3.009
165 HA CYS 25 HA CYS 25 -5.042 -1.831 -0.209
166 1HB CYS 25 2HB CYS 25 -6.769 -1.673 -2.700
167 2HB CYS 25 1HB CYS 25 -7.200 -1.024 -1.119
168 H GLY 26 H GLY 26 -5.947 -3.271 1.184
169 1HA GLY 26 2HA GLY 26 -8.109 -5.025 0.511
170 2HA GLY 26 1HA GLY 26 -6.604 -5.944 0.513
171 H GLY 27 H GLY 27 -9.092 -5.627 2.401
172 1HA GLY 27 2HA GLY 27 -8.568 -6.625 4.728
173 2HA GLY 27 1HA GLY 27 -7.564 -5.191 4.935
174 H TRP 28 H TRP 28 -8.558 -3.198 5.346
175 HA TRP 28 HA TRP 28 -11.296 -3.344 6.374
176 1HB TRP 28 2HB TRP 28 -9.462 -2.024 7.487
177 2HB TRP 28 1HB TRP 28 -9.502 -0.914 6.119
178 HD1 TRP 28 HD1 TRP 28 -11.752 -2.214 8.960
179 HE1 TRP 28 HE1 TRP 28 -13.543 -0.432 9.458
180 HE3 TRP 28 HE3 TRP 28 -10.751 1.117 5.221
181 HZ2 TRP 28 HZ2 TRP 28 -14.433 2.076 8.415
182 HZ3 TRP 28 HZ3 TRP 28 -12.084 3.193 5.000
183 HH2 TRP 28 HH2 TRP 28 -13.924 3.676 6.589
184 H HIS 29 H HIS 29 -12.632 -3.647 4.561
185 HA HIS 29 HA HIS 29 -13.889 -3.044 2.681
186 1HB HIS 29 2HB HIS 29 -13.112 -0.231 3.516
187 2HB HIS 29 1HB HIS 29 -14.503 -0.688 2.536
188 HD1 HIS 29 HD1 HIS 29 -14.546 0.721 5.447
189 HD2 HIS 29 HD2 HIS 29 -15.335 -3.284 4.615
190 HE1 HIS 29 HE1 HIS 29 -15.916 -0.156 7.388
191 H ARG 30 H ARG 30 -11.013 -3.559 2.339
192 HA ARG 30 HA ARG 30 -9.331 -3.361 0.734
193 1HB ARG 30 2HB ARG 30 -11.289 -4.014 -0.714
194 2HB ARG 30 1HB ARG 30 -11.554 -2.300 -1.036
195 1HG ARG 30 2HG ARG 30 -9.664 -2.106 -2.334
196 2HG ARG 30 1HG ARG 30 -8.787 -3.334 -1.425
197 1HD ARG 30 2HD ARG 30 -10.493 -5.000 -2.458
198 2HD ARG 30 1HD ARG 30 -10.820 -3.707 -3.615
199 HE ARG 30 HE ARG 30 -8.179 -5.063 -3.276
200 1HH1 ARG 30 2HH1 ARG 30 -9.644 -5.516 -5.795
201 2HH1 ARG 30 1HH1 ARG 30 -8.993 -4.310 -6.853
202 1HH2 ARG 30 1HH2 ARG 30 -7.635 -2.411 -4.283
203 2HH2 ARG 30 2HH2 ARG 30 -7.854 -2.545 -5.994
204 H LEU 31 H LEU 31 -9.865 -1.063 2.511
205 HA LEU 31 HA LEU 31 -8.975 1.184 0.762
206 1HB LEU 31 2HB LEU 31 -10.451 1.096 3.384
207 2HB LEU 31 1HB LEU 31 -9.570 2.545 2.903
208 HG LEU 31 HG LEU 31 -11.682 1.175 1.210
209 1HD1 LEU 31 1HD1 LEU 31 -11.812 3.675 2.924
210 2HD1 LEU 31 2HD1 LEU 31 -12.701 2.173 3.189
211 3HD1 LEU 31 3HD1 LEU 31 -13.061 3.174 1.783
212 1HD2 LEU 31 1HD2 LEU 31 -11.504 3.610 0.163
213 2HD2 LEU 31 2HD2 LEU 31 -10.376 2.344 -0.322
214 3HD2 LEU 31 3HD2 LEU 31 -9.885 3.555 0.863
215 H ARG 32 H ARG 32 -7.974 -0.991 3.257
216 HA ARG 32 HA ARG 32 -5.777 0.711 4.213
217 1HB ARG 32 2HB ARG 32 -7.031 -1.071 5.598
218 2HB ARG 32 1HB ARG 32 -6.088 -2.258 4.699
219 1HG ARG 32 2HG ARG 32 -4.077 -1.587 5.649
220 2HG ARG 32 1HG ARG 32 -4.655 0.047 5.973
221 1HD ARG 32 2HD ARG 32 -4.714 -0.827 8.117
222 2HD ARG 32 1HD ARG 32 -6.343 -1.231 7.577
223 HE ARG 32 HE ARG 32 -4.850 -3.443 6.837
224 1HH1 ARG 32 1HH2 ARG 32 -3.018 -2.829 9.095
225 2HH1 ARG 32 2HH2 ARG 32 -3.769 -3.647 10.426
226 1HH2 ARG 32 2HH1 ARG 32 -6.833 -3.994 8.820
227 2HH2 ARG 32 1HH1 ARG 32 -5.938 -4.309 10.268
228 H CYS 33 H CYS 33 -3.672 0.604 3.474
229 HA CYS 33 HA CYS 33 -3.191 -1.019 1.045
230 1HB CYS 33 2HB CYS 33 -1.944 1.399 2.273
231 2HB CYS 33 1HB CYS 33 -0.917 0.370 1.275
232 H THR 34 H THR 34 -2.293 -2.991 1.283
233 HA THR 34 HA THR 34 -0.612 -3.535 3.679
234 HB THR 34 HB THR 34 -1.836 -5.467 1.684
235 HG1 THR 34 HG1 THR 34 -3.562 -5.283 2.839
236 1HG2 THR 34 1HG2 THR 34 0.284 -5.939 3.308
237 2HG2 THR 34 2HG2 THR 34 -0.903 -7.172 2.886
238 3HG2 THR 34 3HG2 THR 34 -1.039 -6.306 4.415
239 H CYS 35 H CYS 35 1.526 -3.213 3.290
240 HA CYS 35 HA CYS 35 2.599 -3.704 0.560
241 1HB CYS 35 2HB CYS 35 4.198 -2.541 2.830
242 2HB CYS 35 1HB CYS 35 4.389 -2.284 1.098
243 H TYR 36 H TYR 36 4.214 -5.237 0.186
244 HA TYR 36 HA TYR 36 4.726 -7.122 2.445
245 1HB TYR 36 2HB TYR 36 5.490 -8.652 0.472
246 2HB TYR 36 1HB TYR 36 3.769 -8.413 0.745
247 HD1 TYR 36 HD1 TYR 36 2.398 -7.221 -0.839
248 HD2 TYR 36 HD2 TYR 36 6.657 -7.423 -1.360
249 HE1 TYR 36 HE1 TYR 36 2.156 -6.332 -3.140
250 HE2 TYR 36 HE2 TYR 36 6.415 -6.535 -3.662
251 HH TYR 36 HH TYR 36 4.923 -5.373 -5.043
252 H ARG 37 H ARG 37 6.891 -8.019 2.660
253 HA ARG 37 HA ARG 37 8.961 -6.023 2.434
254 1HB ARG 37 2HB ARG 37 8.836 -8.872 3.341
255 2HB ARG 37 1HB ARG 37 10.415 -8.158 3.020
256 1HG ARG 37 2HG ARG 37 8.936 -6.233 4.493
257 2HG ARG 37 1HG ARG 37 8.709 -7.779 5.308
258 1HD ARG 37 2HD ARG 37 11.473 -7.119 4.408
259 2HD ARG 37 1HD ARG 37 10.842 -6.215 5.783
260 HE ARG 37 HE ARG 37 11.072 -8.172 7.072
261 1HH1 ARG 37 2HH1 ARG 37 12.734 -8.971 4.452
262 2HH1 ARG 37 1HH1 ARG 37 12.239 -10.625 4.325
263 1HH2 ARG 37 1HH2 ARG 37 9.639 -10.295 6.612
264 2HH2 ARG 37 2HH2 ARG 37 10.483 -11.379 5.559
265 H CYS 38 H CYS 38 10.851 -6.072 1.144
266 HA CYS 38 HA CYS 38 10.464 -7.322 -1.511
267 1HB CYS 38 2HB CYS 38 11.277 -4.857 -0.954
268 2HB CYS 38 1HB CYS 38 12.850 -5.642 -0.832
269 H GLY 39 HN GLY 39 11.942 -8.815 -2.404
270 1HA GLY 39 2HA GLY 39 13.420 -10.437 -0.469
271 2HA GLY 39 1HA GLY 39 13.263 -10.768 -2.194
Start of MODEL 11
1 1H GLY 1 1H GLY 1 -7.743 3.373 2.279
2 2H GLY 1 2H GLY 1 -8.731 4.591 1.625
3 3H GLY 1 3H GLY 1 -8.840 4.200 3.275
4 1HA GLY 1 2HA GLY 1 -7.555 6.300 2.614
5 2HA GLY 1 1HA GLY 1 -6.843 5.213 3.804
6 H PHE 2 H PHE 2 -5.088 6.785 2.535
7 HA PHE 2 HA PHE 2 -3.150 6.814 1.221
8 1HB PHE 2 2HB PHE 2 -3.577 3.838 1.578
9 2HB PHE 2 1HB PHE 2 -2.146 4.512 0.799
10 HD1 PHE 2 HD1 PHE 2 -0.772 6.256 2.107
11 HD2 PHE 2 HD2 PHE 2 -3.718 3.717 3.931
12 HE1 PHE 2 HE1 PHE 2 0.235 6.686 4.331
13 HE2 PHE 2 HE2 PHE 2 -2.710 4.147 6.155
14 HZ PHE 2 HZ PHE 2 -0.734 5.631 6.356
15 H GLY 3 H GLY 3 -5.761 6.901 -0.177
16 1HA GLY 3 2HA GLY 3 -6.480 6.977 -2.401
17 2HA GLY 3 1HA GLY 3 -4.820 6.625 -2.879
18 H CYS 4 H CYS 4 -7.489 4.880 -1.231
19 HA CYS 4 HA CYS 4 -6.802 2.496 -2.898
20 1HB CYS 4 2HB CYS 4 -7.835 2.796 -0.094
21 2HB CYS 4 1HB CYS 4 -8.223 1.338 -1.004
22 HA PRO 5 HA PRO 5 -7.839 0.501 -2.888
23 1HB PRO 5 2HB PRO 5 -8.879 -0.935 -4.982
24 2HB PRO 5 1HB PRO 5 -9.580 -0.928 -3.356
25 1HG PRO 5 2HG PRO 5 -10.574 0.396 -5.828
26 2HG PRO 5 1HG PRO 5 -11.474 -0.120 -4.393
27 1HD PRO 5 2HD PRO 5 -10.658 2.536 -5.009
28 2HD PRO 5 1HD PRO 5 -11.342 1.968 -3.472
29 H ASN 6 H ASN 6 -7.536 3.034 -4.785
30 HA ASN 6 HA ASN 6 -6.523 2.314 -7.296
31 1HB ASN 6 2HB ASN 6 -6.784 4.663 -6.112
32 2HB ASN 6 1HB ASN 6 -5.090 4.407 -5.694
33 1HD2 ASN 6 1HD2 ASN 6 -7.305 5.057 -8.350
34 2HD2 ASN 6 2HD2 ASN 6 -6.110 5.272 -9.536
35 H ASN 7 H ASN 7 -5.004 0.834 -7.758
36 HA ASN 7 HA ASN 7 -3.092 -0.166 -5.842
37 1HB ASN 7 2HB ASN 7 -3.457 -0.517 -8.819
38 2HB ASN 7 1HB ASN 7 -2.079 -1.225 -7.977
39 1HD2 ASN 7 1HD2 ASN 7 -5.663 -1.222 -8.057
40 2HD2 ASN 7 2HD2 ASN 7 -5.836 -2.731 -7.299
41 H TYR 8 H TYR 8 -2.947 2.281 -8.393
42 HA TYR 8 HA TYR 8 -0.089 2.592 -8.422
43 1HB TYR 8 2HB TYR 8 -1.492 3.463 -10.236
44 2HB TYR 8 1HB TYR 8 -2.304 4.550 -9.114
45 HD1 TYR 8 HD1 TYR 8 1.035 3.734 -10.579
46 HD2 TYR 8 HD2 TYR 8 -1.402 6.675 -8.613
47 HE1 TYR 8 HE1 TYR 8 2.786 5.445 -10.965
48 HE2 TYR 8 HE2 TYR 8 0.349 8.385 -8.998
49 HH TYR 8 HH TYR 8 2.969 8.283 -9.368
50 H GLN 9 H GLN 9 -2.681 4.350 -6.686
51 HA GLN 9 HA GLN 9 -0.914 6.101 -5.247
52 1HB GLN 9 2HB GLN 9 -3.678 5.127 -4.456
53 2HB GLN 9 1HB GLN 9 -2.848 6.531 -3.790
54 1HG GLN 9 2HG GLN 9 -3.285 6.322 -6.761
55 2HG GLN 9 1HG GLN 9 -4.593 6.875 -5.718
56 1HE2 GLN 9 1HE2 GLN 9 -4.565 9.115 -6.303
57 2HE2 GLN 9 2HE2 GLN 9 -3.229 10.125 -6.025
58 H CYS 10 H CYS 10 -2.502 3.030 -4.327
59 HA CYS 10 HA CYS 10 -1.367 2.808 -1.724
60 1HB CYS 10 2HB CYS 10 -3.209 1.368 -2.882
61 2HB CYS 10 1HB CYS 10 -1.857 0.408 -3.479
62 H HIS 11 H HIS 11 -0.170 1.754 -4.908
63 HA HIS 11 HA HIS 11 2.158 0.378 -3.999
64 1HB HIS 11 2HB HIS 11 1.341 0.188 -6.310
65 2HB HIS 11 1HB HIS 11 1.690 1.894 -6.587
66 HD1 HIS 11 HD1 HIS 11 3.933 -0.601 -4.804
67 HD2 HIS 11 HD2 HIS 11 3.879 1.667 -8.298
68 HE1 HIS 11 HE1 HIS 11 6.207 -0.891 -5.877
69 H ARG 12 H ARG 12 1.600 3.797 -4.809
70 HA ARG 12 HA ARG 12 4.279 4.722 -4.557
71 1HB ARG 12 2HB ARG 12 2.582 6.169 -5.504
72 2HB ARG 12 1HB ARG 12 1.625 6.097 -4.026
73 1HG ARG 12 2HG ARG 12 2.771 8.201 -3.989
74 2HG ARG 12 1HG ARG 12 3.602 7.166 -2.830
75 1HD ARG 12 2HD ARG 12 5.408 6.762 -4.329
76 2HD ARG 12 1HD ARG 12 4.508 7.404 -5.705
77 HE ARG 12 HE ARG 12 4.922 9.639 -4.886
78 1HH1 ARG 12 2HH1 ARG 12 7.670 8.476 -4.591
79 2HH1 ARG 12 1HH1 ARG 12 8.081 8.914 -2.966
80 1HH2 ARG 12 1HH2 ARG 12 4.805 9.641 -2.060
81 2HH2 ARG 12 2HH2 ARG 12 6.451 9.586 -1.530
82 H HIS 13 H HIS 13 1.701 4.346 -2.123
83 HA HIS 13 HA HIS 13 3.178 5.401 0.097
84 1HB HIS 13 2HB HIS 13 0.781 5.155 0.284
85 2HB HIS 13 1HB HIS 13 0.881 3.427 -0.045
86 HD1 HIS 13 HD1 HIS 13 2.550 5.766 2.491
87 HD2 HIS 13 HD2 HIS 13 0.682 2.043 2.319
88 HE1 HIS 13 HE1 HIS 13 2.595 4.832 4.845
89 H CYS 14 H CYS 14 2.777 2.054 -1.112
90 HA CYS 14 HA CYS 14 4.302 0.759 0.919
91 1HB CYS 14 2HB CYS 14 3.927 0.005 -1.996
92 2HB CYS 14 1HB CYS 14 4.586 -1.063 -0.757
93 H LYS 15 H LYS 15 5.296 2.326 -2.110
94 HA LYS 15 HA LYS 15 8.053 1.502 -1.994
95 1HB LYS 15 2HB LYS 15 6.551 3.669 -3.445
96 2HB LYS 15 1HB LYS 15 8.314 3.631 -3.492
97 1HG LYS 15 2HG LYS 15 8.122 1.193 -4.210
98 2HG LYS 15 1HG LYS 15 6.395 1.481 -4.424
99 1HD LYS 15 2HD LYS 15 8.503 3.204 -5.744
100 2HD LYS 15 1HD LYS 15 7.840 1.762 -6.513
101 1HE LYS 15 2HE LYS 15 5.927 2.826 -7.065
102 2HE LYS 15 1HE LYS 15 5.735 3.467 -5.434
103 1HZ LYS 15 1HZ LYS 15 7.576 5.080 -6.098
104 2HZ LYS 15 2HZ LYS 15 6.031 5.337 -6.758
105 3HZ LYS 15 3HZ LYS 15 7.249 4.613 -7.699
106 H SER 16 H SER 16 6.271 4.259 -0.647
107 HA SER 16 HA SER 16 8.602 5.730 0.199
108 1HB SER 16 2HB SER 16 7.086 7.130 1.406
109 2HB SER 16 1HB SER 16 6.240 6.650 -0.058
110 HG SER 16 HG SER 16 5.352 4.897 1.306
111 H ILE 17 H ILE 17 6.851 3.015 1.544
112 HA ILE 17 HA ILE 17 7.894 3.289 4.248
113 HB ILE 17 HB ILE 17 6.746 0.853 2.837
114 1HG1 ILE 17 2HG1 ILE 17 5.304 2.589 4.833
115 2HG1 ILE 17 1HG1 ILE 17 5.330 3.037 3.129
116 1HG2 ILE 17 1HG2 ILE 17 6.370 -0.005 5.105
117 2HG2 ILE 17 2HG2 ILE 17 7.086 1.452 5.793
118 3HG2 ILE 17 3HG2 ILE 17 8.085 0.330 4.868
119 1HD1 ILE 17 1HD1 ILE 17 4.736 0.229 3.368
120 2HD1 ILE 17 2HD1 ILE 17 3.750 1.508 2.661
121 3HD1 ILE 17 3HD1 ILE 17 3.630 1.153 4.383
122 HA PRO 18 HA PRO 18 11.903 1.636 3.334
123 1HB PRO 18 2HB PRO 18 12.717 1.346 5.945
124 2HB PRO 18 1HB PRO 18 12.679 2.900 5.094
125 1HG PRO 18 2HG PRO 18 10.818 1.856 7.180
126 2HG PRO 18 1HG PRO 18 11.230 3.532 6.779
127 1HD PRO 18 2HD PRO 18 8.867 2.187 6.013
128 2HD PRO 18 1HD PRO 18 9.460 3.718 5.333
129 H GLY 19 H GLY 19 12.692 -0.432 3.042
130 1HA GLY 19 2HA GLY 19 12.983 -2.755 3.347
131 2HA GLY 19 1HA GLY 19 12.057 -2.637 4.845
132 H ARG 20 H ARG 20 10.927 -1.531 1.672
133 HA ARG 20 HA ARG 20 9.058 -3.840 1.534
134 1HB ARG 20 2HB ARG 20 8.346 -1.110 2.183
135 2HB ARG 20 1HB ARG 20 7.576 -1.603 0.679
136 1HG ARG 20 2HG ARG 20 6.017 -2.442 2.144
137 2HG ARG 20 1HG ARG 20 7.110 -3.824 2.106
138 1HD ARG 20 2HD ARG 20 8.310 -2.815 4.091
139 2HD ARG 20 1HD ARG 20 7.012 -1.626 4.186
140 HE ARG 20 HE ARG 20 6.386 -4.544 4.338
141 1HH1 ARG 20 1HH2 ARG 20 7.364 -2.850 6.791
142 2HH1 ARG 20 2HH2 ARG 20 5.843 -2.545 7.558
143 1HH2 ARG 20 2HH1 ARG 20 3.962 -3.511 4.794
144 2HH2 ARG 20 1HH1 ARG 20 3.905 -2.920 6.422
145 H CYS 21 H CYS 21 7.737 -3.540 -0.656
146 HA CYS 21 HA CYS 21 9.474 -2.420 -2.790
147 1HB CYS 21 2HB CYS 21 9.215 -5.233 -2.204
148 2HB CYS 21 1HB CYS 21 8.518 -4.894 -3.788
149 H GLY 22 H GLY 22 6.471 -4.338 -2.324
150 1HA GLY 22 2HA GLY 22 5.002 -2.239 -3.824
151 2HA GLY 22 1HA GLY 22 4.883 -3.902 -4.389
152 H GLY 23 H GLY 23 2.510 -3.052 -3.815
153 1HA GLY 23 2HA GLY 23 1.673 -4.565 -1.497
154 2HA GLY 23 1HA GLY 23 1.545 -2.834 -1.200
155 H TYR 24 H TYR 24 -0.798 -3.502 -1.011
156 HA TYR 24 HA TYR 24 -2.219 -2.782 -3.447
157 1HB TYR 24 2HB TYR 24 -3.527 -4.867 -3.641
158 2HB TYR 24 1HB TYR 24 -1.810 -5.185 -3.888
159 HD1 TYR 24 HD1 TYR 24 -4.713 -5.789 -1.776
160 HD2 TYR 24 HD2 TYR 24 -0.443 -6.188 -2.032
161 HE1 TYR 24 HE1 TYR 24 -4.754 -7.410 0.099
162 HE2 TYR 24 HE2 TYR 24 -0.485 -7.809 -0.157
163 HH TYR 24 HH TYR 24 -2.606 -8.122 1.958
164 H CYS 25 H CYS 25 -4.598 -2.637 -3.018
165 HA CYS 25 HA CYS 25 -5.075 -1.821 -0.222
166 1HB CYS 25 2HB CYS 25 -6.812 -1.618 -2.699
167 2HB CYS 25 1HB CYS 25 -7.246 -0.979 -1.114
168 H GLY 26 H GLY 26 -5.680 -3.419 1.159
169 1HA GLY 26 2HA GLY 26 -8.059 -4.998 0.667
170 2HA GLY 26 1HA GLY 26 -6.601 -5.985 0.546
171 H GLY 27 H GLY 27 -8.851 -5.835 2.605
172 1HA GLY 27 2HA GLY 27 -8.072 -6.788 4.883
173 2HA GLY 27 1HA GLY 27 -7.212 -5.257 5.037
174 H TRP 28 H TRP 28 -8.640 -3.271 4.762
175 HA TRP 28 HA TRP 28 -11.219 -3.724 6.190
176 1HB TRP 28 2HB TRP 28 -9.509 -2.308 7.342
177 2HB TRP 28 1HB TRP 28 -9.575 -1.181 5.989
178 HD1 TRP 28 HD1 TRP 28 -11.798 -2.608 8.789
179 HE1 TRP 28 HE1 TRP 28 -13.677 -0.916 9.279
180 HE3 TRP 28 HE3 TRP 28 -10.920 0.792 5.078
181 HZ2 TRP 28 HZ2 TRP 28 -14.677 1.551 8.240
182 HZ3 TRP 28 HZ3 TRP 28 -12.351 2.803 4.854
183 HH2 TRP 28 HH2 TRP 28 -14.228 3.185 6.428
184 H HIS 29 H HIS 29 -12.598 -4.046 4.431
185 HA HIS 29 HA HIS 29 -13.948 -3.483 2.611
186 1HB HIS 29 2HB HIS 29 -13.273 -0.661 3.500
187 2HB HIS 29 1HB HIS 29 -14.637 -1.127 2.487
188 HD1 HIS 29 HD1 HIS 29 -14.796 0.177 5.428
189 HD2 HIS 29 HD2 HIS 29 -15.364 -3.839 4.478
190 HE1 HIS 29 HE1 HIS 29 -16.132 -0.827 7.331
191 H ARG 30 H ARG 30 -11.079 -3.874 2.117
192 HA ARG 30 HA ARG 30 -9.533 -3.639 0.378
193 1HB ARG 30 2HB ARG 30 -11.789 -4.065 -0.855
194 2HB ARG 30 1HB ARG 30 -11.712 -2.351 -1.251
195 1HG ARG 30 2HG ARG 30 -9.888 -2.607 -2.638
196 2HG ARG 30 1HG ARG 30 -9.253 -3.972 -1.721
197 1HD ARG 30 2HD ARG 30 -10.329 -5.469 -3.023
198 2HD ARG 30 1HD ARG 30 -11.847 -4.578 -2.912
199 HE ARG 30 HE ARG 30 -10.872 -3.082 -4.748
200 1HH1 ARG 30 1HH2 ARG 30 -11.456 -6.207 -5.223
201 2HH1 ARG 30 2HH2 ARG 30 -10.226 -6.517 -6.401
202 1HH2 ARG 30 2HH1 ARG 30 -8.563 -3.516 -5.841
203 2HH2 ARG 30 1HH1 ARG 30 -8.584 -4.988 -6.755
204 H LEU 31 H LEU 31 -10.001 -1.385 2.304
205 HA LEU 31 HA LEU 31 -9.040 0.879 0.609
206 1HB LEU 31 2HB LEU 31 -10.580 0.871 3.213
207 2HB LEU 31 1HB LEU 31 -9.815 2.318 2.557
208 HG LEU 31 HG LEU 31 -11.787 0.635 0.988
209 1HD1 LEU 31 1HD1 LEU 31 -12.291 3.183 2.558
210 2HD1 LEU 31 2HD1 LEU 31 -12.861 1.577 3.014
211 3HD1 LEU 31 3HD1 LEU 31 -13.463 2.341 1.544
212 1HD2 LEU 31 1HD2 LEU 31 -10.259 2.073 -0.326
213 2HD2 LEU 31 2HD2 LEU 31 -10.743 3.467 0.639
214 3HD2 LEU 31 3HD2 LEU 31 -11.915 2.672 -0.409
215 H ARG 32 H ARG 32 -8.096 -1.385 2.972
216 HA ARG 32 HA ARG 32 -6.108 0.312 4.301
217 1HB ARG 32 2HB ARG 32 -7.112 -1.491 5.589
218 2HB ARG 32 1HB ARG 32 -6.646 -2.675 4.371
219 1HG ARG 32 2HG ARG 32 -4.919 -2.975 5.876
220 2HG ARG 32 1HG ARG 32 -4.213 -1.709 4.872
221 1HD ARG 32 2HD ARG 32 -5.190 -0.019 6.487
222 2HD ARG 32 1HD ARG 32 -5.608 -1.374 7.537
223 HE ARG 32 HE ARG 32 -3.220 -1.815 7.825
224 1HH1 ARG 32 1HH2 ARG 32 -2.085 -0.764 5.320
225 2HH1 ARG 32 2HH2 ARG 32 -1.399 0.751 5.804
226 1HH2 ARG 32 2HH1 ARG 32 -3.196 0.914 8.776
227 2HH2 ARG 32 1HH1 ARG 32 -2.032 1.707 7.768
228 H CYS 33 H CYS 33 -4.013 0.570 3.613
229 HA CYS 33 HA CYS 33 -3.209 -0.748 1.099
230 1HB CYS 33 2HB CYS 33 -2.365 1.636 2.630
231 2HB CYS 33 1HB CYS 33 -1.051 0.763 1.842
232 H THR 34 H THR 34 -2.549 -2.829 1.446
233 HA THR 34 HA THR 34 -0.765 -3.410 3.749
234 HB THR 34 HB THR 34 -2.159 -5.284 1.811
235 HG1 THR 34 HG1 THR 34 -3.786 -4.980 3.080
236 1HG2 THR 34 1HG2 THR 34 -0.136 -6.290 2.745
237 2HG2 THR 34 2HG2 THR 34 -1.554 -7.013 3.505
238 3HG2 THR 34 3HG2 THR 34 -0.614 -5.796 4.370
239 H CYS 35 H CYS 35 1.364 -3.193 3.316
240 HA CYS 35 HA CYS 35 2.362 -3.795 0.566
241 1HB CYS 35 2HB CYS 35 3.870 -2.352 2.754
242 2HB CYS 35 1HB CYS 35 4.210 -2.356 1.025
243 H TYR 36 H TYR 36 4.101 -5.270 0.307
244 HA TYR 36 HA TYR 36 4.649 -6.950 2.718
245 1HB TYR 36 2HB TYR 36 5.383 -8.667 0.908
246 2HB TYR 36 1HB TYR 36 3.662 -8.394 1.157
247 HD1 TYR 36 HD1 TYR 36 2.302 -7.287 -0.516
248 HD2 TYR 36 HD2 TYR 36 6.542 -7.718 -1.062
249 HE1 TYR 36 HE1 TYR 36 2.059 -6.642 -2.898
250 HE2 TYR 36 HE2 TYR 36 6.297 -7.072 -3.444
251 HH TYR 36 HH TYR 36 4.742 -5.855 -4.872
252 H ARG 37 H ARG 37 6.809 -7.741 3.040
253 HA ARG 37 HA ARG 37 8.862 -5.786 2.544
254 1HB ARG 37 2HB ARG 37 8.934 -8.607 3.623
255 2HB ARG 37 1HB ARG 37 10.381 -7.612 3.477
256 1HG ARG 37 2HG ARG 37 9.338 -5.881 4.897
257 2HG ARG 37 1HG ARG 37 7.892 -6.880 5.049
258 1HD ARG 37 2HD ARG 37 9.124 -7.362 7.011
259 2HD ARG 37 1HD ARG 37 9.489 -8.713 5.937
260 HE ARG 37 HE ARG 37 11.339 -6.392 6.344
261 1HH1 ARG 37 2HH1 ARG 37 11.754 -9.017 7.815
262 2HH1 ARG 37 1HH1 ARG 37 12.914 -9.803 6.798
263 1HH2 ARG 37 1HH2 ARG 37 12.362 -7.688 4.093
264 2HH2 ARG 37 2HH2 ARG 37 13.258 -9.049 4.681
265 H CYS 38 H CYS 38 10.569 -5.821 1.083
266 HA CYS 38 HA CYS 38 10.177 -7.340 -1.376
267 1HB CYS 38 2HB CYS 38 11.216 -4.931 -0.984
268 2HB CYS 38 1HB CYS 38 12.712 -5.846 -0.805
269 H GLY 39 HN GLY 39 11.467 -9.037 -2.158
270 1HA GLY 39 2HA GLY 39 12.997 -10.513 -0.100
271 2HA GLY 39 1HA GLY 39 12.489 -11.150 -1.664
Start of MODEL 12
1 1H GLY 1 1H GLY 1 -7.586 3.585 2.041
2 2H GLY 1 2H GLY 1 -8.415 4.881 1.317
3 3H GLY 1 3H GLY 1 -8.655 4.528 2.962
4 1HA GLY 1 2HA GLY 1 -7.144 6.487 2.369
5 2HA GLY 1 1HA GLY 1 -6.593 5.346 3.594
6 H PHE 2 H PHE 2 -4.663 6.776 2.358
7 HA PHE 2 HA PHE 2 -2.664 6.600 1.145
8 1HB PHE 2 2HB PHE 2 -3.242 3.625 1.165
9 2HB PHE 2 1HB PHE 2 -1.669 4.403 1.016
10 HD1 PHE 2 HD1 PHE 2 -4.002 2.963 3.276
11 HD2 PHE 2 HD2 PHE 2 -0.987 6.010 2.987
12 HE1 PHE 2 HE1 PHE 2 -3.778 2.976 5.746
13 HE2 PHE 2 HE2 PHE 2 -0.764 6.022 5.457
14 HZ PHE 2 HZ PHE 2 -2.159 4.505 6.836
15 H GLY 3 H GLY 3 -5.260 6.824 -0.341
16 1HA GLY 3 2HA GLY 3 -5.854 6.973 -2.599
17 2HA GLY 3 1HA GLY 3 -4.222 6.446 -3.008
18 H CYS 4 H CYS 4 -6.955 4.896 -1.265
19 HA CYS 4 HA CYS 4 -6.549 2.507 -3.012
20 1HB CYS 4 2HB CYS 4 -7.390 2.845 -0.156
21 2HB CYS 4 1HB CYS 4 -8.011 1.462 -1.056
22 HA PRO 5 HA PRO 5 -7.720 0.611 -3.046
23 1HB PRO 5 2HB PRO 5 -8.931 -0.657 -5.157
24 2HB PRO 5 1HB PRO 5 -9.566 -0.677 -3.503
25 1HG PRO 5 2HG PRO 5 -10.562 0.823 -5.873
26 2HG PRO 5 1HG PRO 5 -11.439 0.301 -4.426
27 1HD PRO 5 2HD PRO 5 -10.471 2.924 -4.959
28 2HD PRO 5 1HD PRO 5 -11.126 2.331 -3.417
29 H ASN 6 H ASN 6 -7.372 3.198 -4.931
30 HA ASN 6 HA ASN 6 -6.444 2.441 -7.469
31 1HB ASN 6 2HB ASN 6 -6.611 4.801 -6.379
32 2HB ASN 6 1HB ASN 6 -4.967 4.493 -5.827
33 1HD2 ASN 6 1HD2 ASN 6 -6.596 5.968 -8.307
34 2HD2 ASN 6 2HD2 ASN 6 -5.450 5.794 -9.546
35 H ASN 7 H ASN 7 -4.990 0.887 -7.957
36 HA ASN 7 HA ASN 7 -3.111 -0.208 -6.076
37 1HB ASN 7 2HB ASN 7 -3.121 -0.441 -9.102
38 2HB ASN 7 1HB ASN 7 -2.243 -1.486 -7.988
39 1HD2 ASN 7 1HD2 ASN 7 -4.540 -1.513 -6.000
40 2HD2 ASN 7 2HD2 ASN 7 -5.714 -2.517 -6.701
41 H TYR 8 H TYR 8 -2.812 2.245 -8.624
42 HA TYR 8 HA TYR 8 0.057 2.425 -8.556
43 1HB TYR 8 2HB TYR 8 -0.967 3.411 -10.449
44 2HB TYR 8 1HB TYR 8 -2.144 4.281 -9.469
45 HD1 TYR 8 HD1 TYR 8 -1.784 6.546 -9.073
46 HD2 TYR 8 HD2 TYR 8 1.582 4.007 -9.891
47 HE1 TYR 8 HE1 TYR 8 -0.281 8.516 -8.998
48 HE2 TYR 8 HE2 TYR 8 3.086 5.976 -9.816
49 HH TYR 8 HH TYR 8 2.658 8.633 -10.249
50 H GLN 9 H GLN 9 -2.486 4.393 -6.969
51 HA GLN 9 HA GLN 9 -0.684 6.032 -5.466
52 1HB GLN 9 2HB GLN 9 -3.549 5.240 -4.862
53 2HB GLN 9 1HB GLN 9 -2.668 6.537 -4.055
54 1HG GLN 9 2HG GLN 9 -2.905 6.492 -7.060
55 2HG GLN 9 1HG GLN 9 -4.204 7.153 -6.069
56 1HE2 GLN 9 1HE2 GLN 9 -3.719 9.084 -4.761
57 2HE2 GLN 9 2HE2 GLN 9 -2.363 10.048 -5.105
58 H CYS 10 H CYS 10 -2.311 2.958 -4.685
59 HA CYS 10 HA CYS 10 -1.395 2.782 -1.976
60 1HB CYS 10 2HB CYS 10 -3.181 1.351 -3.164
61 2HB CYS 10 1HB CYS 10 -1.831 0.397 -3.774
62 H HIS 11 H HIS 11 -0.005 1.693 -5.061
63 HA HIS 11 HA HIS 11 2.251 0.317 -3.961
64 1HB HIS 11 2HB HIS 11 1.587 0.022 -6.304
65 2HB HIS 11 1HB HIS 11 1.942 1.717 -6.637
66 HD1 HIS 11 HD1 HIS 11 3.757 -1.395 -5.376
67 HD2 HIS 11 HD2 HIS 11 4.567 2.154 -7.404
68 HE1 HIS 11 HE1 HIS 11 6.199 -1.490 -6.040
69 H ARG 12 H ARG 12 1.852 3.704 -5.064
70 HA ARG 12 HA ARG 12 4.529 4.550 -4.606
71 1HB ARG 12 2HB ARG 12 2.246 5.770 -5.525
72 2HB ARG 12 1HB ARG 12 2.452 6.543 -3.952
73 1HG ARG 12 2HG ARG 12 5.019 6.352 -5.234
74 2HG ARG 12 1HG ARG 12 3.875 7.087 -6.356
75 1HD ARG 12 2HD ARG 12 3.578 8.119 -3.634
76 2HD ARG 12 1HD ARG 12 5.192 8.397 -4.285
77 HE ARG 12 HE ARG 12 4.247 9.855 -5.913
78 1HH1 ARG 12 1HH2 ARG 12 1.981 8.218 -6.867
79 2HH1 ARG 12 2HH2 ARG 12 0.599 9.082 -6.282
80 1HH2 ARG 12 2HH1 ARG 12 2.424 10.937 -3.969
81 2HH2 ARG 12 1HH1 ARG 12 0.853 10.627 -4.626
82 H HIS 13 H HIS 13 1.766 4.285 -2.390
83 HA HIS 13 HA HIS 13 2.996 5.573 -0.139
84 1HB HIS 13 2HB HIS 13 0.598 5.184 -0.143
85 2HB HIS 13 1HB HIS 13 0.837 3.444 -0.299
86 HD1 HIS 13 HD1 HIS 13 1.999 6.165 2.130
87 HD2 HIS 13 HD2 HIS 13 0.684 2.211 2.153
88 HE1 HIS 13 HE1 HIS 13 1.958 5.440 4.556
89 H CYS 14 H CYS 14 2.915 2.181 -1.234
90 HA CYS 14 HA CYS 14 4.399 1.113 0.990
91 1HB CYS 14 2HB CYS 14 4.063 0.107 -1.852
92 2HB CYS 14 1HB CYS 14 4.811 -0.821 -0.553
93 H LYS 15 H LYS 15 5.327 2.599 -2.077
94 HA LYS 15 HA LYS 15 8.086 1.868 -2.097
95 1HB LYS 15 2HB LYS 15 6.557 4.203 -3.256
96 2HB LYS 15 1HB LYS 15 8.306 4.069 -3.441
97 1HG LYS 15 2HG LYS 15 7.650 1.584 -4.193
98 2HG LYS 15 1HG LYS 15 6.139 2.386 -4.621
99 1HD LYS 15 2HD LYS 15 7.077 3.371 -6.420
100 2HD LYS 15 1HD LYS 15 8.441 3.955 -5.466
101 1HE LYS 15 2HE LYS 15 8.252 1.061 -6.300
102 2HE LYS 15 1HE LYS 15 8.939 2.275 -7.377
103 1HZ LYS 15 1HZ LYS 15 10.761 1.498 -6.204
104 2HZ LYS 15 2HZ LYS 15 9.909 1.381 -4.738
105 3HZ LYS 15 3HZ LYS 15 10.352 2.905 -5.347
106 H SER 16 H SER 16 6.379 4.613 -0.574
107 HA SER 16 HA SER 16 8.816 5.829 0.431
108 1HB SER 16 2HB SER 16 7.185 7.106 1.924
109 2HB SER 16 1HB SER 16 6.949 7.294 0.190
110 HG SER 16 HG SER 16 5.489 5.714 2.032
111 H ILE 17 H ILE 17 6.660 3.307 1.574
112 HA ILE 17 HA ILE 17 7.522 3.383 4.344
113 HB ILE 17 HB ILE 17 6.214 1.175 2.720
114 1HG1 ILE 17 2HG1 ILE 17 5.021 3.003 4.825
115 2HG1 ILE 17 1HG1 ILE 17 4.938 3.343 3.097
116 1HG2 ILE 17 1HG2 ILE 17 5.728 0.111 4.866
117 2HG2 ILE 17 2HG2 ILE 17 6.533 1.420 5.730
118 3HG2 ILE 17 3HG2 ILE 17 7.471 0.329 4.709
119 1HD1 ILE 17 1HD1 ILE 17 3.378 1.722 2.722
120 2HD1 ILE 17 2HD1 ILE 17 3.059 1.897 4.447
121 3HD1 ILE 17 3HD1 ILE 17 4.117 0.608 3.873
122 HA PRO 18 HA PRO 18 11.437 1.417 3.635
123 1HB PRO 18 2HB PRO 18 12.116 1.192 6.291
124 2HB PRO 18 1HB PRO 18 12.238 2.699 5.369
125 1HG PRO 18 2HG PRO 18 10.222 1.912 7.420
126 2HG PRO 18 1HG PRO 18 10.774 3.529 6.952
127 1HD PRO 18 2HD PRO 18 8.349 2.311 6.152
128 2HD PRO 18 1HD PRO 18 9.070 3.771 5.440
129 H GLY 19 H GLY 19 12.152 -0.713 3.564
130 1HA GLY 19 2HA GLY 19 12.288 -3.013 4.127
131 2HA GLY 19 1HA GLY 19 11.086 -2.751 5.387
132 H ARG 20 H ARG 20 10.082 -1.437 2.391
133 HA ARG 20 HA ARG 20 8.615 -3.940 1.688
134 1HB ARG 20 2HB ARG 20 7.350 -1.195 1.587
135 2HB ARG 20 1HB ARG 20 6.555 -2.755 1.400
136 1HG ARG 20 2HG ARG 20 8.006 -2.085 3.958
137 2HG ARG 20 1HG ARG 20 6.357 -1.522 3.692
138 1HD ARG 20 2HD ARG 20 6.099 -4.125 2.952
139 2HD ARG 20 1HD ARG 20 7.360 -4.269 4.174
140 HE ARG 20 HE ARG 20 4.575 -3.391 4.655
141 1HH1 ARG 20 2HH1 ARG 20 6.668 -1.710 6.146
142 2HH1 ARG 20 1HH1 ARG 20 6.750 -2.555 7.656
143 1HH2 ARG 20 1HH2 ARG 20 5.161 -5.402 6.454
144 2HH2 ARG 20 2HH2 ARG 20 5.893 -4.647 7.832
145 H CYS 21 H CYS 21 8.150 -4.167 -0.547
146 HA CYS 21 HA CYS 21 9.705 -2.327 -2.314
147 1HB CYS 21 2HB CYS 21 9.569 -5.172 -2.157
148 2HB CYS 21 1HB CYS 21 8.842 -4.693 -3.690
149 H GLY 22 H GLY 22 6.700 -4.272 -2.318
150 1HA GLY 22 2HA GLY 22 5.359 -2.049 -3.780
151 2HA GLY 22 1HA GLY 22 5.200 -3.702 -4.375
152 H GLY 23 H GLY 23 2.822 -2.792 -3.860
153 1HA GLY 23 2HA GLY 23 1.929 -4.283 -1.530
154 2HA GLY 23 1HA GLY 23 1.766 -2.547 -1.301
155 H TYR 24 H TYR 24 -0.560 -3.488 -1.146
156 HA TYR 24 HA TYR 24 -1.936 -2.818 -3.653
157 1HB TYR 24 2HB TYR 24 -3.140 -4.917 -3.857
158 2HB TYR 24 1HB TYR 24 -1.415 -5.280 -3.836
159 HD1 TYR 24 HD1 TYR 24 -0.338 -6.098 -1.704
160 HD2 TYR 24 HD2 TYR 24 -4.595 -5.694 -2.126
161 HE1 TYR 24 HE1 TYR 24 -0.675 -7.544 0.281
162 HE2 TYR 24 HE2 TYR 24 -4.929 -7.141 -0.143
163 HH TYR 24 HH TYR 24 -3.276 -9.110 0.996
164 H CYS 25 H CYS 25 -4.344 -2.729 -3.280
165 HA CYS 25 HA CYS 25 -4.899 -1.730 -0.558
166 1HB CYS 25 2HB CYS 25 -6.519 -1.728 -3.118
167 2HB CYS 25 1HB CYS 25 -7.126 -1.104 -1.584
168 H GLY 26 H GLY 26 -5.569 -3.174 0.941
169 1HA GLY 26 2HA GLY 26 -7.851 -4.869 0.588
170 2HA GLY 26 1HA GLY 26 -6.386 -5.838 0.434
171 H GLY 27 H GLY 27 -8.497 -5.751 2.586
172 1HA GLY 27 2HA GLY 27 -7.609 -6.563 4.858
173 2HA GLY 27 1HA GLY 27 -6.766 -5.015 4.912
174 H TRP 28 H TRP 28 -8.095 -3.055 4.947
175 HA TRP 28 HA TRP 28 -10.652 -3.510 6.383
176 1HB TRP 28 2HB TRP 28 -8.892 -2.027 7.393
177 2HB TRP 28 1HB TRP 28 -9.101 -0.927 6.032
178 HD1 TRP 28 HD1 TRP 28 -11.064 -2.402 8.998
179 HE1 TRP 28 HE1 TRP 28 -12.973 -0.781 9.597
180 HE3 TRP 28 HE3 TRP 28 -10.582 0.979 5.199
181 HZ2 TRP 28 HZ2 TRP 28 -14.142 1.630 8.603
182 HZ3 TRP 28 HZ3 TRP 28 -12.107 2.926 5.052
183 HH2 TRP 28 HH2 TRP 28 -13.885 3.254 6.746
184 H HIS 29 H HIS 29 -12.056 -3.944 4.654
185 HA HIS 29 HA HIS 29 -13.505 -3.459 2.887
186 1HB HIS 29 2HB HIS 29 -12.921 -0.588 3.681
187 2HB HIS 29 1HB HIS 29 -14.324 -1.157 2.780
188 HD1 HIS 29 HD1 HIS 29 -14.345 0.233 5.688
189 HD2 HIS 29 HD2 HIS 29 -14.771 -3.835 4.896
190 HE1 HIS 29 HE1 HIS 29 -15.505 -0.771 7.703
191 H ARG 30 H ARG 30 -10.630 -3.719 2.296
192 HA ARG 30 HA ARG 30 -9.158 -3.427 0.501
193 1HB ARG 30 2HB ARG 30 -11.275 -4.087 -0.729
194 2HB ARG 30 1HB ARG 30 -11.580 -2.370 -0.982
195 1HG ARG 30 2HG ARG 30 -9.846 -2.136 -2.479
196 2HG ARG 30 1HG ARG 30 -8.874 -3.390 -1.710
197 1HD ARG 30 2HD ARG 30 -11.424 -4.257 -2.982
198 2HD ARG 30 1HD ARG 30 -10.112 -3.782 -4.062
199 HE ARG 30 HE ARG 30 -9.175 -5.596 -2.008
200 1HH1 ARG 30 1HH2 ARG 30 -8.149 -5.809 -4.737
201 2HH1 ARG 30 2HH2 ARG 30 -8.960 -7.204 -5.368
202 1HH2 ARG 30 2HH1 ARG 30 -11.424 -7.203 -2.915
203 2HH2 ARG 30 1HH1 ARG 30 -10.820 -7.997 -4.331
204 H LEU 31 H LEU 31 -9.697 -1.174 2.410
205 HA LEU 31 HA LEU 31 -8.957 1.123 0.652
206 1HB LEU 31 2HB LEU 31 -10.291 1.035 3.367
207 2HB LEU 31 1HB LEU 31 -9.664 2.521 2.654
208 HG LEU 31 HG LEU 31 -11.625 0.724 1.211
209 1HD1 LEU 31 1HD1 LEU 31 -12.197 3.178 2.898
210 2HD1 LEU 31 2HD1 LEU 31 -12.646 1.522 3.310
211 3HD1 LEU 31 3HD1 LEU 31 -13.375 2.312 1.913
212 1HD2 LEU 31 1HD2 LEU 31 -10.337 2.278 -0.194
213 2HD2 LEU 31 2HD2 LEU 31 -10.786 3.621 0.857
214 3HD2 LEU 31 3HD2 LEU 31 -12.019 2.801 -0.099
215 H ARG 32 H ARG 32 -7.752 -1.045 3.034
216 HA ARG 32 HA ARG 32 -5.686 0.814 4.020
217 1HB ARG 32 2HB ARG 32 -6.744 -0.954 5.488
218 2HB ARG 32 1HB ARG 32 -5.926 -2.170 4.506
219 1HG ARG 32 2HG ARG 32 -3.774 -1.430 5.175
220 2HG ARG 32 1HG ARG 32 -4.402 0.098 5.794
221 1HD ARG 32 2HD ARG 32 -5.307 -2.522 6.976
222 2HD ARG 32 1HD ARG 32 -3.804 -1.768 7.507
223 HE ARG 32 HE ARG 32 -6.389 -0.267 7.621
224 1HH1 ARG 32 1HH2 ARG 32 -3.584 0.747 8.477
225 2HH1 ARG 32 2HH2 ARG 32 -3.721 0.614 10.199
226 1HH2 ARG 32 2HH1 ARG 32 -6.541 -1.414 10.080
227 2HH2 ARG 32 1HH1 ARG 32 -5.401 -0.615 11.108
228 H CYS 33 H CYS 33 -3.487 0.664 3.464
229 HA CYS 33 HA CYS 33 -2.938 -0.775 0.929
230 1HB CYS 33 2HB CYS 33 -1.788 1.588 2.322
231 2HB CYS 33 1HB CYS 33 -0.662 0.603 1.386
232 H THR 34 H THR 34 -2.294 -2.852 1.279
233 HA THR 34 HA THR 34 -0.546 -3.460 3.600
234 HB THR 34 HB THR 34 -1.981 -5.278 1.638
235 HG1 THR 34 HG1 THR 34 -2.440 -4.705 4.383
236 1HG2 THR 34 1HG2 THR 34 -1.366 -7.039 3.368
237 2HG2 THR 34 2HG2 THR 34 -0.245 -5.858 4.047
238 3HG2 THR 34 3HG2 THR 34 -0.024 -6.436 2.395
239 H CYS 35 H CYS 35 1.593 -3.244 3.198
240 HA CYS 35 HA CYS 35 2.620 -3.761 0.452
241 1HB CYS 35 2HB CYS 35 4.207 -2.575 2.728
242 2HB CYS 35 1HB CYS 35 4.484 -2.408 0.995
243 H TYR 36 H TYR 36 4.393 -5.184 0.119
244 HA TYR 36 HA TYR 36 4.841 -7.125 2.352
245 1HB TYR 36 2HB TYR 36 5.566 -8.644 0.334
246 2HB TYR 36 1HB TYR 36 3.855 -8.426 0.686
247 HD1 TYR 36 HD1 TYR 36 6.638 -7.375 -1.535
248 HD2 TYR 36 HD2 TYR 36 2.403 -7.233 -0.817
249 HE1 TYR 36 HE1 TYR 36 6.280 -6.451 -3.809
250 HE2 TYR 36 HE2 TYR 36 2.048 -6.308 -3.088
251 HH TYR 36 HH TYR 36 3.389 -6.416 -5.350
252 H ARG 37 H ARG 37 6.998 -8.097 2.469
253 HA ARG 37 HA ARG 37 9.113 -6.148 2.270
254 1HB ARG 37 2HB ARG 37 8.927 -9.039 3.030
255 2HB ARG 37 1HB ARG 37 10.520 -8.359 2.688
256 1HG ARG 37 2HG ARG 37 10.266 -6.686 4.389
257 2HG ARG 37 1HG ARG 37 8.558 -7.071 4.600
258 1HD ARG 37 2HD ARG 37 10.354 -9.379 4.950
259 2HD ARG 37 1HD ARG 37 10.594 -8.098 6.138
260 HE ARG 37 HE ARG 37 7.785 -8.652 5.851
261 1HH1 ARG 37 2HH1 ARG 37 9.700 -8.421 8.332
262 2HH1 ARG 37 1HH1 ARG 37 9.405 -9.961 9.067
263 1HH2 ARG 37 1HH2 ARG 37 7.841 -11.295 6.264
264 2HH2 ARG 37 2HH2 ARG 37 8.348 -11.594 7.892
265 H CYS 38 H CYS 38 11.084 -6.372 0.995
266 HA CYS 38 HA CYS 38 10.495 -7.262 -1.763
267 1HB CYS 38 2HB CYS 38 11.666 -5.018 -0.963
268 2HB CYS 38 1HB CYS 38 13.110 -6.028 -0.987
269 H GLY 39 HN GLY 39 11.184 -9.196 -2.500
270 1HA GLY 39 2HA GLY 39 13.102 -10.769 -0.886
271 2HA GLY 39 1HA GLY 39 12.123 -11.386 -2.218
Start of MODEL 13
1 1H GLY 1 1H GLY 1 -7.439 3.280 2.329
2 2H GLY 1 2H GLY 1 -8.480 4.413 1.607
3 3H GLY 1 3H GLY 1 -8.582 4.104 3.275
4 1HA GLY 1 2HA GLY 1 -7.375 6.222 2.459
5 2HA GLY 1 1HA GLY 1 -6.680 5.274 3.772
6 H PHE 2 H PHE 2 -4.922 6.791 2.452
7 HA PHE 2 HA PHE 2 -2.900 6.761 1.277
8 1HB PHE 2 2HB PHE 2 -3.262 3.757 1.532
9 2HB PHE 2 1HB PHE 2 -1.760 4.574 1.100
10 HD1 PHE 2 HD1 PHE 2 -3.395 3.067 3.745
11 HD2 PHE 2 HD2 PHE 2 -1.263 6.678 2.816
12 HE1 PHE 2 HE1 PHE 2 -2.879 3.383 6.149
13 HE2 PHE 2 HE2 PHE 2 -0.746 6.993 5.220
14 HZ PHE 2 HZ PHE 2 -1.555 5.345 6.887
15 H GLY 3 H GLY 3 -5.322 6.949 -0.269
16 1HA GLY 3 2HA GLY 3 -5.891 7.010 -2.537
17 2HA GLY 3 1HA GLY 3 -4.273 6.415 -2.897
18 H CYS 4 H CYS 4 -7.107 5.048 -1.171
19 HA CYS 4 HA CYS 4 -6.792 2.593 -2.849
20 1HB CYS 4 2HB CYS 4 -7.542 2.992 0.031
21 2HB CYS 4 1HB CYS 4 -8.151 1.582 -0.834
22 HA PRO 5 HA PRO 5 -8.042 0.712 -2.757
23 1HB PRO 5 2HB PRO 5 -9.379 -0.558 -4.790
24 2HB PRO 5 1HB PRO 5 -9.952 -0.512 -3.113
25 1HG PRO 5 2HG PRO 5 -10.977 0.969 -5.485
26 2HG PRO 5 1HG PRO 5 -11.820 0.515 -3.996
27 1HD PRO 5 2HD PRO 5 -10.780 3.086 -4.623
28 2HD PRO 5 1HD PRO 5 -11.394 2.550 -3.044
29 H ASN 6 H ASN 6 -7.602 3.234 -4.674
30 HA ASN 6 HA ASN 6 -6.806 2.384 -7.240
31 1HB ASN 6 2HB ASN 6 -6.868 4.770 -6.279
32 2HB ASN 6 1HB ASN 6 -5.261 4.429 -5.638
33 1HD2 ASN 6 1HD2 ASN 6 -7.095 4.955 -8.620
34 2HD2 ASN 6 2HD2 ASN 6 -5.742 5.068 -9.638
35 H ASN 7 H ASN 7 -5.064 1.261 -8.020
36 HA ASN 7 HA ASN 7 -3.353 -0.142 -6.111
37 1HB ASN 7 2HB ASN 7 -3.671 -0.200 -9.108
38 2HB ASN 7 1HB ASN 7 -2.326 -1.032 -8.327
39 1HD2 ASN 7 1HD2 ASN 7 -5.747 -1.195 -8.985
40 2HD2 ASN 7 2HD2 ASN 7 -6.046 -2.632 -8.135
41 H TYR 8 H TYR 8 -2.811 2.289 -8.691
42 HA TYR 8 HA TYR 8 0.024 2.430 -8.376
43 1HB TYR 8 2HB TYR 8 -0.915 3.439 -10.334
44 2HB TYR 8 1HB TYR 8 -2.005 4.444 -9.377
45 HD1 TYR 8 HD1 TYR 8 1.675 3.736 -9.696
46 HD2 TYR 8 HD2 TYR 8 -1.397 6.659 -9.005
47 HE1 TYR 8 HE1 TYR 8 3.395 5.517 -9.576
48 HE2 TYR 8 HE2 TYR 8 0.323 8.440 -8.890
49 HH TYR 8 HH TYR 8 3.585 7.822 -8.509
50 H GLN 9 H GLN 9 -2.546 4.497 -6.967
51 HA GLN 9 HA GLN 9 -0.816 6.107 -5.377
52 1HB GLN 9 2HB GLN 9 -3.708 5.307 -4.942
53 2HB GLN 9 1HB GLN 9 -2.873 6.537 -3.995
54 1HG GLN 9 2HG GLN 9 -3.109 6.628 -7.015
55 2HG GLN 9 1HG GLN 9 -4.218 7.456 -5.925
56 1HE2 GLN 9 1HE2 GLN 9 -1.936 8.404 -7.884
57 2HE2 GLN 9 2HE2 GLN 9 -1.069 9.513 -6.936
58 H CYS 10 H CYS 10 -2.559 3.093 -4.557
59 HA CYS 10 HA CYS 10 -1.637 2.927 -1.852
60 1HB CYS 10 2HB CYS 10 -3.491 1.553 -2.928
61 2HB CYS 10 1HB CYS 10 -2.225 0.575 -3.667
62 H HIS 11 H HIS 11 -0.328 1.671 -4.907
63 HA HIS 11 HA HIS 11 1.877 0.221 -3.822
64 1HB HIS 11 2HB HIS 11 0.958 0.276 -6.254
65 2HB HIS 11 1HB HIS 11 1.996 1.685 -6.461
66 HD1 HIS 11 HD1 HIS 11 2.051 -1.973 -6.449
67 HD2 HIS 11 HD2 HIS 11 4.841 1.073 -5.897
68 HE1 HIS 11 HE1 HIS 11 4.336 -3.037 -6.704
69 H ARG 12 H ARG 12 1.646 3.610 -4.965
70 HA ARG 12 HA ARG 12 4.357 4.336 -4.506
71 1HB ARG 12 2HB ARG 12 2.270 5.643 -5.569
72 2HB ARG 12 1HB ARG 12 2.226 6.352 -3.953
73 1HG ARG 12 2HG ARG 12 4.781 6.705 -4.275
74 2HG ARG 12 1HG ARG 12 4.447 6.450 -5.989
75 1HD ARG 12 2HD ARG 12 3.455 8.477 -6.213
76 2HD ARG 12 1HD ARG 12 2.571 8.309 -4.696
77 HE ARG 12 HE ARG 12 4.766 8.970 -3.566
78 1HH1 ARG 12 1HH2 ARG 12 3.395 11.285 -4.958
79 2HH1 ARG 12 2HH2 ARG 12 4.710 11.995 -5.833
80 1HH2 ARG 12 2HH1 ARG 12 6.767 9.212 -5.515
81 2HH2 ARG 12 1HH1 ARG 12 6.625 10.816 -6.150
82 H HIS 13 H HIS 13 1.551 4.360 -2.306
83 HA HIS 13 HA HIS 13 2.834 5.619 -0.085
84 1HB HIS 13 2HB HIS 13 0.440 5.369 -0.044
85 2HB HIS 13 1HB HIS 13 0.556 3.622 -0.244
86 HD1 HIS 13 HD1 HIS 13 1.952 6.167 2.256
87 HD2 HIS 13 HD2 HIS 13 0.232 2.371 2.183
88 HE1 HIS 13 HE1 HIS 13 1.820 5.395 4.665
89 H CYS 14 H CYS 14 2.616 2.195 -1.049
90 HA CYS 14 HA CYS 14 4.066 1.192 1.236
91 1HB CYS 14 2HB CYS 14 3.477 0.041 -1.499
92 2HB CYS 14 1HB CYS 14 4.357 -0.851 -0.259
93 H LYS 15 H LYS 15 4.999 2.416 -1.935
94 HA LYS 15 HA LYS 15 7.717 1.505 -1.930
95 1HB LYS 15 2HB LYS 15 6.333 3.817 -3.305
96 2HB LYS 15 1HB LYS 15 8.044 3.458 -3.547
97 1HG LYS 15 2HG LYS 15 7.104 1.002 -3.971
98 2HG LYS 15 1HG LYS 15 5.640 1.891 -4.388
99 1HD LYS 15 2HD LYS 15 6.544 2.743 -6.295
100 2HD LYS 15 1HD LYS 15 8.121 2.998 -5.545
101 1HE LYS 15 2HE LYS 15 7.732 0.192 -5.652
102 2HE LYS 15 1HE LYS 15 7.262 0.821 -7.231
103 1HZ LYS 15 1HZ LYS 15 9.575 0.418 -7.309
104 2HZ LYS 15 2HZ LYS 15 9.846 1.197 -5.822
105 3HZ LYS 15 3HZ LYS 15 9.400 2.102 -7.191
106 H SER 16 H SER 16 6.223 4.566 -0.796
107 HA SER 16 HA SER 16 8.676 5.818 -0.013
108 1HB SER 16 2HB SER 16 7.213 7.218 1.478
109 2HB SER 16 1HB SER 16 6.666 7.155 -0.193
110 HG SER 16 HG SER 16 5.608 5.927 2.105
111 H ILE 17 H ILE 17 6.676 3.381 1.538
112 HA ILE 17 HA ILE 17 7.875 3.636 4.171
113 HB ILE 17 HB ILE 17 6.330 1.371 2.866
114 1HG1 ILE 17 2HG1 ILE 17 5.346 3.133 5.093
115 2HG1 ILE 17 1HG1 ILE 17 5.308 3.739 3.437
116 1HG2 ILE 17 1HG2 ILE 17 7.812 0.582 4.712
117 2HG2 ILE 17 2HG2 ILE 17 6.102 0.441 5.117
118 3HG2 ILE 17 3HG2 ILE 17 7.060 1.761 5.787
119 1HD1 ILE 17 1HD1 ILE 17 4.234 1.334 2.984
120 2HD1 ILE 17 2HD1 ILE 17 3.249 2.707 3.487
121 3HD1 ILE 17 3HD1 ILE 17 3.762 1.507 4.674
122 HA PRO 18 HA PRO 18 11.641 1.566 3.074
123 1HB PRO 18 2HB PRO 18 12.671 1.489 5.623
124 2HB PRO 18 1HB PRO 18 12.678 2.937 4.601
125 1HG PRO 18 2HG PRO 18 10.953 2.307 6.950
126 2HG PRO 18 1HG PRO 18 11.448 3.884 6.312
127 1HD PRO 18 2HD PRO 18 8.928 2.656 5.924
128 2HD PRO 18 1HD PRO 18 9.555 4.058 5.032
129 H GLY 19 H GLY 19 12.363 -0.567 3.068
130 1HA GLY 19 2HA GLY 19 12.588 -2.816 3.823
131 2HA GLY 19 1HA GLY 19 11.435 -2.478 5.112
132 H ARG 20 H ARG 20 10.742 -1.664 1.750
133 HA ARG 20 HA ARG 20 9.116 -4.093 1.372
134 1HB ARG 20 2HB ARG 20 7.986 -1.435 2.028
135 2HB ARG 20 1HB ARG 20 7.222 -2.276 0.681
136 1HG ARG 20 2HG ARG 20 6.049 -3.417 2.240
137 2HG ARG 20 1HG ARG 20 7.550 -4.280 2.572
138 1HD ARG 20 2HD ARG 20 8.113 -2.310 4.146
139 2HD ARG 20 1HD ARG 20 6.404 -1.901 4.022
140 HE ARG 20 HE ARG 20 6.396 -4.598 4.683
141 1HH1 ARG 20 1HH2 ARG 20 9.047 -3.583 5.986
142 2HH1 ARG 20 2HH2 ARG 20 8.497 -3.306 7.604
143 1HH2 ARG 20 2HH1 ARG 20 5.125 -3.441 6.759
144 2HH2 ARG 20 1HH1 ARG 20 6.264 -3.231 8.045
145 H CYS 21 H CYS 21 7.907 -3.876 -0.826
146 HA CYS 21 HA CYS 21 9.620 -2.383 -2.767
147 1HB CYS 21 2HB CYS 21 9.234 -5.248 -2.523
148 2HB CYS 21 1HB CYS 21 8.691 -4.675 -4.101
149 H GLY 22 H GLY 22 6.476 -4.042 -2.309
150 1HA GLY 22 2HA GLY 22 5.205 -1.876 -3.896
151 2HA GLY 22 1HA GLY 22 4.912 -3.543 -4.383
152 H GLY 23 H GLY 23 2.624 -2.583 -3.864
153 1HA GLY 23 2HA GLY 23 1.726 -3.806 -1.398
154 2HA GLY 23 1HA GLY 23 1.684 -2.050 -1.286
155 H TYR 24 H TYR 24 -0.678 -3.395 -1.070
156 HA TYR 24 HA TYR 24 -2.140 -2.434 -3.447
157 1HB TYR 24 2HB TYR 24 -3.325 -4.560 -3.790
158 2HB TYR 24 1HB TYR 24 -1.591 -4.788 -4.005
159 HD1 TYR 24 HD1 TYR 24 -4.518 -5.660 -2.026
160 HD2 TYR 24 HD2 TYR 24 -0.227 -5.812 -2.154
161 HE1 TYR 24 HE1 TYR 24 -4.526 -7.393 -0.252
162 HE2 TYR 24 HE2 TYR 24 -0.235 -7.543 -0.381
163 HH TYR 24 HH TYR 24 -2.475 -8.104 1.632
164 H CYS 25 H CYS 25 -4.512 -2.397 -3.050
165 HA CYS 25 HA CYS 25 -5.086 -1.749 -0.235
166 1HB CYS 25 2HB CYS 25 -6.883 -1.626 -2.679
167 2HB CYS 25 1HB CYS 25 -7.253 -0.957 -1.090
168 H GLY 26 H GLY 26 -5.611 -3.431 1.086
169 1HA GLY 26 2HA GLY 26 -7.860 -5.157 0.480
170 2HA GLY 26 1HA GLY 26 -6.333 -6.031 0.361
171 H GLY 27 H GLY 27 -8.709 -5.893 2.393
172 1HA GLY 27 2HA GLY 27 -8.044 -6.948 4.648
173 2HA GLY 27 1HA GLY 27 -7.052 -5.506 4.853
174 H TRP 28 H TRP 28 -8.170 -3.424 4.961
175 HA TRP 28 HA TRP 28 -10.740 -3.661 6.381
176 1HB TRP 28 2HB TRP 28 -8.828 -2.180 7.169
177 2HB TRP 28 1HB TRP 28 -9.175 -1.134 5.794
178 HD1 TRP 28 HD1 TRP 28 -10.822 -2.485 8.997
179 HE1 TRP 28 HE1 TRP 28 -12.678 -0.849 9.713
180 HE3 TRP 28 HE3 TRP 28 -10.749 0.726 5.028
181 HZ2 TRP 28 HZ2 TRP 28 -13.962 1.510 8.734
182 HZ3 TRP 28 HZ3 TRP 28 -12.296 2.659 4.947
183 HH2 TRP 28 HH2 TRP 28 -13.903 3.054 6.792
184 H HIS 29 H HIS 29 -12.137 -4.221 4.639
185 HA HIS 29 HA HIS 29 -13.624 -3.796 2.886
186 1HB HIS 29 2HB HIS 29 -13.067 -0.881 3.509
187 2HB HIS 29 1HB HIS 29 -14.512 -1.549 2.758
188 HD1 HIS 29 HD1 HIS 29 -14.258 0.033 5.597
189 HD2 HIS 29 HD2 HIS 29 -14.832 -4.056 5.038
190 HE1 HIS 29 HE1 HIS 29 -15.273 -0.848 7.745
191 H ARG 30 H ARG 30 -10.742 -4.035 2.286
192 HA ARG 30 HA ARG 30 -9.301 -3.793 0.455
193 1HB ARG 30 2HB ARG 30 -11.447 -4.454 -0.739
194 2HB ARG 30 1HB ARG 30 -11.735 -2.737 -1.012
195 1HG ARG 30 2HG ARG 30 -9.902 -2.521 -2.450
196 2HG ARG 30 1HG ARG 30 -9.094 -3.945 -1.796
197 1HD ARG 30 2HD ARG 30 -10.358 -5.414 -3.057
198 2HD ARG 30 1HD ARG 30 -11.749 -4.332 -3.115
199 HE ARG 30 HE ARG 30 -10.044 -2.935 -4.647
200 1HH1 ARG 30 2HH1 ARG 30 -8.194 -5.192 -5.041
201 2HH1 ARG 30 1HH1 ARG 30 -8.838 -5.994 -6.436
202 1HH2 ARG 30 1HH2 ARG 30 -11.945 -4.450 -6.212
203 2HH2 ARG 30 2HH2 ARG 30 -10.970 -5.569 -7.104
204 H LEU 31 H LEU 31 -9.782 -1.533 2.355
205 HA LEU 31 HA LEU 31 -9.053 0.751 0.571
206 1HB LEU 31 2HB LEU 31 -10.348 0.777 3.311
207 2HB LEU 31 1HB LEU 31 -9.863 2.216 2.417
208 HG LEU 31 HG LEU 31 -11.714 0.165 1.202
209 1HD1 LEU 31 1HD1 LEU 31 -13.609 1.506 1.963
210 2HD1 LEU 31 2HD1 LEU 31 -12.519 2.621 2.788
211 3HD1 LEU 31 3HD1 LEU 31 -12.679 0.960 3.358
212 1HD2 LEU 31 1HD2 LEU 31 -11.113 3.096 0.709
213 2HD2 LEU 31 2HD2 LEU 31 -12.432 2.227 -0.076
214 3HD2 LEU 31 3HD2 LEU 31 -10.761 1.741 -0.364
215 H ARG 32 H ARG 32 -7.906 -1.338 3.074
216 HA ARG 32 HA ARG 32 -5.900 0.559 4.083
217 1HB ARG 32 2HB ARG 32 -7.039 -1.424 5.373
218 2HB ARG 32 1HB ARG 32 -5.812 -2.410 4.577
219 1HG ARG 32 2HG ARG 32 -4.692 0.040 5.717
220 2HG ARG 32 1HG ARG 32 -5.468 -0.969 6.936
221 1HD ARG 32 2HD ARG 32 -4.149 -2.910 6.187
222 2HD ARG 32 1HD ARG 32 -3.380 -1.917 4.948
223 HE ARG 32 HE ARG 32 -2.985 -1.561 7.890
224 1HH1 ARG 32 2HH1 ARG 32 -2.489 0.909 6.271
225 2HH1 ARG 32 1HH1 ARG 32 -0.802 0.775 5.900
226 1HH2 ARG 32 1HH2 ARG 32 -0.632 -2.609 6.703
227 2HH2 ARG 32 2HH2 ARG 32 0.256 -1.230 6.146
228 H CYS 33 H CYS 33 -3.732 0.583 3.485
229 HA CYS 33 HA CYS 33 -3.070 -0.827 0.977
230 1HB CYS 33 2HB CYS 33 -1.953 1.486 2.492
231 2HB CYS 33 1HB CYS 33 -0.834 0.563 1.491
232 H THR 34 H THR 34 -2.444 -2.914 1.293
233 HA THR 34 HA THR 34 -0.751 -3.617 3.621
234 HB THR 34 HB THR 34 -1.986 -5.354 1.456
235 HG1 THR 34 HG1 THR 34 -3.679 -5.275 2.672
236 1HG2 THR 34 1HG2 THR 34 -0.092 -5.882 3.658
237 2HG2 THR 34 2HG2 THR 34 -0.416 -6.822 2.200
238 3HG2 THR 34 3HG2 THR 34 -1.475 -6.973 3.602
239 H CYS 35 H CYS 35 1.410 -3.350 3.343
240 HA CYS 35 HA CYS 35 2.576 -3.633 0.614
241 1HB CYS 35 2HB CYS 35 4.089 -2.665 3.034
242 2HB CYS 35 1HB CYS 35 4.365 -2.286 1.335
243 H TYR 36 H TYR 36 4.397 -5.036 0.278
244 HA TYR 36 HA TYR 36 4.733 -7.107 2.410
245 1HB TYR 36 2HB TYR 36 5.578 -8.483 0.300
246 2HB TYR 36 1HB TYR 36 3.865 -8.385 0.693
247 HD1 TYR 36 HD1 TYR 36 6.532 -7.169 -1.561
248 HD2 TYR 36 HD2 TYR 36 2.331 -7.074 -0.662
249 HE1 TYR 36 HE1 TYR 36 6.079 -6.147 -3.775
250 HE2 TYR 36 HE2 TYR 36 1.880 -6.051 -2.874
251 HH TYR 36 HH TYR 36 3.412 -6.157 -5.296
252 H ARG 37 H ARG 37 6.814 -7.753 2.962
253 HA ARG 37 HA ARG 37 8.935 -5.872 2.683
254 1HB ARG 37 2HB ARG 37 8.893 -8.775 3.520
255 2HB ARG 37 1HB ARG 37 10.375 -7.821 3.518
256 1HG ARG 37 2HG ARG 37 9.559 -6.329 5.163
257 2HG ARG 37 1HG ARG 37 7.889 -6.842 4.921
258 1HD ARG 37 2HD ARG 37 9.322 -9.178 5.606
259 2HD ARG 37 1HD ARG 37 9.872 -7.928 6.721
260 HE ARG 37 HE ARG 37 7.358 -7.542 7.162
261 1HH1 ARG 37 2HH1 ARG 37 6.593 -9.729 5.159
262 2HH1 ARG 37 1HH1 ARG 37 6.259 -11.052 6.226
263 1HH2 ARG 37 1HH2 ARG 37 7.844 -9.594 8.955
264 2HH2 ARG 37 2HH2 ARG 37 6.972 -10.976 8.383
265 H CYS 38 H CYS 38 10.728 -5.815 1.319
266 HA CYS 38 HA CYS 38 10.467 -7.337 -1.204
267 1HB CYS 38 2HB CYS 38 10.982 -4.789 -0.988
268 2HB CYS 38 1HB CYS 38 12.629 -5.318 -0.647
269 H GLY 39 HN GLY 39 11.594 -9.181 -1.507
270 1HA GLY 39 2HA GLY 39 13.806 -9.868 0.332
271 2HA GLY 39 1HA GLY 39 13.025 -10.971 -0.802
Start of MODEL 14
1 1H GLY 1 1H GLY 1 -7.400 3.344 2.273
2 2H GLY 1 2H GLY 1 -8.347 4.443 1.388
3 3H GLY 1 3H GLY 1 -8.544 4.312 3.070
4 1HA GLY 1 2HA GLY 1 -7.246 6.301 2.250
5 2HA GLY 1 1HA GLY 1 -6.502 5.333 3.522
6 H PHE 2 H PHE 2 -4.760 6.783 2.130
7 HA PHE 2 HA PHE 2 -2.796 6.678 0.862
8 1HB PHE 2 2HB PHE 2 -3.218 3.678 0.837
9 2HB PHE 2 1HB PHE 2 -1.694 4.551 0.699
10 HD1 PHE 2 HD1 PHE 2 -3.743 2.771 2.914
11 HD2 PHE 2 HD2 PHE 2 -1.266 6.277 2.732
12 HE1 PHE 2 HE1 PHE 2 -3.498 2.728 5.380
13 HE2 PHE 2 HE2 PHE 2 -1.022 6.232 5.199
14 HZ PHE 2 HZ PHE 2 -2.137 4.456 6.523
15 H GLY 3 H GLY 3 -5.466 6.803 -0.500
16 1HA GLY 3 2HA GLY 3 -6.190 6.937 -2.719
17 2HA GLY 3 1HA GLY 3 -4.546 6.550 -3.214
18 H CYS 4 H CYS 4 -6.993 4.707 -1.350
19 HA CYS 4 HA CYS 4 -6.469 2.385 -3.141
20 1HB CYS 4 2HB CYS 4 -7.435 2.688 -0.318
21 2HB CYS 4 1HB CYS 4 -7.898 1.249 -1.229
22 HA PRO 5 HA PRO 5 -7.590 0.387 -3.002
23 1HB PRO 5 2HB PRO 5 -8.749 -1.122 -4.977
24 2HB PRO 5 1HB PRO 5 -9.400 -0.992 -3.334
25 1HG PRO 5 2HG PRO 5 -10.420 0.221 -5.852
26 2HG PRO 5 1HG PRO 5 -11.291 -0.160 -4.358
27 1HD PRO 5 2HD PRO 5 -10.367 2.410 -5.180
28 2HD PRO 5 1HD PRO 5 -11.049 1.981 -3.596
29 H ASN 6 H ASN 6 -7.356 2.781 -5.164
30 HA ASN 6 HA ASN 6 -6.303 1.645 -7.554
31 1HB ASN 6 2HB ASN 6 -6.909 4.131 -6.942
32 2HB ASN 6 1HB ASN 6 -5.221 4.219 -6.444
33 1HD2 ASN 6 1HD2 ASN 6 -4.298 5.406 -8.178
34 2HD2 ASN 6 2HD2 ASN 6 -4.378 4.915 -9.801
35 H ASN 7 H ASN 7 -4.468 0.515 -7.878
36 HA ASN 7 HA ASN 7 -2.556 0.054 -5.756
37 1HB ASN 7 2HB ASN 7 -2.898 -0.838 -8.573
38 2HB ASN 7 1HB ASN 7 -1.266 -0.921 -7.909
39 1HD2 ASN 7 1HD2 ASN 7 -0.978 -2.233 -5.892
40 2HD2 ASN 7 2HD2 ASN 7 -2.079 -3.477 -5.543
41 H TYR 8 H TYR 8 -2.709 2.364 -8.396
42 HA TYR 8 HA TYR 8 0.085 2.975 -8.556
43 1HB TYR 8 2HB TYR 8 -1.465 3.754 -10.280
44 2HB TYR 8 1HB TYR 8 -2.341 4.720 -9.094
45 HD1 TYR 8 HD1 TYR 8 0.922 4.336 -10.841
46 HD2 TYR 8 HD2 TYR 8 -1.556 6.870 -8.412
47 HE1 TYR 8 HE1 TYR 8 2.485 6.224 -11.212
48 HE2 TYR 8 HE2 TYR 8 0.007 8.755 -8.783
49 HH TYR 8 HH TYR 8 1.935 9.128 -11.019
50 H GLN 9 H GLN 9 -2.546 4.531 -6.688
51 HA GLN 9 HA GLN 9 -0.702 6.257 -5.248
52 1HB GLN 9 2HB GLN 9 -3.595 5.511 -4.718
53 2HB GLN 9 1HB GLN 9 -2.701 6.735 -3.815
54 1HG GLN 9 2HG GLN 9 -2.189 7.613 -6.301
55 2HG GLN 9 1HG GLN 9 -3.734 6.820 -6.611
56 1HE2 GLN 9 1HE2 GLN 9 -5.642 7.846 -5.822
57 2HE2 GLN 9 2HE2 GLN 9 -5.622 9.298 -4.946
58 H CYS 10 H CYS 10 -2.304 3.152 -4.635
59 HA CYS 10 HA CYS 10 -1.527 2.859 -1.898
60 1HB CYS 10 2HB CYS 10 -3.193 1.430 -3.235
61 2HB CYS 10 1HB CYS 10 -1.786 0.577 -3.865
62 H HIS 11 H HIS 11 0.057 1.893 -4.949
63 HA HIS 11 HA HIS 11 2.320 0.611 -3.750
64 1HB HIS 11 2HB HIS 11 1.704 0.369 -6.151
65 2HB HIS 11 1HB HIS 11 2.162 2.051 -6.418
66 HD1 HIS 11 HD1 HIS 11 3.894 -0.852 -4.622
67 HD2 HIS 11 HD2 HIS 11 4.689 2.048 -7.509
68 HE1 HIS 11 HE1 HIS 11 6.323 -1.141 -5.281
69 H ARG 12 H ARG 12 1.655 3.985 -4.628
70 HA ARG 12 HA ARG 12 4.261 5.055 -4.200
71 1HB ARG 12 2HB ARG 12 1.732 6.079 -4.828
72 2HB ARG 12 1HB ARG 12 2.135 6.835 -3.287
73 1HG ARG 12 2HG ARG 12 3.616 8.199 -4.289
74 2HG ARG 12 1HG ARG 12 4.462 6.821 -4.992
75 1HD ARG 12 2HD ARG 12 2.117 6.998 -6.493
76 2HD ARG 12 1HD ARG 12 2.593 8.679 -6.248
77 HE ARG 12 HE ARG 12 4.182 6.622 -7.681
78 1HH1 ARG 12 2HH1 ARG 12 6.052 8.342 -6.156
79 2HH1 ARG 12 1HH1 ARG 12 6.330 9.665 -7.238
80 1HH2 ARG 12 1HH2 ARG 12 3.557 8.969 -9.220
81 2HH2 ARG 12 2HH2 ARG 12 4.913 10.020 -8.980
82 H HIS 13 H HIS 13 1.540 4.542 -1.947
83 HA HIS 13 HA HIS 13 2.799 5.661 0.367
84 1HB HIS 13 2HB HIS 13 0.394 5.235 0.323
85 2HB HIS 13 1HB HIS 13 0.673 3.506 0.126
86 HD1 HIS 13 HD1 HIS 13 1.944 6.140 2.599
87 HD2 HIS 13 HD2 HIS 13 0.375 2.279 2.567
88 HE1 HIS 13 HE1 HIS 13 1.876 5.375 5.013
89 H CYS 14 H CYS 14 2.624 2.279 -0.805
90 HA CYS 14 HA CYS 14 4.210 1.168 1.313
91 1HB CYS 14 2HB CYS 14 3.663 0.238 -1.516
92 2HB CYS 14 1HB CYS 14 4.595 -0.712 -0.359
93 H LYS 15 H LYS 15 5.043 2.678 -1.776
94 HA LYS 15 HA LYS 15 7.788 1.918 -1.896
95 1HB LYS 15 2HB LYS 15 6.142 4.130 -3.061
96 2HB LYS 15 1HB LYS 15 7.898 4.283 -3.126
97 1HG LYS 15 2HG LYS 15 7.609 1.700 -3.929
98 2HG LYS 15 1HG LYS 15 6.111 2.393 -4.551
99 1HD LYS 15 2HD LYS 15 7.192 3.580 -6.148
100 2HD LYS 15 1HD LYS 15 8.458 4.093 -5.031
101 1HE LYS 15 2HE LYS 15 8.416 1.231 -5.916
102 2HE LYS 15 1HE LYS 15 9.007 2.449 -7.045
103 1HZ LYS 15 1HZ LYS 15 10.886 1.807 -5.864
104 2HZ LYS 15 2HZ LYS 15 10.063 1.737 -4.379
105 3HZ LYS 15 3HZ LYS 15 10.419 3.241 -5.087
106 H SER 16 H SER 16 6.210 4.750 -0.360
107 HA SER 16 HA SER 16 8.693 5.895 0.575
108 1HB SER 16 2HB SER 16 7.224 7.270 2.054
109 2HB SER 16 1HB SER 16 6.716 7.300 0.369
110 HG SER 16 HG SER 16 5.554 6.036 2.591
111 H ILE 17 H ILE 17 6.545 3.412 1.824
112 HA ILE 17 HA ILE 17 7.579 3.463 4.539
113 HB ILE 17 HB ILE 17 6.057 1.335 2.999
114 1HG1 ILE 17 2HG1 ILE 17 5.113 3.130 5.249
115 2HG1 ILE 17 1HG1 ILE 17 4.958 3.583 3.552
116 1HG2 ILE 17 1HG2 ILE 17 6.640 1.494 5.976
117 2HG2 ILE 17 2HG2 ILE 17 7.436 0.384 4.859
118 3HG2 ILE 17 3HG2 ILE 17 5.703 0.242 5.157
119 1HD1 ILE 17 1HD1 ILE 17 3.054 2.196 4.897
120 2HD1 ILE 17 2HD1 ILE 17 4.007 0.861 4.250
121 3HD1 ILE 17 3HD1 ILE 17 3.305 2.054 3.158
122 HA PRO 18 HA PRO 18 11.353 1.343 3.525
123 1HB PRO 18 2HB PRO 18 12.301 1.265 6.104
124 2HB PRO 18 1HB PRO 18 12.366 2.708 5.078
125 1HG PRO 18 2HG PRO 18 10.572 2.127 7.383
126 2HG PRO 18 1HG PRO 18 11.094 3.690 6.734
127 1HD PRO 18 2HD PRO 18 8.577 2.449 6.297
128 2HD PRO 18 1HD PRO 18 9.214 3.865 5.437
129 H GLY 19 H GLY 19 11.901 -0.828 3.453
130 1HA GLY 19 2HA GLY 19 12.115 -3.044 4.430
131 2HA GLY 19 1HA GLY 19 10.751 -2.678 5.485
132 H ARG 20 H ARG 20 9.315 -1.485 3.044
133 HA ARG 20 HA ARG 20 8.432 -4.104 1.906
134 1HB ARG 20 2HB ARG 20 6.694 -1.695 1.648
135 2HB ARG 20 1HB ARG 20 6.247 -3.378 1.916
136 1HG ARG 20 2HG ARG 20 7.588 -1.683 4.039
137 2HG ARG 20 1HG ARG 20 5.839 -1.801 3.877
138 1HD ARG 20 2HD ARG 20 7.269 -4.394 3.900
139 2HD ARG 20 1HD ARG 20 7.340 -3.489 5.411
140 HE ARG 20 HE ARG 20 5.080 -4.941 4.539
141 1HH1 ARG 20 2HH1 ARG 20 6.015 -2.189 6.353
142 2HH1 ARG 20 1HH1 ARG 20 4.396 -1.691 6.705
143 1HH2 ARG 20 1HH2 ARG 20 2.922 -4.116 4.702
144 2HH2 ARG 20 2HH2 ARG 20 2.641 -2.782 5.770
145 H CYS 21 H CYS 21 8.130 -4.258 -0.354
146 HA CYS 21 HA CYS 21 9.537 -2.158 -1.927
147 1HB CYS 21 2HB CYS 21 9.510 -5.012 -2.026
148 2HB CYS 21 1HB CYS 21 8.816 -4.418 -3.534
149 H GLY 22 H GLY 22 6.643 -4.251 -2.255
150 1HA GLY 22 2HA GLY 22 5.285 -1.975 -3.636
151 2HA GLY 22 1HA GLY 22 5.113 -3.633 -4.209
152 H GLY 23 H GLY 23 2.744 -2.633 -3.694
153 1HA GLY 23 2HA GLY 23 1.834 -4.103 -1.351
154 2HA GLY 23 1HA GLY 23 1.697 -2.362 -1.145
155 H TYR 24 H TYR 24 -0.556 -3.899 -1.067
156 HA TYR 24 HA TYR 24 -2.007 -2.984 -3.493
157 1HB TYR 24 2HB TYR 24 -3.208 -5.120 -3.667
158 2HB TYR 24 1HB TYR 24 -1.474 -5.389 -3.835
159 HD1 TYR 24 HD1 TYR 24 -4.440 -6.018 -1.814
160 HD2 TYR 24 HD2 TYR 24 -0.152 -6.287 -1.900
161 HE1 TYR 24 HE1 TYR 24 -4.499 -7.584 0.107
162 HE2 TYR 24 HE2 TYR 24 -0.212 -7.851 0.020
163 HH TYR 24 HH TYR 24 -2.420 -8.172 2.063
164 H CYS 25 H CYS 25 -4.333 -2.752 -3.101
165 HA CYS 25 HA CYS 25 -4.885 -1.930 -0.336
166 1HB CYS 25 2HB CYS 25 -6.638 -1.867 -2.811
167 2HB CYS 25 1HB CYS 25 -7.028 -1.117 -1.263
168 H GLY 26 H GLY 26 -5.444 -3.503 1.086
169 1HA GLY 26 2HA GLY 26 -7.785 -5.153 0.647
170 2HA GLY 26 1HA GLY 26 -6.305 -6.106 0.545
171 H GLY 27 H GLY 27 -8.587 -5.836 2.622
172 1HA GLY 27 2HA GLY 27 -7.857 -6.748 4.918
173 2HA GLY 27 1HA GLY 27 -6.878 -5.285 5.014
174 H TRP 28 H TRP 28 -8.057 -3.203 4.922
175 HA TRP 28 HA TRP 28 -10.617 -3.401 6.402
176 1HB TRP 28 2HB TRP 28 -8.732 -1.950 7.245
177 2HB TRP 28 1HB TRP 28 -8.952 -0.933 5.822
178 HD1 TRP 28 HD1 TRP 28 -10.839 -2.110 8.962
179 HE1 TRP 28 HE1 TRP 28 -12.654 -0.373 9.521
180 HE3 TRP 28 HE3 TRP 28 -10.394 0.972 4.913
181 HZ2 TRP 28 HZ2 TRP 28 -13.771 2.010 8.406
182 HZ3 TRP 28 HZ3 TRP 28 -11.845 2.967 4.690
183 HH2 TRP 28 HH2 TRP 28 -13.533 3.489 6.427
184 H HIS 29 H HIS 29 -12.059 -3.901 4.702
185 HA HIS 29 HA HIS 29 -13.506 -3.458 2.919
186 1HB HIS 29 2HB HIS 29 -12.806 -0.566 3.514
187 2HB HIS 29 1HB HIS 29 -14.255 -1.152 2.704
188 HD1 HIS 29 HD1 HIS 29 -14.093 0.440 5.518
189 HD2 HIS 29 HD2 HIS 29 -14.753 -3.642 5.006
190 HE1 HIS 29 HE1 HIS 29 -15.226 -0.372 7.633
191 H ARG 30 H ARG 30 -10.646 -3.862 2.338
192 HA ARG 30 HA ARG 30 -9.166 -3.720 0.534
193 1HB ARG 30 2HB ARG 30 -11.384 -4.330 -0.621
194 2HB ARG 30 1HB ARG 30 -11.490 -2.626 -1.058
195 1HG ARG 30 2HG ARG 30 -9.705 -2.741 -2.517
196 2HG ARG 30 1HG ARG 30 -8.912 -4.025 -1.606
197 1HD ARG 30 2HD ARG 30 -9.661 -5.135 -3.538
198 2HD ARG 30 1HD ARG 30 -10.921 -5.496 -2.358
199 HE ARG 30 HE ARG 30 -11.171 -3.454 -4.527
200 1HH1 ARG 30 1HH2 ARG 30 -12.674 -6.075 -4.600
201 2HH1 ARG 30 2HH2 ARG 30 -14.224 -5.609 -3.984
202 1HH2 ARG 30 2HH1 ARG 30 -13.084 -2.606 -2.652
203 2HH2 ARG 30 1HH1 ARG 30 -14.457 -3.636 -2.878
204 H LEU 31 H LEU 31 -9.555 -1.373 2.321
205 HA LEU 31 HA LEU 31 -8.752 0.798 0.433
206 1HB LEU 31 2HB LEU 31 -10.215 0.899 3.072
207 2HB LEU 31 1HB LEU 31 -9.451 2.325 2.374
208 HG LEU 31 HG LEU 31 -11.549 0.616 1.002
209 1HD1 LEU 31 1HD1 LEU 31 -12.362 2.015 2.929
210 2HD1 LEU 31 2HD1 LEU 31 -13.056 2.474 1.374
211 3HD1 LEU 31 3HD1 LEU 31 -11.761 3.441 2.082
212 1HD2 LEU 31 1HD2 LEU 31 -11.396 3.035 -0.313
213 2HD2 LEU 31 2HD2 LEU 31 -10.611 1.550 -0.851
214 3HD2 LEU 31 3HD2 LEU 31 -9.707 2.733 0.093
215 H ARG 32 H ARG 32 -7.638 -1.256 2.938
216 HA ARG 32 HA ARG 32 -5.594 0.627 3.914
217 1HB ARG 32 2HB ARG 32 -6.718 -1.131 5.382
218 2HB ARG 32 1HB ARG 32 -5.793 -2.341 4.491
219 1HG ARG 32 2HG ARG 32 -3.935 -1.891 5.683
220 2HG ARG 32 1HG ARG 32 -4.067 -0.168 5.329
221 1HD ARG 32 2HD ARG 32 -6.036 -0.342 7.135
222 2HD ARG 32 1HD ARG 32 -5.061 -1.704 7.689
223 HE ARG 32 HE ARG 32 -4.202 1.140 7.669
224 1HH1 ARG 32 2HH1 ARG 32 -4.216 -0.324 10.217
225 2HH1 ARG 32 1HH1 ARG 32 -2.577 -0.857 10.381
226 1HH2 ARG 32 1HH2 ARG 32 -1.805 -0.355 7.028
227 2HH2 ARG 32 2HH2 ARG 32 -1.204 -0.872 8.568
228 H CYS 33 H CYS 33 -3.442 0.587 3.280
229 HA CYS 33 HA CYS 33 -2.832 -0.961 0.842
230 1HB CYS 33 2HB CYS 33 -1.613 1.384 2.248
231 2HB CYS 33 1HB CYS 33 -0.584 0.415 1.192
232 H THR 34 H THR 34 -2.252 -3.046 1.280
233 HA THR 34 HA THR 34 -0.522 -3.630 3.614
234 HB THR 34 HB THR 34 -1.866 -5.465 1.602
235 HG1 THR 34 HG1 THR 34 -3.492 -5.131 2.871
236 1HG2 THR 34 1HG2 THR 34 -1.288 -7.060 3.684
237 2HG2 THR 34 2HG2 THR 34 0.055 -5.926 3.834
238 3HG2 THR 34 3HG2 THR 34 -0.170 -6.833 2.338
239 H CYS 35 H CYS 35 1.616 -3.329 3.247
240 HA CYS 35 HA CYS 35 2.729 -3.801 0.538
241 1HB CYS 35 2HB CYS 35 4.354 -2.790 2.849
242 2HB CYS 35 1HB CYS 35 4.522 -2.432 1.132
243 H TYR 36 H TYR 36 4.490 -5.237 0.193
244 HA TYR 36 HA TYR 36 4.863 -7.265 2.361
245 1HB TYR 36 2HB TYR 36 5.616 -8.707 0.280
246 2HB TYR 36 1HB TYR 36 3.906 -8.519 0.656
247 HD1 TYR 36 HD1 TYR 36 6.664 -7.328 -1.533
248 HD2 TYR 36 HD2 TYR 36 2.429 -7.307 -0.799
249 HE1 TYR 36 HE1 TYR 36 6.280 -6.317 -3.764
250 HE2 TYR 36 HE2 TYR 36 2.048 -6.294 -3.029
251 HH TYR 36 HH TYR 36 3.298 -4.958 -4.683
252 H ARG 37 H ARG 37 7.003 -8.261 2.496
253 HA ARG 37 HA ARG 37 9.152 -6.375 2.481
254 1HB ARG 37 2HB ARG 37 9.040 -9.383 2.741
255 2HB ARG 37 1HB ARG 37 10.577 -8.518 2.745
256 1HG ARG 37 2HG ARG 37 9.731 -7.103 4.625
257 2HG ARG 37 1HG ARG 37 8.268 -8.088 4.664
258 1HD ARG 37 2HD ARG 37 11.082 -9.163 5.037
259 2HD ARG 37 1HD ARG 37 9.952 -8.827 6.348
260 HE ARG 37 HE ARG 37 9.726 -11.044 4.393
261 1HH1 ARG 37 1HH2 ARG 37 7.019 -9.873 4.943
262 2HH1 ARG 37 2HH2 ARG 37 6.502 -10.786 6.323
263 1HH2 ARG 37 2HH1 ARG 37 9.690 -11.946 7.080
264 2HH2 ARG 37 1HH1 ARG 37 8.021 -11.962 7.538
265 H CYS 38 H CYS 38 11.096 -6.403 1.184
266 HA CYS 38 HA CYS 38 10.546 -7.064 -1.653
267 1HB CYS 38 2HB CYS 38 11.538 -4.810 -0.707
268 2HB CYS 38 1HB CYS 38 13.057 -5.706 -0.724
269 H GLY 39 HN GLY 39 11.423 -8.833 -2.593
270 1HA GLY 39 2HA GLY 39 13.381 -10.447 -1.071
271 2HA GLY 39 1HA GLY 39 12.499 -10.974 -2.504
Start of MODEL 15
1 1H GLY 1 1H GLY 1 -7.607 3.580 2.377
2 2H GLY 1 2H GLY 1 -8.345 4.817 1.473
3 3H GLY 1 3H GLY 1 -8.698 4.643 3.127
4 1HA GLY 1 2HA GLY 1 -7.143 6.504 2.581
5 2HA GLY 1 1HA GLY 1 -6.550 5.349 3.772
6 H PHE 2 H PHE 2 -4.661 6.794 2.515
7 HA PHE 2 HA PHE 2 -2.703 6.662 1.240
8 1HB PHE 2 2HB PHE 2 -3.348 3.710 1.486
9 2HB PHE 2 1HB PHE 2 -1.818 4.342 0.882
10 HD1 PHE 2 HD1 PHE 2 -3.503 3.216 3.757
11 HD2 PHE 2 HD2 PHE 2 -0.709 6.208 2.454
12 HE1 PHE 2 HE1 PHE 2 -2.693 3.475 6.086
13 HE2 PHE 2 HE2 PHE 2 0.099 6.467 4.784
14 HZ PHE 2 HZ PHE 2 -0.892 5.101 6.599
15 H GLY 3 H GLY 3 -5.298 6.927 -0.191
16 1HA GLY 3 2HA GLY 3 -5.911 7.140 -2.439
17 2HA GLY 3 1HA GLY 3 -4.313 6.547 -2.880
18 H CYS 4 H CYS 4 -6.850 4.939 -0.944
19 HA CYS 4 HA CYS 4 -6.677 2.620 -2.801
20 1HB CYS 4 2HB CYS 4 -7.565 2.965 0.052
21 2HB CYS 4 1HB CYS 4 -8.137 1.582 -0.880
22 HA PRO 5 HA PRO 5 -8.085 0.742 -2.575
23 1HB PRO 5 2HB PRO 5 -9.451 -0.579 -4.555
24 2HB PRO 5 1HB PRO 5 -10.066 -0.376 -2.907
25 1HG PRO 5 2HG PRO 5 -10.919 0.999 -5.407
26 2HG PRO 5 1HG PRO 5 -11.835 0.701 -3.921
27 1HD PRO 5 2HD PRO 5 -10.610 3.151 -4.679
28 2HD PRO 5 1HD PRO 5 -11.301 2.764 -3.089
29 H ASN 6 H ASN 6 -7.623 3.103 -4.775
30 HA ASN 6 HA ASN 6 -6.687 1.840 -7.144
31 1HB ASN 6 2HB ASN 6 -7.028 4.375 -6.587
32 2HB ASN 6 1HB ASN 6 -5.354 4.298 -6.035
33 1HD2 ASN 6 1HD2 ASN 6 -7.290 4.738 -8.806
34 2HD2 ASN 6 2HD2 ASN 6 -6.089 4.485 -9.979
35 H ASN 7 H ASN 7 -4.915 0.622 -7.531
36 HA ASN 7 HA ASN 7 -3.061 0.001 -5.368
37 1HB ASN 7 2HB ASN 7 -3.269 -0.882 -8.249
38 2HB ASN 7 1HB ASN 7 -1.956 -1.406 -7.194
39 1HD2 ASN 7 1HD2 ASN 7 -2.387 -3.280 -6.012
40 2HD2 ASN 7 2HD2 ASN 7 -3.938 -3.874 -5.664
41 H TYR 8 H TYR 8 -3.076 2.220 -8.062
42 HA TYR 8 HA TYR 8 -0.232 2.542 -8.333
43 1HB TYR 8 2HB TYR 8 -2.003 3.386 -9.955
44 2HB TYR 8 1HB TYR 8 -2.332 4.678 -8.802
45 HD1 TYR 8 HD1 TYR 8 0.251 3.202 -11.021
46 HD2 TYR 8 HD2 TYR 8 -0.825 6.529 -8.524
47 HE1 TYR 8 HE1 TYR 8 2.169 4.493 -11.914
48 HE2 TYR 8 HE2 TYR 8 1.094 7.819 -9.418
49 HH TYR 8 HH TYR 8 3.550 6.880 -10.600
50 H GLN 9 H GLN 9 -2.668 4.474 -6.541
51 HA GLN 9 HA GLN 9 -0.748 6.143 -5.205
52 1HB GLN 9 2HB GLN 9 -3.547 5.349 -4.336
53 2HB GLN 9 1HB GLN 9 -2.609 6.684 -3.667
54 1HG GLN 9 2HG GLN 9 -2.584 7.811 -5.823
55 2HG GLN 9 1HG GLN 9 -3.394 6.443 -6.586
56 1HE2 GLN 9 1HE2 GLN 9 -3.884 9.225 -4.448
57 2HE2 GLN 9 2HE2 GLN 9 -5.579 9.125 -4.418
58 H CYS 10 H CYS 10 -2.428 3.150 -4.240
59 HA CYS 10 HA CYS 10 -1.301 2.894 -1.636
60 1HB CYS 10 2HB CYS 10 -3.185 1.510 -2.739
61 2HB CYS 10 1HB CYS 10 -1.888 0.543 -3.437
62 H HIS 11 H HIS 11 -0.150 1.787 -4.816
63 HA HIS 11 HA HIS 11 2.148 0.358 -3.915
64 1HB HIS 11 2HB HIS 11 1.314 0.154 -6.210
65 2HB HIS 11 1HB HIS 11 1.670 1.853 -6.514
66 HD1 HIS 11 HD1 HIS 11 3.926 -0.648 -4.747
67 HD2 HIS 11 HD2 HIS 11 3.826 1.597 -8.257
68 HE1 HIS 11 HE1 HIS 11 6.179 -0.961 -5.859
69 H ARG 12 H ARG 12 1.705 3.787 -4.796
70 HA ARG 12 HA ARG 12 4.430 4.593 -4.543
71 1HB ARG 12 2HB ARG 12 2.231 5.883 -5.345
72 2HB ARG 12 1HB ARG 12 2.259 6.462 -3.680
73 1HG ARG 12 2HG ARG 12 4.766 6.978 -4.129
74 2HG ARG 12 1HG ARG 12 4.337 6.830 -5.834
75 1HD ARG 12 2HD ARG 12 3.305 8.839 -5.845
76 2HD ARG 12 1HD ARG 12 2.422 8.474 -4.362
77 HE ARG 12 HE ARG 12 4.664 9.081 -3.195
78 1HH1 ARG 12 2HH1 ARG 12 3.111 11.500 -3.696
79 2HH1 ARG 12 1HH1 ARG 12 4.175 12.482 -4.645
80 1HH2 ARG 12 1HH2 ARG 12 6.260 9.841 -5.515
81 2HH2 ARG 12 2HH2 ARG 12 5.966 11.538 -5.679
82 H HIS 13 H HIS 13 1.834 4.283 -2.134
83 HA HIS 13 HA HIS 13 3.260 5.436 0.072
84 1HB HIS 13 2HB HIS 13 0.870 5.139 0.248
85 2HB HIS 13 1HB HIS 13 1.009 3.407 -0.046
86 HD1 HIS 13 HD1 HIS 13 2.564 5.850 2.463
87 HD2 HIS 13 HD2 HIS 13 0.861 2.048 2.334
88 HE1 HIS 13 HE1 HIS 13 2.620 4.959 4.834
89 H CYS 14 H CYS 14 2.990 2.081 -1.123
90 HA CYS 14 HA CYS 14 4.533 0.850 0.950
91 1HB CYS 14 2HB CYS 14 4.283 0.020 -1.958
92 2HB CYS 14 1HB CYS 14 4.819 -1.010 -0.633
93 H LYS 15 H LYS 15 5.441 2.521 -2.026
94 HA LYS 15 HA LYS 15 8.208 1.764 -2.066
95 1HB LYS 15 2HB LYS 15 6.656 4.076 -3.230
96 2HB LYS 15 1HB LYS 15 8.409 3.980 -3.398
97 1HG LYS 15 2HG LYS 15 7.596 1.427 -4.085
98 2HG LYS 15 1HG LYS 15 6.316 2.435 -4.760
99 1HD LYS 15 2HD LYS 15 8.219 3.901 -5.707
100 2HD LYS 15 1HD LYS 15 9.279 2.539 -5.337
101 1HE LYS 15 2HE LYS 15 7.559 1.105 -6.638
102 2HE LYS 15 1HE LYS 15 6.959 2.640 -7.264
103 1HZ LYS 15 1HZ LYS 15 8.628 1.671 -8.720
104 2HZ LYS 15 2HZ LYS 15 9.762 1.673 -7.456
105 3HZ LYS 15 3HZ LYS 15 9.174 3.141 -8.077
106 H SER 16 H SER 16 6.512 4.579 -0.629
107 HA SER 16 HA SER 16 8.896 5.839 0.364
108 1HB SER 16 2HB SER 16 7.275 7.005 1.953
109 2HB SER 16 1HB SER 16 6.943 7.201 0.237
110 HG SER 16 HG SER 16 5.682 5.471 2.099
111 H ILE 17 H ILE 17 6.946 3.182 1.573
112 HA ILE 17 HA ILE 17 7.938 3.282 4.298
113 HB ILE 17 HB ILE 17 6.764 0.951 2.743
114 1HG1 ILE 17 2HG1 ILE 17 5.375 2.687 4.792
115 2HG1 ILE 17 1HG1 ILE 17 5.358 3.093 3.076
116 1HG2 ILE 17 1HG2 ILE 17 6.367 -0.052 4.928
117 2HG2 ILE 17 2HG2 ILE 17 7.031 1.367 5.737
118 3HG2 ILE 17 3HG2 ILE 17 8.083 0.324 4.779
119 1HD1 ILE 17 1HD1 ILE 17 4.712 0.402 3.073
120 2HD1 ILE 17 2HD1 ILE 17 3.557 1.727 2.937
121 3HD1 ILE 17 3HD1 ILE 17 3.886 1.002 4.511
122 HA PRO 18 HA PRO 18 11.938 1.606 3.356
123 1HB PRO 18 2HB PRO 18 12.768 1.392 5.970
124 2HB PRO 18 1HB PRO 18 12.747 2.915 5.066
125 1HG PRO 18 2HG PRO 18 10.888 1.974 7.201
126 2HG PRO 18 1HG PRO 18 11.321 3.629 6.739
127 1HD PRO 18 2HD PRO 18 8.933 2.294 6.037
128 2HD PRO 18 1HD PRO 18 9.543 3.792 5.302
129 H GLY 19 H GLY 19 12.427 -0.505 2.917
130 1HA GLY 19 2HA GLY 19 12.831 -2.804 3.543
131 2HA GLY 19 1HA GLY 19 11.674 -2.624 4.859
132 H ARG 20 H ARG 20 10.127 -1.181 2.353
133 HA ARG 20 HA ARG 20 8.749 -3.720 1.611
134 1HB ARG 20 2HB ARG 20 7.848 -0.911 2.011
135 2HB ARG 20 1HB ARG 20 7.029 -1.845 0.764
136 1HG ARG 20 2HG ARG 20 5.828 -2.149 2.847
137 2HG ARG 20 1HG ARG 20 6.649 -3.660 2.455
138 1HD ARG 20 2HD ARG 20 8.352 -3.278 4.068
139 2HD ARG 20 1HD ARG 20 7.910 -1.580 4.245
140 HE ARG 20 HE ARG 20 6.025 -2.247 5.589
141 1HH1 ARG 20 1HH2 ARG 20 8.210 -4.040 6.688
142 2HH1 ARG 20 2HH2 ARG 20 7.409 -5.572 6.734
143 1HH2 ARG 20 2HH1 ARG 20 4.837 -4.591 4.609
144 2HH2 ARG 20 1HH1 ARG 20 5.493 -5.887 5.554
145 H CYS 21 H CYS 21 7.807 -3.717 -0.622
146 HA CYS 21 HA CYS 21 9.554 -2.299 -2.590
147 1HB CYS 21 2HB CYS 21 9.394 -5.115 -2.122
148 2HB CYS 21 1HB CYS 21 8.654 -4.787 -3.688
149 H GLY 22 H GLY 22 6.557 -4.234 -2.295
150 1HA GLY 22 2HA GLY 22 5.122 -2.140 -3.828
151 2HA GLY 22 1HA GLY 22 5.039 -3.800 -4.415
152 H GLY 23 H GLY 23 2.638 -2.824 -3.822
153 1HA GLY 23 2HA GLY 23 1.752 -4.464 -1.598
154 2HA GLY 23 1HA GLY 23 1.650 -2.748 -1.218
155 H TYR 24 H TYR 24 -0.706 -3.337 -1.083
156 HA TYR 24 HA TYR 24 -2.081 -2.498 -3.507
157 1HB TYR 24 2HB TYR 24 -3.431 -4.541 -3.805
158 2HB TYR 24 1HB TYR 24 -1.720 -4.888 -4.043
159 HD1 TYR 24 HD1 TYR 24 -4.662 -5.495 -1.979
160 HD2 TYR 24 HD2 TYR 24 -0.406 -6.025 -2.237
161 HE1 TYR 24 HE1 TYR 24 -4.768 -7.202 -0.187
162 HE2 TYR 24 HE2 TYR 24 -0.512 -7.733 -0.444
163 HH TYR 24 HH TYR 24 -2.332 -8.153 1.593
164 H CYS 25 H CYS 25 -4.566 -2.654 -3.088
165 HA CYS 25 HA CYS 25 -5.034 -1.767 -0.294
166 1HB CYS 25 2HB CYS 25 -6.764 -1.572 -2.779
167 2HB CYS 25 1HB CYS 25 -7.228 -0.970 -1.189
168 H GLY 26 H GLY 26 -5.973 -3.144 1.138
169 1HA GLY 26 2HA GLY 26 -8.133 -4.923 0.497
170 2HA GLY 26 1HA GLY 26 -6.626 -5.832 0.556
171 H GLY 27 H GLY 27 -9.114 -5.580 2.394
172 1HA GLY 27 2HA GLY 27 -8.558 -6.457 4.766
173 2HA GLY 27 1HA GLY 27 -7.674 -4.941 4.934
174 H TRP 28 H TRP 28 -8.843 -2.997 5.160
175 HA TRP 28 HA TRP 28 -11.608 -3.339 6.124
176 1HB TRP 28 2HB TRP 28 -9.922 -1.959 7.372
177 2HB TRP 28 1HB TRP 28 -9.906 -0.829 6.019
178 HD1 TRP 28 HD1 TRP 28 -12.322 -2.264 8.658
179 HE1 TRP 28 HE1 TRP 28 -14.189 -0.537 9.067
180 HE3 TRP 28 HE3 TRP 28 -11.126 1.195 5.096
181 HZ2 TRP 28 HZ2 TRP 28 -15.061 1.979 8.027
182 HZ3 TRP 28 HZ3 TRP 28 -12.488 3.247 4.831
183 HH2 TRP 28 HH2 TRP 28 -14.454 3.642 6.288
184 H HIS 29 H HIS 29 -12.865 -3.637 4.271
185 HA HIS 29 HA HIS 29 -14.061 -3.053 2.349
186 1HB HIS 29 2HB HIS 29 -13.351 -0.234 3.221
187 2HB HIS 29 1HB HIS 29 -14.677 -0.691 2.158
188 HD1 HIS 29 HD1 HIS 29 -14.941 0.713 5.038
189 HD2 HIS 29 HD2 HIS 29 -15.578 -3.316 4.196
190 HE1 HIS 29 HE1 HIS 29 -16.408 -0.183 6.898
191 H ARG 30 H ARG 30 -11.161 -3.528 2.121
192 HA ARG 30 HA ARG 30 -9.441 -3.336 0.555
193 1HB ARG 30 2HB ARG 30 -11.370 -3.953 -0.951
194 2HB ARG 30 1HB ARG 30 -11.605 -2.231 -1.260
195 1HG ARG 30 2HG ARG 30 -9.702 -2.058 -2.530
196 2HG ARG 30 1HG ARG 30 -8.836 -3.266 -1.584
197 1HD ARG 30 2HD ARG 30 -10.866 -4.745 -2.739
198 2HD ARG 30 1HD ARG 30 -10.442 -3.599 -4.013
199 HE ARG 30 HE ARG 30 -8.157 -4.945 -2.728
200 1HH1 ARG 30 2HH1 ARG 30 -8.226 -3.753 -5.520
201 2HH1 ARG 30 1HH1 ARG 30 -8.273 -5.178 -6.503
202 1HH2 ARG 30 1HH2 ARG 30 -9.180 -7.272 -3.876
203 2HH2 ARG 30 2HH2 ARG 30 -8.813 -7.181 -5.566
204 H LEU 31 H LEU 31 -10.050 -1.055 2.344
205 HA LEU 31 HA LEU 31 -9.081 1.215 0.668
206 1HB LEU 31 2HB LEU 31 -10.564 1.140 3.304
207 2HB LEU 31 1HB LEU 31 -9.815 2.606 2.676
208 HG LEU 31 HG LEU 31 -11.701 0.993 0.965
209 1HD1 LEU 31 1HD1 LEU 31 -13.557 2.351 1.744
210 2HD1 LEU 31 2HD1 LEU 31 -12.494 3.249 2.827
211 3HD1 LEU 31 3HD1 LEU 31 -12.830 1.546 3.133
212 1HD2 LEU 31 1HD2 LEU 31 -10.982 3.941 1.063
213 2HD2 LEU 31 2HD2 LEU 31 -12.005 3.162 -0.143
214 3HD2 LEU 31 3HD2 LEU 31 -10.288 2.769 -0.057
215 H ARG 32 H ARG 32 -8.182 -1.003 3.161
216 HA ARG 32 HA ARG 32 -6.071 0.669 4.312
217 1HB ARG 32 2HB ARG 32 -7.264 -1.159 5.585
218 2HB ARG 32 1HB ARG 32 -6.452 -2.333 4.550
219 1HG ARG 32 2HG ARG 32 -4.254 -1.430 5.281
220 2HG ARG 32 1HG ARG 32 -5.091 -0.314 6.361
221 1HD ARG 32 2HD ARG 32 -4.574 -2.107 7.784
222 2HD ARG 32 1HD ARG 32 -6.233 -2.464 7.307
223 HE ARG 32 HE ARG 32 -5.023 -3.920 5.465
224 1HH1 ARG 32 1HH2 ARG 32 -5.616 -5.391 7.943
225 2HH1 ARG 32 2HH2 ARG 32 -4.064 -5.980 8.435
226 1HH2 ARG 32 2HH1 ARG 32 -2.296 -3.775 6.409
227 2HH2 ARG 32 1HH1 ARG 32 -2.175 -5.061 7.563
228 H CYS 33 H CYS 33 -3.889 0.602 3.755
229 HA CYS 33 HA CYS 33 -3.248 -0.742 1.197
230 1HB CYS 33 2HB CYS 33 -2.166 1.556 2.722
231 2HB CYS 33 1HB CYS 33 -0.972 0.589 1.855
232 H THR 34 H THR 34 -2.244 -2.667 1.183
233 HA THR 34 HA THR 34 -0.729 -3.504 3.617
234 HB THR 34 HB THR 34 -2.173 -5.120 1.498
235 HG1 THR 34 HG1 THR 34 -2.477 -5.113 4.313
236 1HG2 THR 34 1HG2 THR 34 -0.370 -6.519 1.884
237 2HG2 THR 34 2HG2 THR 34 -1.423 -7.008 3.212
238 3HG2 THR 34 3HG2 THR 34 -0.093 -5.889 3.507
239 H CYS 35 H CYS 35 1.410 -3.155 3.271
240 HA CYS 35 HA CYS 35 2.535 -3.684 0.553
241 1HB CYS 35 2HB CYS 35 3.866 -2.177 2.818
242 2HB CYS 35 1HB CYS 35 4.340 -2.202 1.120
243 H TYR 36 H TYR 36 4.266 -5.158 0.352
244 HA TYR 36 HA TYR 36 4.844 -6.753 2.816
245 1HB TYR 36 2HB TYR 36 5.539 -8.540 1.051
246 2HB TYR 36 1HB TYR 36 3.826 -8.264 1.346
247 HD1 TYR 36 HD1 TYR 36 6.648 -7.478 -0.949
248 HD2 TYR 36 HD2 TYR 36 2.393 -7.401 -0.360
249 HE1 TYR 36 HE1 TYR 36 6.325 -6.918 -3.342
250 HE2 TYR 36 HE2 TYR 36 2.071 -6.837 -2.752
251 HH TYR 36 HH TYR 36 4.171 -5.594 -4.643
252 H ARG 37 H ARG 37 7.023 -7.700 2.966
253 HA ARG 37 HA ARG 37 9.084 -5.738 2.480
254 1HB ARG 37 2HB ARG 37 9.036 -8.538 3.569
255 2HB ARG 37 1HB ARG 37 10.576 -7.762 3.207
256 1HG ARG 37 2HG ARG 37 10.243 -6.066 4.798
257 2HG ARG 37 1HG ARG 37 8.500 -6.323 4.845
258 1HD ARG 37 2HD ARG 37 9.446 -7.241 6.880
259 2HD ARG 37 1HD ARG 37 8.928 -8.583 5.862
260 HE ARG 37 HE ARG 37 11.309 -8.932 5.260
261 1HH1 ARG 37 1HH2 ARG 37 12.447 -6.290 5.982
262 2HH1 ARG 37 2HH2 ARG 37 13.189 -6.596 7.517
263 1HH2 ARG 37 2HH1 ARG 37 11.463 -9.567 8.051
264 2HH2 ARG 37 1HH1 ARG 37 12.635 -8.463 8.690
265 H CYS 38 H CYS 38 10.839 -5.845 1.044
266 HA CYS 38 HA CYS 38 10.302 -7.171 -1.503
267 1HB CYS 38 2HB CYS 38 11.506 -4.858 -0.971
268 2HB CYS 38 1HB CYS 38 12.938 -5.884 -0.903
269 H GLY 39 HN GLY 39 11.234 -9.043 -2.253
270 1HA GLY 39 2HA GLY 39 12.920 -10.579 -0.367
271 2HA GLY 39 1HA GLY 39 12.133 -11.224 -1.808
Start of MODEL 16
1 1H GLY 1 1H GLY 1 -7.529 3.448 2.162
2 2H GLY 1 2H GLY 1 -8.356 4.728 1.409
3 3H GLY 1 3H GLY 1 -8.608 4.406 3.057
4 1HA GLY 1 2HA GLY 1 -7.104 6.360 2.457
5 2HA GLY 1 1HA GLY 1 -6.537 5.226 3.682
6 H PHE 2 H PHE 2 -4.632 6.673 2.413
7 HA PHE 2 HA PHE 2 -2.632 6.494 1.203
8 1HB PHE 2 2HB PHE 2 -3.179 3.518 1.136
9 2HB PHE 2 1HB PHE 2 -1.615 4.330 1.096
10 HD1 PHE 2 HD1 PHE 2 -3.834 2.591 3.158
11 HD2 PHE 2 HD2 PHE 2 -1.261 6.030 3.181
12 HE1 PHE 2 HE1 PHE 2 -3.734 2.500 5.635
13 HE2 PHE 2 HE2 PHE 2 -1.161 5.940 5.657
14 HZ PHE 2 HZ PHE 2 -2.397 4.174 6.883
15 H GLY 3 H GLY 3 -5.228 6.755 -0.257
16 1HA GLY 3 2HA GLY 3 -5.791 6.990 -2.517
17 2HA GLY 3 1HA GLY 3 -4.207 6.348 -2.938
18 H CYS 4 H CYS 4 -6.758 4.801 -0.977
19 HA CYS 4 HA CYS 4 -6.681 2.495 -2.860
20 1HB CYS 4 2HB CYS 4 -7.431 2.805 0.035
21 2HB CYS 4 1HB CYS 4 -8.076 1.451 -0.890
22 HA PRO 5 HA PRO 5 -8.095 0.625 -2.619
23 1HB PRO 5 2HB PRO 5 -9.515 -0.625 -4.607
24 2HB PRO 5 1HB PRO 5 -10.086 -0.476 -2.937
25 1HG PRO 5 2HG PRO 5 -10.995 0.991 -5.365
26 2HG PRO 5 1HG PRO 5 -11.878 0.636 -3.872
27 1HD PRO 5 2HD PRO 5 -10.679 3.115 -4.556
28 2HD PRO 5 1HD PRO 5 -11.310 2.658 -2.960
29 H ASN 6 H ASN 6 -7.754 3.045 -4.821
30 HA ASN 6 HA ASN 6 -6.826 1.838 -7.216
31 1HB ASN 6 2HB ASN 6 -7.185 4.363 -6.592
32 2HB ASN 6 1HB ASN 6 -5.497 4.290 -6.085
33 1HD2 ASN 6 1HD2 ASN 6 -7.601 4.479 -8.848
34 2HD2 ASN 6 2HD2 ASN 6 -6.390 4.394 -10.034
35 H ASN 7 H ASN 7 -4.826 1.003 -7.825
36 HA ASN 7 HA ASN 7 -3.023 0.259 -5.606
37 1HB ASN 7 2HB ASN 7 -3.488 -0.723 -8.386
38 2HB ASN 7 1HB ASN 7 -1.897 -0.985 -7.672
39 1HD2 ASN 7 1HD2 ASN 7 -5.238 -2.011 -7.591
40 2HD2 ASN 7 2HD2 ASN 7 -5.058 -3.166 -6.360
41 H TYR 8 H TYR 8 -3.127 2.541 -8.227
42 HA TYR 8 HA TYR 8 -0.298 2.886 -8.599
43 1HB TYR 8 2HB TYR 8 -2.223 3.782 -10.065
44 2HB TYR 8 1HB TYR 8 -2.366 5.077 -8.882
45 HD1 TYR 8 HD1 TYR 8 -1.875 6.315 -11.198
46 HD2 TYR 8 HD2 TYR 8 1.023 4.058 -8.963
47 HE1 TYR 8 HE1 TYR 8 -0.042 7.544 -12.326
48 HE2 TYR 8 HE2 TYR 8 2.850 5.289 -10.094
49 HH TYR 8 HH TYR 8 2.731 7.968 -11.396
50 H GLN 9 H GLN 9 -2.645 4.838 -6.709
51 HA GLN 9 HA GLN 9 -0.640 6.391 -5.360
52 1HB GLN 9 2HB GLN 9 -3.465 5.723 -4.469
53 2HB GLN 9 1HB GLN 9 -2.461 7.016 -3.816
54 1HG GLN 9 2HG GLN 9 -2.991 6.901 -6.774
55 2HG GLN 9 1HG GLN 9 -4.212 7.572 -5.694
56 1HE2 GLN 9 1HE2 GLN 9 -1.029 8.130 -7.097
57 2HE2 GLN 9 2HE2 GLN 9 -0.821 9.691 -6.463
58 H CYS 10 H CYS 10 -2.327 3.367 -4.541
59 HA CYS 10 HA CYS 10 -1.288 3.041 -1.899
60 1HB CYS 10 2HB CYS 10 -3.135 1.677 -3.014
61 2HB CYS 10 1HB CYS 10 -1.859 0.796 -3.852
62 H HIS 11 H HIS 11 -0.073 2.009 -5.080
63 HA HIS 11 HA HIS 11 2.225 0.575 -4.232
64 1HB HIS 11 2HB HIS 11 1.254 0.783 -6.596
65 2HB HIS 11 1HB HIS 11 2.093 2.327 -6.701
66 HD1 HIS 11 HD1 HIS 11 3.165 -1.123 -5.440
67 HD2 HIS 11 HD2 HIS 11 4.454 1.877 -8.028
68 HE1 HIS 11 HE1 HIS 11 5.381 -1.900 -6.393
69 H ARG 12 H ARG 12 1.830 4.058 -4.953
70 HA ARG 12 HA ARG 12 4.551 4.790 -4.454
71 1HB ARG 12 2HB ARG 12 2.492 6.150 -5.461
72 2HB ARG 12 1HB ARG 12 2.346 6.699 -3.790
73 1HG ARG 12 2HG ARG 12 4.672 7.450 -3.797
74 2HG ARG 12 1HG ARG 12 4.891 6.827 -5.433
75 1HD ARG 12 2HD ARG 12 2.900 8.374 -6.057
76 2HD ARG 12 1HD ARG 12 3.236 9.176 -4.523
77 HE ARG 12 HE ARG 12 4.696 9.646 -6.881
78 1HH1 ARG 12 1HH2 ARG 12 5.024 10.919 -4.072
79 2HH1 ARG 12 2HH2 ARG 12 6.707 10.624 -3.792
80 1HH2 ARG 12 2HH1 ARG 12 6.989 8.277 -6.340
81 2HH2 ARG 12 1HH1 ARG 12 7.825 9.126 -5.083
82 H HIS 13 H HIS 13 1.717 4.548 -2.314
83 HA HIS 13 HA HIS 13 2.923 5.658 0.026
84 1HB HIS 13 2HB HIS 13 0.514 5.308 -0.086
85 2HB HIS 13 1HB HIS 13 0.739 3.569 -0.264
86 HD1 HIS 13 HD1 HIS 13 2.017 6.173 2.240
87 HD2 HIS 13 HD2 HIS 13 0.327 2.364 2.168
88 HE1 HIS 13 HE1 HIS 13 1.837 5.425 4.653
89 H CYS 14 H CYS 14 2.707 2.272 -1.122
90 HA CYS 14 HA CYS 14 4.115 1.088 1.060
91 1HB CYS 14 2HB CYS 14 3.757 0.273 -1.828
92 2HB CYS 14 1HB CYS 14 4.664 -0.718 -0.688
93 H LYS 15 H LYS 15 5.250 2.742 -1.845
94 HA LYS 15 HA LYS 15 8.015 1.946 -1.636
95 1HB LYS 15 2HB LYS 15 6.727 4.353 -2.960
96 2HB LYS 15 1HB LYS 15 8.420 3.902 -3.148
97 1HG LYS 15 2HG LYS 15 6.894 1.558 -3.641
98 2HG LYS 15 1HG LYS 15 6.124 2.864 -4.541
99 1HD LYS 15 2HD LYS 15 8.418 3.479 -5.424
100 2HD LYS 15 1HD LYS 15 9.019 1.987 -4.698
101 1HE LYS 15 2HE LYS 15 6.614 1.873 -6.491
102 2HE LYS 15 1HE LYS 15 8.216 1.999 -7.214
103 1HZ LYS 15 1HZ LYS 15 7.154 -0.138 -5.468
104 2HZ LYS 15 2HZ LYS 15 8.825 0.074 -5.697
105 3HZ LYS 15 3HZ LYS 15 7.822 -0.277 -7.022
106 H SER 16 H SER 16 6.189 4.796 -0.482
107 HA SER 16 HA SER 16 8.402 6.212 0.621
108 1HB SER 16 2HB SER 16 6.768 7.468 1.898
109 2HB SER 16 1HB SER 16 6.095 7.153 0.304
110 HG SER 16 HG SER 16 4.928 5.422 1.223
111 H ILE 17 H ILE 17 6.604 3.438 1.806
112 HA ILE 17 HA ILE 17 7.718 3.622 4.517
113 HB ILE 17 HB ILE 17 6.242 1.335 3.169
114 1HG1 ILE 17 2HG1 ILE 17 4.985 3.142 5.198
115 2HG1 ILE 17 1HG1 ILE 17 5.158 3.754 3.552
116 1HG2 ILE 17 1HG2 ILE 17 7.505 0.614 5.135
117 2HG2 ILE 17 2HG2 ILE 17 5.785 0.654 5.526
118 3HG2 ILE 17 3HG2 ILE 17 6.845 1.950 6.079
119 1HD1 ILE 17 1HD1 ILE 17 3.100 2.700 3.389
120 2HD1 ILE 17 2HD1 ILE 17 3.529 1.451 4.556
121 3HD1 ILE 17 3HD1 ILE 17 4.168 1.381 2.914
122 HA PRO 18 HA PRO 18 11.460 1.565 3.283
123 1HB PRO 18 2HB PRO 18 12.534 1.420 5.811
124 2HB PRO 18 1HB PRO 18 12.539 2.890 4.821
125 1HG PRO 18 2HG PRO 18 10.848 2.225 7.186
126 2HG PRO 18 1HG PRO 18 11.350 3.810 6.575
127 1HD PRO 18 2HD PRO 18 8.809 2.621 6.204
128 2HD PRO 18 1HD PRO 18 9.439 4.034 5.330
129 H GLY 19 H GLY 19 12.066 -0.582 3.134
130 1HA GLY 19 2HA GLY 19 12.353 -2.828 3.999
131 2HA GLY 19 1HA GLY 19 11.047 -2.526 5.141
132 H ARG 20 H ARG 20 9.548 -1.255 2.704
133 HA ARG 20 HA ARG 20 8.537 -3.863 1.652
134 1HB ARG 20 2HB ARG 20 6.957 -1.334 1.378
135 2HB ARG 20 1HB ARG 20 6.389 -2.989 1.581
136 1HG ARG 20 2HG ARG 20 7.830 -1.500 3.788
137 2HG ARG 20 1HG ARG 20 6.081 -1.426 3.588
138 1HD ARG 20 2HD ARG 20 5.857 -3.795 3.906
139 2HD ARG 20 1HD ARG 20 7.602 -4.032 3.815
140 HE ARG 20 HE ARG 20 6.266 -2.576 6.065
141 1HH1 ARG 20 1HH2 ARG 20 9.171 -2.184 5.978
142 2HH1 ARG 20 2HH2 ARG 20 9.784 -3.502 6.923
143 1HH2 ARG 20 2HH1 ARG 20 6.840 -5.343 6.741
144 2HH2 ARG 20 1HH1 ARG 20 8.456 -5.295 7.361
145 H CYS 21 H CYS 21 8.226 -4.087 -0.604
146 HA CYS 21 HA CYS 21 9.665 -2.062 -2.255
147 1HB CYS 21 2HB CYS 21 9.630 -4.915 -2.261
148 2HB CYS 21 1HB CYS 21 8.923 -4.371 -3.781
149 H GLY 22 H GLY 22 6.698 -4.064 -2.347
150 1HA GLY 22 2HA GLY 22 5.334 -1.829 -3.769
151 2HA GLY 22 1HA GLY 22 5.218 -3.464 -4.419
152 H GLY 23 H GLY 23 2.811 -2.661 -3.917
153 1HA GLY 23 2HA GLY 23 1.912 -4.246 -1.667
154 2HA GLY 23 1HA GLY 23 1.747 -2.526 -1.335
155 H TYR 24 H TYR 24 -0.562 -3.646 -1.256
156 HA TYR 24 HA TYR 24 -1.953 -2.784 -3.713
157 1HB TYR 24 2HB TYR 24 -3.157 -4.876 -4.001
158 2HB TYR 24 1HB TYR 24 -1.430 -5.229 -4.023
159 HD1 TYR 24 HD1 TYR 24 -0.317 -6.165 -1.968
160 HD2 TYR 24 HD2 TYR 24 -4.579 -5.716 -2.268
161 HE1 TYR 24 HE1 TYR 24 -0.617 -7.699 -0.042
162 HE2 TYR 24 HE2 TYR 24 -4.877 -7.251 -0.345
163 HH TYR 24 HH TYR 24 -3.254 -9.266 0.666
164 H CYS 25 H CYS 25 -4.332 -2.622 -3.332
165 HA CYS 25 HA CYS 25 -4.887 -1.792 -0.561
166 1HB CYS 25 2HB CYS 25 -6.529 -1.689 -3.107
167 2HB CYS 25 1HB CYS 25 -7.138 -1.156 -1.541
168 H GLY 26 H GLY 26 -5.607 -3.263 0.892
169 1HA GLY 26 2HA GLY 26 -7.849 -4.968 0.496
170 2HA GLY 26 1HA GLY 26 -6.393 -5.926 0.232
171 H GLY 27 H GLY 27 -8.452 -5.926 2.458
172 1HA GLY 27 2HA GLY 27 -7.499 -6.900 4.644
173 2HA GLY 27 1HA GLY 27 -6.635 -5.368 4.767
174 H TRP 28 H TRP 28 -8.116 -3.385 4.600
175 HA TRP 28 HA TRP 28 -10.585 -3.893 6.201
176 1HB TRP 28 2HB TRP 28 -8.785 -2.517 7.289
177 2HB TRP 28 1HB TRP 28 -8.978 -1.327 6.003
178 HD1 TRP 28 HD1 TRP 28 -10.962 -2.947 8.879
179 HE1 TRP 28 HE1 TRP 28 -12.822 -1.318 9.602
180 HE3 TRP 28 HE3 TRP 28 -10.402 0.673 5.320
181 HZ2 TRP 28 HZ2 TRP 28 -13.925 1.189 8.784
182 HZ3 TRP 28 HZ3 TRP 28 -11.868 2.669 5.318
183 HH2 TRP 28 HH2 TRP 28 -13.630 2.930 7.043
184 H HIS 29 H HIS 29 -12.007 -4.187 4.448
185 HA HIS 29 HA HIS 29 -13.461 -3.552 2.731
186 1HB HIS 29 2HB HIS 29 -12.785 -0.748 3.675
187 2HB HIS 29 1HB HIS 29 -14.214 -1.227 2.766
188 HD1 HIS 29 HD1 HIS 29 -14.157 0.016 5.736
189 HD2 HIS 29 HD2 HIS 29 -14.718 -3.994 4.750
190 HE1 HIS 29 HE1 HIS 29 -15.329 -1.051 7.713
191 H ARG 30 H ARG 30 -10.575 -3.837 2.134
192 HA ARG 30 HA ARG 30 -9.085 -3.462 0.372
193 1HB ARG 30 2HB ARG 30 -11.243 -4.038 -0.880
194 2HB ARG 30 1HB ARG 30 -11.447 -2.303 -1.118
195 1HG ARG 30 2HG ARG 30 -9.664 -2.150 -2.570
196 2HG ARG 30 1HG ARG 30 -8.784 -3.464 -1.793
197 1HD ARG 30 2HD ARG 30 -11.347 -4.135 -3.172
198 2HD ARG 30 1HD ARG 30 -9.940 -3.785 -4.176
199 HE ARG 30 HE ARG 30 -9.285 -5.663 -2.070
200 1HH1 ARG 30 2HH1 ARG 30 -8.153 -5.937 -4.767
201 2HH1 ARG 30 1HH1 ARG 30 -9.029 -7.276 -5.431
202 1HH2 ARG 30 1HH2 ARG 30 -11.577 -7.112 -3.072
203 2HH2 ARG 30 2HH2 ARG 30 -10.974 -7.944 -4.466
204 H LEU 31 H LEU 31 -9.682 -1.297 2.374
205 HA LEU 31 HA LEU 31 -8.947 1.097 0.753
206 1HB LEU 31 2HB LEU 31 -10.225 0.822 3.482
207 2HB LEU 31 1HB LEU 31 -9.612 2.355 2.863
208 HG LEU 31 HG LEU 31 -11.539 0.695 1.243
209 1HD1 LEU 31 1HD1 LEU 31 -13.392 1.935 2.216
210 2HD1 LEU 31 2HD1 LEU 31 -12.287 2.840 3.250
211 3HD1 LEU 31 3HD1 LEU 31 -12.519 1.112 3.509
212 1HD2 LEU 31 1HD2 LEU 31 -10.909 3.663 1.385
213 2HD2 LEU 31 2HD2 LEU 31 -12.064 2.916 0.282
214 3HD2 LEU 31 3HD2 LEU 31 -10.345 2.551 0.138
215 H ARG 32 H ARG 32 -7.783 -1.162 3.116
216 HA ARG 32 HA ARG 32 -5.650 0.605 4.100
217 1HB ARG 32 2HB ARG 32 -6.911 -1.495 5.240
218 2HB ARG 32 1HB ARG 32 -5.529 -2.335 4.543
219 1HG ARG 32 2HG ARG 32 -4.348 -1.659 6.343
220 2HG ARG 32 1HG ARG 32 -4.429 -0.028 5.678
221 1HD ARG 32 2HD ARG 32 -6.684 0.205 6.834
222 2HD ARG 32 1HD ARG 32 -6.319 -1.305 7.669
223 HE ARG 32 HE ARG 32 -4.109 0.117 8.279
224 1HH1 ARG 32 2HH1 ARG 32 -6.500 -0.080 10.163
225 2HH1 ARG 32 1HH1 ARG 32 -6.784 1.589 10.526
226 1HH2 ARG 32 1HH2 ARG 32 -4.851 2.760 7.882
227 2HH2 ARG 32 2HH2 ARG 32 -5.843 3.205 9.230
228 H CYS 33 H CYS 33 -3.486 0.476 3.459
229 HA CYS 33 HA CYS 33 -2.994 -0.939 0.902
230 1HB CYS 33 2HB CYS 33 -1.754 1.362 2.339
231 2HB CYS 33 1HB CYS 33 -0.702 0.398 1.302
232 H THR 34 H THR 34 -2.287 -3.003 1.125
233 HA THR 34 HA THR 34 -0.577 -3.716 3.447
234 HB THR 34 HB THR 34 -1.959 -5.444 1.367
235 HG1 THR 34 HG1 THR 34 -3.567 -5.196 2.675
236 1HG2 THR 34 1HG2 THR 34 -1.337 -7.315 2.889
237 2HG2 THR 34 2HG2 THR 34 -0.387 -6.184 3.853
238 3HG2 THR 34 3HG2 THR 34 0.075 -6.528 2.186
239 H CYS 35 H CYS 35 1.568 -3.440 3.083
240 HA CYS 35 HA CYS 35 2.642 -3.836 0.334
241 1HB CYS 35 2HB CYS 35 4.215 -2.759 2.672
242 2HB CYS 35 1HB CYS 35 4.485 -2.496 0.950
243 H TYR 36 H TYR 36 4.654 -5.081 0.089
244 HA TYR 36 HA TYR 36 4.977 -7.174 2.202
245 1HB TYR 36 2HB TYR 36 5.761 -8.594 0.120
246 2HB TYR 36 1HB TYR 36 4.047 -8.438 0.492
247 HD1 TYR 36 HD1 TYR 36 2.555 -7.215 -0.946
248 HD2 TYR 36 HD2 TYR 36 6.786 -7.216 -1.694
249 HE1 TYR 36 HE1 TYR 36 2.160 -6.196 -3.170
250 HE2 TYR 36 HE2 TYR 36 6.391 -6.198 -3.920
251 HH TYR 36 HH TYR 36 3.164 -5.157 -4.930
252 H ARG 37 H ARG 37 7.135 -8.153 2.303
253 HA ARG 37 HA ARG 37 9.245 -6.209 2.305
254 1HB ARG 37 2HB ARG 37 9.354 -9.237 2.451
255 2HB ARG 37 1HB ARG 37 10.722 -8.172 2.774
256 1HG ARG 37 2HG ARG 37 9.876 -7.465 4.789
257 2HG ARG 37 1HG ARG 37 8.201 -7.584 4.248
258 1HD ARG 37 2HD ARG 37 8.871 -10.198 4.173
259 2HD ARG 37 1HD ARG 37 9.955 -9.663 5.456
260 HE ARG 37 HE ARG 37 8.001 -8.994 6.759
261 1HH1 ARG 37 2HH1 ARG 37 7.571 -11.808 5.293
262 2HH1 ARG 37 1HH1 ARG 37 5.864 -11.701 5.025
263 1HH2 ARG 37 1HH2 ARG 37 5.691 -8.311 5.763
264 2HH2 ARG 37 2HH2 ARG 37 4.795 -9.718 5.294
265 H CYS 38 H CYS 38 11.209 -6.233 1.027
266 HA CYS 38 HA CYS 38 10.694 -6.970 -1.802
267 1HB CYS 38 2HB CYS 38 11.569 -4.648 -0.947
268 2HB CYS 38 1HB CYS 38 13.128 -5.471 -0.878
269 H GLY 39 HN GLY 39 11.480 -8.880 -2.493
270 1HA GLY 39 2HA GLY 39 12.968 -10.655 -2.855
271 2HA GLY 39 1HA GLY 39 14.208 -9.691 -2.058
Start of MODEL 17
1 1H GLY 1 1H GLY 1 -8.320 4.872 1.412
2 2H GLY 1 2H GLY 1 -8.753 4.879 3.055
3 3H GLY 1 3H GLY 1 -7.696 3.689 2.457
4 1HA GLY 1 2HA GLY 1 -7.064 6.588 2.408
5 2HA GLY 1 1HA GLY 1 -6.603 5.526 3.739
6 H PHE 2 H PHE 2 -4.492 6.606 2.609
7 HA PHE 2 HA PHE 2 -2.469 6.178 1.508
8 1HB PHE 2 2HB PHE 2 -3.445 3.310 1.424
9 2HB PHE 2 1HB PHE 2 -1.772 3.868 1.379
10 HD1 PHE 2 HD1 PHE 2 -1.082 5.441 3.424
11 HD2 PHE 2 HD2 PHE 2 -4.326 2.627 3.470
12 HE1 PHE 2 HE1 PHE 2 -1.004 5.393 5.902
13 HE2 PHE 2 HE2 PHE 2 -4.246 2.577 5.948
14 HZ PHE 2 HZ PHE 2 -2.585 3.960 7.164
15 H GLY 3 H GLY 3 -4.996 6.699 -0.087
16 1HA GLY 3 2HA GLY 3 -5.434 6.998 -2.365
17 2HA GLY 3 1HA GLY 3 -3.855 6.298 -2.715
18 H CYS 4 H CYS 4 -6.528 4.767 -0.916
19 HA CYS 4 HA CYS 4 -6.461 2.545 -2.896
20 1HB CYS 4 2HB CYS 4 -7.220 2.760 -0.008
21 2HB CYS 4 1HB CYS 4 -7.994 1.513 -0.984
22 HA PRO 5 HA PRO 5 -7.801 0.760 -2.973
23 1HB PRO 5 2HB PRO 5 -9.196 -0.321 -5.075
24 2HB PRO 5 1HB PRO 5 -9.777 -0.336 -3.401
25 1HG PRO 5 2HG PRO 5 -10.711 1.318 -5.690
26 2HG PRO 5 1HG PRO 5 -11.578 0.845 -4.219
27 1HD PRO 5 2HD PRO 5 -10.370 3.376 -4.738
28 2HD PRO 5 1HD PRO 5 -11.047 2.818 -3.192
29 H ASN 6 H ASN 6 -7.313 3.373 -4.805
30 HA ASN 6 HA ASN 6 -6.474 2.456 -7.368
31 1HB ASN 6 2HB ASN 6 -6.746 4.884 -6.461
32 2HB ASN 6 1HB ASN 6 -5.080 4.697 -5.911
33 1HD2 ASN 6 1HD2 ASN 6 -7.137 4.843 -8.807
34 2HD2 ASN 6 2HD2 ASN 6 -5.863 5.060 -9.907
35 H ASN 7 H ASN 7 -5.079 0.757 -7.561
36 HA ASN 7 HA ASN 7 -3.059 0.062 -5.654
37 1HB ASN 7 2HB ASN 7 -3.606 -0.747 -8.502
38 2HB ASN 7 1HB ASN 7 -2.159 -1.316 -7.668
39 1HD2 ASN 7 1HD2 ASN 7 -2.416 -3.009 -6.131
40 2HD2 ASN 7 2HD2 ASN 7 -3.921 -3.662 -5.698
41 H TYR 8 H TYR 8 -2.981 2.210 -8.456
42 HA TYR 8 HA TYR 8 -0.115 2.350 -8.698
43 1HB TYR 8 2HB TYR 8 -1.484 3.176 -10.518
44 2HB TYR 8 1HB TYR 8 -2.309 4.308 -9.451
45 HD1 TYR 8 HD1 TYR 8 1.184 3.421 -10.519
46 HD2 TYR 8 HD2 TYR 8 -1.587 6.514 -9.428
47 HE1 TYR 8 HE1 TYR 8 2.912 5.136 -10.991
48 HE2 TYR 8 HE2 TYR 8 0.140 8.229 -9.898
49 HH TYR 8 HH TYR 8 2.958 8.047 -9.898
50 H GLN 9 H GLN 9 -2.459 4.529 -7.076
51 HA GLN 9 HA GLN 9 -0.438 6.122 -5.775
52 1HB GLN 9 2HB GLN 9 -3.345 5.646 -5.030
53 2HB GLN 9 1HB GLN 9 -2.317 6.897 -4.333
54 1HG GLN 9 2HG GLN 9 -2.915 6.652 -7.296
55 2HG GLN 9 1HG GLN 9 -3.780 7.725 -6.200
56 1HE2 GLN 9 1HE2 GLN 9 -1.926 8.390 -8.528
57 2HE2 GLN 9 2HE2 GLN 9 -0.743 9.406 -7.860
58 H CYS 10 H CYS 10 -2.323 3.265 -4.840
59 HA CYS 10 HA CYS 10 -1.484 3.027 -2.134
60 1HB CYS 10 2HB CYS 10 -3.271 1.658 -3.309
61 2HB CYS 10 1HB CYS 10 -1.972 0.731 -4.055
62 H HIS 11 H HIS 11 -0.039 1.790 -5.148
63 HA HIS 11 HA HIS 11 2.163 0.397 -4.000
64 1HB HIS 11 2HB HIS 11 1.597 0.136 -6.360
65 2HB HIS 11 1HB HIS 11 1.919 1.843 -6.660
66 HD1 HIS 11 HD1 HIS 11 4.070 -0.564 -4.646
67 HD2 HIS 11 HD2 HIS 11 4.257 1.665 -8.162
68 HE1 HIS 11 HE1 HIS 11 6.439 -0.789 -5.509
69 H ARG 12 H ARG 12 1.751 3.813 -4.908
70 HA ARG 12 HA ARG 12 4.429 4.671 -4.420
71 1HB ARG 12 2HB ARG 12 2.407 5.945 -5.483
72 2HB ARG 12 1HB ARG 12 2.045 6.412 -3.822
73 1HG ARG 12 2HG ARG 12 3.924 7.727 -3.632
74 2HG ARG 12 1HG ARG 12 4.866 6.726 -4.737
75 1HD ARG 12 2HD ARG 12 3.299 7.587 -6.586
76 2HD ARG 12 1HD ARG 12 2.785 8.806 -5.418
77 HE ARG 12 HE ARG 12 5.644 8.512 -6.265
78 1HH1 ARG 12 1HH2 ARG 12 5.111 10.351 -4.004
79 2HH1 ARG 12 2HH2 ARG 12 4.892 11.878 -4.793
80 1HH2 ARG 12 2HH1 ARG 12 4.380 10.472 -7.931
81 2HH2 ARG 12 1HH1 ARG 12 4.479 11.947 -7.029
82 H HIS 13 H HIS 13 1.601 4.416 -2.254
83 HA HIS 13 HA HIS 13 2.829 5.547 0.069
84 1HB HIS 13 2HB HIS 13 0.430 5.239 0.033
85 2HB HIS 13 1HB HIS 13 0.606 3.502 -0.220
86 HD1 HIS 13 HD1 HIS 13 1.725 6.076 2.378
87 HD2 HIS 13 HD2 HIS 13 0.494 2.100 2.152
88 HE1 HIS 13 HE1 HIS 13 1.682 5.202 4.756
89 H CYS 14 H CYS 14 2.728 2.204 -1.164
90 HA CYS 14 HA CYS 14 4.095 1.037 1.091
91 1HB CYS 14 2HB CYS 14 3.829 0.110 -1.783
92 2HB CYS 14 1HB CYS 14 4.516 -0.868 -0.488
93 H LYS 15 H LYS 15 5.169 2.612 -1.873
94 HA LYS 15 HA LYS 15 7.922 1.788 -1.745
95 1HB LYS 15 2HB LYS 15 6.448 4.015 -3.135
96 2HB LYS 15 1HB LYS 15 8.212 3.966 -3.158
97 1HG LYS 15 2HG LYS 15 7.917 1.492 -3.900
98 2HG LYS 15 1HG LYS 15 6.261 1.963 -4.287
99 1HD LYS 15 2HD LYS 15 8.536 3.655 -5.279
100 2HD LYS 15 1HD LYS 15 8.143 2.157 -6.122
101 1HE LYS 15 2HE LYS 15 6.359 3.114 -7.104
102 2HE LYS 15 1HE LYS 15 5.719 3.618 -5.541
103 1HZ LYS 15 1HZ LYS 15 7.062 5.575 -5.600
104 2HZ LYS 15 2HZ LYS 15 6.207 5.481 -7.065
105 3HZ LYS 15 3HZ LYS 15 7.855 5.065 -7.013
106 H SER 16 H SER 16 6.171 4.624 -0.441
107 HA SER 16 HA SER 16 8.510 5.962 0.558
108 1HB SER 16 2HB SER 16 6.820 7.050 2.166
109 2HB SER 16 1HB SER 16 6.551 7.296 0.445
110 HG SER 16 HG SER 16 5.236 5.525 2.222
111 H ILE 17 H ILE 17 6.524 3.335 1.814
112 HA ILE 17 HA ILE 17 7.612 3.406 4.505
113 HB ILE 17 HB ILE 17 6.295 1.117 3.003
114 1HG1 ILE 17 2HG1 ILE 17 4.971 2.807 5.110
115 2HG1 ILE 17 1HG1 ILE 17 5.049 3.402 3.451
116 1HG2 ILE 17 1HG2 ILE 17 5.818 0.304 5.339
117 2HG2 ILE 17 2HG2 ILE 17 6.886 1.569 5.944
118 3HG2 ILE 17 3HG2 ILE 17 7.531 0.287 4.919
119 1HD1 ILE 17 1HD1 ILE 17 3.466 1.949 2.754
120 2HD1 ILE 17 2HD1 ILE 17 3.129 1.666 4.461
121 3HD1 ILE 17 3HD1 ILE 17 4.230 0.597 3.591
122 HA PRO 18 HA PRO 18 11.510 1.619 3.344
123 1HB PRO 18 2HB PRO 18 12.515 1.492 5.901
124 2HB PRO 18 1HB PRO 18 12.458 2.978 4.937
125 1HG PRO 18 2HG PRO 18 10.745 2.167 7.238
126 2HG PRO 18 1HG PRO 18 11.163 3.790 6.667
127 1HD PRO 18 2HD PRO 18 8.715 2.450 6.201
128 2HD PRO 18 1HD PRO 18 9.276 3.917 5.372
129 H GLY 19 H GLY 19 11.813 -0.510 2.890
130 1HA GLY 19 2HA GLY 19 12.342 -2.766 3.752
131 2HA GLY 19 1HA GLY 19 11.052 -2.552 4.936
132 H ARG 20 H ARG 20 9.155 -1.379 3.071
133 HA ARG 20 HA ARG 20 8.202 -3.874 1.835
134 1HB ARG 20 2HB ARG 20 6.848 -1.191 1.578
135 2HB ARG 20 1HB ARG 20 6.119 -2.793 1.537
136 1HG ARG 20 2HG ARG 20 7.510 -1.754 4.013
137 2HG ARG 20 1HG ARG 20 5.808 -1.423 3.697
138 1HD ARG 20 2HD ARG 20 6.181 -4.193 3.226
139 2HD ARG 20 1HD ARG 20 7.013 -3.829 4.736
140 HE ARG 20 HE ARG 20 4.248 -4.118 4.575
141 1HH1 ARG 20 2HH1 ARG 20 6.432 -2.683 6.589
142 2HH1 ARG 20 1HH1 ARG 20 5.371 -1.463 7.208
143 1HH2 ARG 20 1HH2 ARG 20 2.880 -2.057 4.858
144 2HH2 ARG 20 2HH2 ARG 20 3.355 -1.104 6.224
145 H CYS 21 H CYS 21 7.955 -4.206 -0.387
146 HA CYS 21 HA CYS 21 9.467 -2.318 -2.133
147 1HB CYS 21 2HB CYS 21 9.412 -5.163 -1.936
148 2HB CYS 21 1HB CYS 21 8.730 -4.729 -3.503
149 H GLY 22 H GLY 22 6.542 -4.384 -2.249
150 1HA GLY 22 2HA GLY 22 5.189 -2.227 -3.808
151 2HA GLY 22 1HA GLY 22 5.076 -3.908 -4.333
152 H GLY 23 H GLY 23 2.684 -2.833 -3.863
153 1HA GLY 23 2HA GLY 23 1.719 -4.326 -1.552
154 2HA GLY 23 1HA GLY 23 1.585 -2.584 -1.339
155 H TYR 24 H TYR 24 -0.729 -3.850 -1.262
156 HA TYR 24 HA TYR 24 -2.067 -3.042 -3.781
157 1HB TYR 24 2HB TYR 24 -3.295 -5.131 -3.972
158 2HB TYR 24 1HB TYR 24 -1.574 -5.507 -3.938
159 HD1 TYR 24 HD1 TYR 24 -0.521 -6.393 -1.849
160 HD2 TYR 24 HD2 TYR 24 -4.764 -5.803 -2.191
161 HE1 TYR 24 HE1 TYR 24 -0.884 -7.821 0.146
162 HE2 TYR 24 HE2 TYR 24 -5.124 -7.231 -0.198
163 HH TYR 24 HH TYR 24 -3.531 -9.270 0.913
164 H CYS 25 H CYS 25 -4.455 -2.828 -3.449
165 HA CYS 25 HA CYS 25 -5.020 -1.822 -0.740
166 1HB CYS 25 2HB CYS 25 -6.554 -1.763 -3.346
167 2HB CYS 25 1HB CYS 25 -7.253 -1.198 -1.829
168 H GLY 26 H GLY 26 -5.637 -3.305 0.748
169 1HA GLY 26 2HA GLY 26 -8.005 -4.905 0.421
170 2HA GLY 26 1HA GLY 26 -6.572 -5.918 0.264
171 H GLY 27 H GLY 27 -8.681 -5.728 2.435
172 1HA GLY 27 2HA GLY 27 -7.791 -6.576 4.699
173 2HA GLY 27 1HA GLY 27 -6.898 -5.057 4.742
174 H TRP 28 H TRP 28 -8.008 -3.143 5.238
175 HA TRP 28 HA TRP 28 -10.573 -3.488 6.607
176 1HB TRP 28 2HB TRP 28 -8.739 -1.990 7.461
177 2HB TRP 28 1HB TRP 28 -9.030 -0.928 6.085
178 HD1 TRP 28 HD1 TRP 28 -10.803 -2.300 9.214
179 HE1 TRP 28 HE1 TRP 28 -12.666 -0.653 9.881
180 HE3 TRP 28 HE3 TRP 28 -10.556 0.953 5.285
181 HZ2 TRP 28 HZ2 TRP 28 -13.890 1.732 8.885
182 HZ3 TRP 28 HZ3 TRP 28 -12.079 2.903 5.172
183 HH2 TRP 28 HH2 TRP 28 -13.747 3.295 6.963
184 H HIS 29 H HIS 29 -12.051 -3.983 4.939
185 HA HIS 29 HA HIS 29 -13.588 -3.535 3.235
186 1HB HIS 29 2HB HIS 29 -12.973 -0.638 3.892
187 2HB HIS 29 1HB HIS 29 -14.432 -1.255 3.124
188 HD1 HIS 29 HD1 HIS 29 -14.261 0.274 5.950
189 HD2 HIS 29 HD2 HIS 29 -14.698 -3.833 5.392
190 HE1 HIS 29 HE1 HIS 29 -15.271 -0.636 8.088
191 H ARG 30 H ARG 30 -10.685 -3.737 2.586
192 HA ARG 30 HA ARG 30 -9.274 -3.475 0.747
193 1HB ARG 30 2HB ARG 30 -11.388 -4.286 -0.394
194 2HB ARG 30 1HB ARG 30 -11.768 -2.597 -0.732
195 1HG ARG 30 2HG ARG 30 -10.104 -2.390 -2.296
196 2HG ARG 30 1HG ARG 30 -9.028 -3.501 -1.450
197 1HD ARG 30 2HD ARG 30 -10.956 -5.242 -2.156
198 2HD ARG 30 1HD ARG 30 -11.140 -4.074 -3.466
199 HE ARG 30 HE ARG 30 -8.361 -4.870 -2.996
200 1HH1 ARG 30 1HH2 ARG 30 -10.140 -4.177 -5.537
201 2HH1 ARG 30 2HH2 ARG 30 -9.948 -5.658 -6.412
202 1HH2 ARG 30 2HH1 ARG 30 -8.634 -7.397 -3.705
203 2HH2 ARG 30 1HH1 ARG 30 -9.094 -7.487 -5.373
204 H LEU 31 H LEU 31 -9.811 -1.174 2.562
205 HA LEU 31 HA LEU 31 -9.221 1.076 0.686
206 1HB LEU 31 2HB LEU 31 -10.404 1.123 3.477
207 2HB LEU 31 1HB LEU 31 -9.987 2.561 2.547
208 HG LEU 31 HG LEU 31 -11.796 0.470 1.357
209 1HD1 LEU 31 1HD1 LEU 31 -13.735 1.574 2.287
210 2HD1 LEU 31 2HD1 LEU 31 -12.727 2.801 3.055
211 3HD1 LEU 31 3HD1 LEU 31 -12.674 1.133 3.624
212 1HD2 LEU 31 1HD2 LEU 31 -10.866 2.309 -0.044
213 2HD2 LEU 31 2HD2 LEU 31 -11.606 3.484 1.042
214 3HD2 LEU 31 3HD2 LEU 31 -12.622 2.401 0.092
215 H ARG 32 H ARG 32 -7.660 -1.051 2.700
216 HA ARG 32 HA ARG 32 -5.705 0.974 3.686
217 1HB ARG 32 2HB ARG 32 -6.792 -0.767 5.260
218 2HB ARG 32 1HB ARG 32 -5.766 -1.950 4.449
219 1HG ARG 32 2HG ARG 32 -3.859 -0.196 4.960
220 2HG ARG 32 1HG ARG 32 -4.980 0.353 6.205
221 1HD ARG 32 2HD ARG 32 -4.769 -1.568 7.440
222 2HD ARG 32 1HD ARG 32 -4.547 -2.583 6.015
223 HE ARG 32 HE ARG 32 -2.362 -0.798 7.018
224 1HH1 ARG 32 1HH2 ARG 32 -2.976 -3.801 7.840
225 2HH1 ARG 32 2HH2 ARG 32 -1.722 -4.589 6.942
226 1HH2 ARG 32 2HH1 ARG 32 -1.013 -1.808 4.981
227 2HH2 ARG 32 1HH1 ARG 32 -0.605 -3.456 5.325
228 H CYS 33 H CYS 33 -3.481 0.728 3.147
229 HA CYS 33 HA CYS 33 -3.001 -0.816 0.671
230 1HB CYS 33 2HB CYS 33 -1.613 1.428 2.088
231 2HB CYS 33 1HB CYS 33 -0.664 0.400 1.014
232 H THR 34 H THR 34 -2.551 -2.943 1.094
233 HA THR 34 HA THR 34 -0.874 -3.656 3.417
234 HB THR 34 HB THR 34 -2.291 -5.345 1.337
235 HG1 THR 34 HG1 THR 34 -2.716 -5.189 4.130
236 1HG2 THR 34 1HG2 THR 34 -1.669 -7.216 2.992
237 2HG2 THR 34 2HG2 THR 34 -0.468 -6.092 3.627
238 3HG2 THR 34 3HG2 THR 34 -0.381 -6.618 1.946
239 H CYS 35 H CYS 35 1.258 -3.321 3.097
240 HA CYS 35 HA CYS 35 2.451 -3.937 0.438
241 1HB CYS 35 2HB CYS 35 3.951 -2.592 2.667
242 2HB CYS 35 1HB CYS 35 4.162 -2.420 0.925
243 H TYR 36 H TYR 36 4.411 -5.216 0.368
244 HA TYR 36 HA TYR 36 4.762 -6.986 2.756
245 1HB TYR 36 2HB TYR 36 5.611 -8.645 0.881
246 2HB TYR 36 1HB TYR 36 3.889 -8.486 1.213
247 HD1 TYR 36 HD1 TYR 36 6.625 -7.492 -1.089
248 HD2 TYR 36 HD2 TYR 36 2.386 -7.491 -0.384
249 HE1 TYR 36 HE1 TYR 36 6.232 -6.781 -3.432
250 HE2 TYR 36 HE2 TYR 36 1.996 -6.779 -2.725
251 HH TYR 36 HH TYR 36 3.408 -7.044 -4.987
252 H ARG 37 H ARG 37 6.946 -7.907 2.995
253 HA ARG 37 HA ARG 37 9.009 -5.921 2.752
254 1HB ARG 37 2HB ARG 37 9.005 -8.847 3.493
255 2HB ARG 37 1HB ARG 37 10.512 -7.939 3.369
256 1HG ARG 37 2HG ARG 37 9.784 -6.367 5.058
257 2HG ARG 37 1HG ARG 37 8.167 -7.069 5.081
258 1HD ARG 37 2HD ARG 37 10.657 -8.650 5.769
259 2HD ARG 37 1HD ARG 37 9.688 -7.810 6.978
260 HE ARG 37 HE ARG 37 7.803 -9.331 5.707
261 1HH1 ARG 37 1HH2 ARG 37 9.991 -11.175 4.830
262 2HH1 ARG 37 2HH2 ARG 37 10.068 -12.305 6.141
263 1HH2 ARG 37 2HH1 ARG 37 8.300 -10.271 8.338
264 2HH2 ARG 37 1HH1 ARG 37 9.104 -11.791 8.136
265 H CYS 38 H CYS 38 10.951 -6.025 1.480
266 HA CYS 38 HA CYS 38 10.499 -7.155 -1.219
267 1HB CYS 38 2HB CYS 38 11.393 -4.747 -0.606
268 2HB CYS 38 1HB CYS 38 12.942 -5.580 -0.470
269 H GLY 39 HN GLY 39 11.583 -8.932 -1.967
270 1HA GLY 39 2HA GLY 39 13.448 -10.303 -0.128
271 2HA GLY 39 1HA GLY 39 12.735 -10.998 -1.584
Start of MODEL 18
1 1H GLY 1 1H GLY 1 -9.058 4.715 2.882
2 2H GLY 1 2H GLY 1 -8.023 3.662 2.039
3 3H GLY 1 3H GLY 1 -8.681 5.020 1.256
4 1HA GLY 1 2HA GLY 1 -7.333 6.514 2.379
5 2HA GLY 1 1HA GLY 1 -6.969 5.337 3.640
6 H PHE 2 H PHE 2 -4.795 6.480 2.629
7 HA PHE 2 HA PHE 2 -2.749 6.089 1.550
8 1HB PHE 2 2HB PHE 2 -3.720 3.223 1.389
9 2HB PHE 2 1HB PHE 2 -2.049 3.780 1.383
10 HD1 PHE 2 HD1 PHE 2 -1.093 4.862 3.450
11 HD2 PHE 2 HD2 PHE 2 -4.930 2.930 3.429
12 HE1 PHE 2 HE1 PHE 2 -1.047 4.742 5.926
13 HE2 PHE 2 HE2 PHE 2 -4.884 2.811 5.906
14 HZ PHE 2 HZ PHE 2 -2.943 3.717 7.154
15 H GLY 3 H GLY 3 -5.244 6.631 -0.102
16 1HA GLY 3 2HA GLY 3 -5.639 6.944 -2.389
17 2HA GLY 3 1HA GLY 3 -4.041 6.271 -2.708
18 H CYS 4 H CYS 4 -6.845 4.789 -1.055
19 HA CYS 4 HA CYS 4 -6.646 2.516 -2.976
20 1HB CYS 4 2HB CYS 4 -7.542 2.759 -0.120
21 2HB CYS 4 1HB CYS 4 -8.177 1.448 -1.113
22 HA PRO 5 HA PRO 5 -7.957 0.704 -3.047
23 1HB PRO 5 2HB PRO 5 -9.310 -0.447 -5.138
24 2HB PRO 5 1HB PRO 5 -9.914 -0.425 -3.473
25 1HG PRO 5 2HG PRO 5 -10.837 1.153 -5.819
26 2HG PRO 5 1HG PRO 5 -11.717 0.715 -4.347
27 1HD PRO 5 2HD PRO 5 -10.525 3.240 -4.927
28 2HD PRO 5 1HD PRO 5 -11.226 2.725 -3.378
29 H ASN 6 H ASN 6 -7.334 3.256 -4.829
30 HA ASN 6 HA ASN 6 -6.558 2.425 -7.429
31 1HB ASN 6 2HB ASN 6 -6.614 4.804 -6.422
32 2HB ASN 6 1HB ASN 6 -5.002 4.443 -5.810
33 1HD2 ASN 6 1HD2 ASN 6 -6.822 5.278 -8.673
34 2HD2 ASN 6 2HD2 ASN 6 -5.508 5.287 -9.745
35 H ASN 7 H ASN 7 -4.844 1.257 -8.184
36 HA ASN 7 HA ASN 7 -3.132 -0.159 -6.290
37 1HB ASN 7 2HB ASN 7 -3.421 -0.144 -9.293
38 2HB ASN 7 1HB ASN 7 -2.064 -0.971 -8.528
39 1HD2 ASN 7 1HD2 ASN 7 -2.686 -2.662 -6.821
40 2HD2 ASN 7 2HD2 ASN 7 -4.139 -3.511 -7.042
41 H TYR 8 H TYR 8 -2.639 2.388 -8.744
42 HA TYR 8 HA TYR 8 0.202 2.566 -8.467
43 1HB TYR 8 2HB TYR 8 -1.363 3.615 -10.265
44 2HB TYR 8 1HB TYR 8 -1.543 4.940 -9.115
45 HD1 TYR 8 HD1 TYR 8 0.283 6.446 -8.628
46 HD2 TYR 8 HD2 TYR 8 0.854 3.075 -11.229
47 HE1 TYR 8 HE1 TYR 8 2.466 7.375 -9.353
48 HE2 TYR 8 HE2 TYR 8 3.036 4.004 -11.954
49 HH TYR 8 HH TYR 8 4.741 6.109 -10.401
50 H GLN 9 H GLN 9 -2.403 4.521 -6.964
51 HA GLN 9 HA GLN 9 -0.665 6.091 -5.319
52 1HB GLN 9 2HB GLN 9 -3.577 5.322 -4.980
53 2HB GLN 9 1HB GLN 9 -2.746 6.488 -3.950
54 1HG GLN 9 2HG GLN 9 -2.664 6.801 -6.942
55 2HG GLN 9 1HG GLN 9 -4.067 7.363 -6.033
56 1HE2 GLN 9 1HE2 GLN 9 -3.721 9.110 -4.446
57 2HE2 GLN 9 2HE2 GLN 9 -2.333 10.084 -4.518
58 H CYS 10 H CYS 10 -2.369 3.018 -4.701
59 HA CYS 10 HA CYS 10 -1.563 2.752 -1.963
60 1HB CYS 10 2HB CYS 10 -3.321 1.379 -3.266
61 2HB CYS 10 1HB CYS 10 -1.959 0.419 -3.841
62 H HIS 11 H HIS 11 -0.093 1.694 -5.019
63 HA HIS 11 HA HIS 11 2.141 0.319 -3.846
64 1HB HIS 11 2HB HIS 11 1.463 -0.011 -6.200
65 2HB HIS 11 1HB HIS 11 1.886 1.663 -6.558
66 HD1 HIS 11 HD1 HIS 11 3.877 -0.840 -4.494
67 HD2 HIS 11 HD2 HIS 11 4.221 1.340 -8.029
68 HE1 HIS 11 HE1 HIS 11 6.229 -1.229 -5.349
69 H ARG 12 H ARG 12 1.598 3.678 -4.864
70 HA ARG 12 HA ARG 12 4.259 4.645 -4.535
71 1HB ARG 12 2HB ARG 12 2.177 5.821 -5.554
72 2HB ARG 12 1HB ARG 12 1.814 6.295 -3.894
73 1HG ARG 12 2HG ARG 12 3.982 7.395 -3.691
74 2HG ARG 12 1HG ARG 12 4.447 6.839 -5.300
75 1HD ARG 12 2HD ARG 12 3.055 8.344 -6.374
76 2HD ARG 12 1HD ARG 12 1.906 8.395 -5.037
77 HE ARG 12 HE ARG 12 3.173 10.147 -4.082
78 1HH1 ARG 12 2HH1 ARG 12 5.827 8.782 -4.066
79 2HH1 ARG 12 1HH1 ARG 12 6.756 9.760 -5.153
80 1HH2 ARG 12 1HH2 ARG 12 3.975 11.292 -6.567
81 2HH2 ARG 12 2HH2 ARG 12 5.703 11.186 -6.574
82 H HIS 13 H HIS 13 1.562 4.347 -2.217
83 HA HIS 13 HA HIS 13 2.858 5.607 0.001
84 1HB HIS 13 2HB HIS 13 0.455 5.175 0.032
85 2HB HIS 13 1HB HIS 13 0.734 3.437 -0.068
86 HD1 HIS 13 HD1 HIS 13 1.915 6.262 2.233
87 HD2 HIS 13 HD2 HIS 13 0.625 2.304 2.432
88 HE1 HIS 13 HE1 HIS 13 1.928 5.627 4.685
89 H CYS 14 H CYS 14 2.722 2.182 -1.017
90 HA CYS 14 HA CYS 14 4.269 1.133 1.148
91 1HB CYS 14 2HB CYS 14 3.922 0.147 -1.698
92 2HB CYS 14 1HB CYS 14 4.718 -0.778 -0.426
93 H LYS 15 H LYS 15 5.178 2.685 -1.887
94 HA LYS 15 HA LYS 15 7.953 1.974 -1.899
95 1HB LYS 15 2HB LYS 15 6.295 4.125 -3.168
96 2HB LYS 15 1HB LYS 15 8.049 4.298 -3.188
97 1HG LYS 15 2HG LYS 15 7.818 1.701 -3.953
98 2HG LYS 15 1HG LYS 15 6.323 2.358 -4.621
99 1HD LYS 15 2HD LYS 15 7.918 4.294 -5.460
100 2HD LYS 15 1HD LYS 15 9.164 3.057 -5.282
101 1HE LYS 15 2HE LYS 15 7.667 1.526 -6.663
102 2HE LYS 15 1HE LYS 15 6.684 2.948 -7.017
103 1HZ LYS 15 1HZ LYS 15 9.575 2.614 -7.618
104 2HZ LYS 15 2HZ LYS 15 8.681 4.034 -7.897
105 3HZ LYS 15 3HZ LYS 15 8.308 2.609 -8.746
106 H SER 16 H SER 16 6.269 4.885 -0.642
107 HA SER 16 HA SER 16 8.583 6.192 0.377
108 1HB SER 16 2HB SER 16 6.763 7.111 2.101
109 2HB SER 16 1HB SER 16 6.784 7.631 0.421
110 HG SER 16 HG SER 16 5.248 5.471 1.465
111 H ILE 17 H ILE 17 6.737 3.490 1.655
112 HA ILE 17 HA ILE 17 7.910 3.696 4.332
113 HB ILE 17 HB ILE 17 6.424 1.372 3.066
114 1HG1 ILE 17 2HG1 ILE 17 5.177 3.256 5.033
115 2HG1 ILE 17 1HG1 ILE 17 5.325 3.792 3.360
116 1HG2 ILE 17 1HG2 ILE 17 6.021 0.718 5.411
117 2HG2 ILE 17 2HG2 ILE 17 6.964 2.101 5.964
118 3HG2 ILE 17 3HG2 ILE 17 7.750 0.797 5.075
119 1HD1 ILE 17 1HD1 ILE 17 3.381 2.672 3.034
120 2HD1 ILE 17 2HD1 ILE 17 3.564 1.740 4.520
121 3HD1 ILE 17 3HD1 ILE 17 4.390 1.226 3.048
122 HA PRO 18 HA PRO 18 11.626 1.617 3.045
123 1HB PRO 18 2HB PRO 18 12.796 1.635 5.535
124 2HB PRO 18 1HB PRO 18 12.754 3.041 4.459
125 1HG PRO 18 2HG PRO 18 11.161 2.518 6.923
126 2HG PRO 18 1HG PRO 18 11.625 4.064 6.194
127 1HD PRO 18 2HD PRO 18 9.082 2.835 5.997
128 2HD PRO 18 1HD PRO 18 9.662 4.199 5.017
129 H GLY 19 H GLY 19 12.119 -0.554 2.939
130 1HA GLY 19 2HA GLY 19 12.461 -2.741 3.969
131 2HA GLY 19 1HA GLY 19 11.189 -2.356 5.126
132 H ARG 20 H ARG 20 9.602 -1.214 2.714
133 HA ARG 20 HA ARG 20 8.555 -3.859 1.803
134 1HB ARG 20 2HB ARG 20 6.960 -1.353 1.457
135 2HB ARG 20 1HB ARG 20 6.410 -2.989 1.806
136 1HG ARG 20 2HG ARG 20 7.919 -1.292 3.814
137 2HG ARG 20 1HG ARG 20 6.160 -1.341 3.722
138 1HD ARG 20 2HD ARG 20 6.065 -3.605 4.359
139 2HD ARG 20 1HD ARG 20 7.755 -3.890 3.944
140 HE ARG 20 HE ARG 20 6.878 -2.302 6.328
141 1HH1 ARG 20 1HH2 ARG 20 8.076 -5.263 5.900
142 2HH1 ARG 20 2HH2 ARG 20 9.618 -5.015 6.651
143 1HH2 ARG 20 2HH1 ARG 20 9.315 -1.555 6.739
144 2HH2 ARG 20 1HH1 ARG 20 10.319 -2.911 7.127
145 H CYS 21 H CYS 21 8.235 -4.202 -0.427
146 HA CYS 21 HA CYS 21 9.634 -2.260 -2.195
147 1HB CYS 21 2HB CYS 21 9.501 -5.119 -2.099
148 2HB CYS 21 1HB CYS 21 8.818 -4.585 -3.635
149 H GLY 22 H GLY 22 6.620 -4.202 -2.164
150 1HA GLY 22 2HA GLY 22 5.280 -1.970 -3.601
151 2HA GLY 22 1HA GLY 22 5.141 -3.602 -4.248
152 H GLY 23 H GLY 23 2.756 -2.727 -3.746
153 1HA GLY 23 2HA GLY 23 1.835 -4.284 -1.468
154 2HA GLY 23 1HA GLY 23 1.645 -2.553 -1.207
155 H TYR 24 H TYR 24 -0.673 -3.564 -1.124
156 HA TYR 24 HA TYR 24 -1.992 -2.863 -3.660
157 1HB TYR 24 2HB TYR 24 -3.197 -4.960 -3.884
158 2HB TYR 24 1HB TYR 24 -1.473 -5.323 -3.836
159 HD1 TYR 24 HD1 TYR 24 -0.432 -6.184 -1.718
160 HD2 TYR 24 HD2 TYR 24 -4.679 -5.697 -2.148
161 HE1 TYR 24 HE1 TYR 24 -0.800 -7.632 0.259
162 HE2 TYR 24 HE2 TYR 24 -5.045 -7.147 -0.172
163 HH TYR 24 HH TYR 24 -3.380 -9.167 0.960
164 H CYS 25 H CYS 25 -4.397 -2.747 -3.349
165 HA CYS 25 HA CYS 25 -5.020 -1.727 -0.656
166 1HB CYS 25 2HB CYS 25 -6.532 -1.760 -3.276
167 2HB CYS 25 1HB CYS 25 -7.263 -1.199 -1.771
168 H GLY 26 H GLY 26 -5.626 -3.201 0.847
169 1HA GLY 26 2HA GLY 26 -7.930 -4.876 0.525
170 2HA GLY 26 1HA GLY 26 -6.474 -5.855 0.351
171 H GLY 27 H GLY 27 -8.561 -5.740 2.527
172 1HA GLY 27 2HA GLY 27 -7.597 -6.565 4.786
173 2HA GLY 27 1HA GLY 27 -6.821 -4.982 4.837
174 H TRP 28 H TRP 28 -8.257 -3.079 4.834
175 HA TRP 28 HA TRP 28 -10.785 -3.656 6.294
176 1HB TRP 28 2HB TRP 28 -9.070 -2.137 7.340
177 2HB TRP 28 1HB TRP 28 -9.327 -1.011 6.010
178 HD1 TRP 28 HD1 TRP 28 -11.219 -2.635 8.942
179 HE1 TRP 28 HE1 TRP 28 -13.190 -1.106 9.586
180 HE3 TRP 28 HE3 TRP 28 -10.883 0.855 5.228
181 HZ2 TRP 28 HZ2 TRP 28 -14.455 1.282 8.655
182 HZ3 TRP 28 HZ3 TRP 28 -12.481 2.746 5.134
183 HH2 TRP 28 HH2 TRP 28 -14.267 2.962 6.839
184 H HIS 29 H HIS 29 -12.134 -4.113 4.514
185 HA HIS 29 HA HIS 29 -13.588 -3.628 2.752
186 1HB HIS 29 2HB HIS 29 -13.123 -0.755 3.609
187 2HB HIS 29 1HB HIS 29 -14.503 -1.368 2.702
188 HD1 HIS 29 HD1 HIS 29 -14.571 -0.024 5.632
189 HD2 HIS 29 HD2 HIS 29 -14.838 -4.092 4.773
190 HE1 HIS 29 HE1 HIS 29 -15.689 -1.106 7.632
191 H ARG 30 H ARG 30 -10.670 -3.728 2.221
192 HA ARG 30 HA ARG 30 -9.197 -3.341 0.443
193 1HB ARG 30 2HB ARG 30 -11.367 -4.014 -0.780
194 2HB ARG 30 1HB ARG 30 -11.575 -2.293 -1.096
195 1HG ARG 30 2HG ARG 30 -9.468 -2.187 -2.282
196 2HG ARG 30 1HG ARG 30 -9.068 -3.839 -1.813
197 1HD ARG 30 2HD ARG 30 -11.524 -3.154 -3.443
198 2HD ARG 30 1HD ARG 30 -9.973 -3.555 -4.180
199 HE ARG 30 HE ARG 30 -10.207 -5.746 -2.770
200 1HH1 ARG 30 1HH2 ARG 30 -12.980 -4.944 -1.829
201 2HH1 ARG 30 2HH2 ARG 30 -13.986 -5.808 -2.945
202 1HH2 ARG 30 2HH1 ARG 30 -11.408 -6.412 -5.200
203 2HH2 ARG 30 1HH1 ARG 30 -13.091 -6.643 -4.863
204 H LEU 31 H LEU 31 -9.890 -1.148 2.397
205 HA LEU 31 HA LEU 31 -9.251 1.219 0.698
206 1HB LEU 31 2HB LEU 31 -10.608 0.978 3.387
207 2HB LEU 31 1HB LEU 31 -10.020 2.518 2.760
208 HG LEU 31 HG LEU 31 -11.915 0.715 1.229
209 1HD1 LEU 31 1HD1 LEU 31 -13.706 2.215 1.933
210 2HD1 LEU 31 2HD1 LEU 31 -12.566 3.182 2.867
211 3HD1 LEU 31 3HD1 LEU 31 -12.928 1.528 3.358
212 1HD2 LEU 31 1HD2 LEU 31 -10.930 3.561 0.895
213 2HD2 LEU 31 2HD2 LEU 31 -12.336 2.932 0.038
214 3HD2 LEU 31 3HD2 LEU 31 -10.747 2.218 -0.233
215 H ARG 32 H ARG 32 -7.803 -0.988 2.812
216 HA ARG 32 HA ARG 32 -5.841 1.012 3.821
217 1HB ARG 32 2HB ARG 32 -7.009 -0.861 5.277
218 2HB ARG 32 1HB ARG 32 -5.774 -1.898 4.562
219 1HG ARG 32 2HG ARG 32 -4.394 0.419 5.334
220 2HG ARG 32 1HG ARG 32 -5.506 0.099 6.663
221 1HD ARG 32 2HD ARG 32 -4.590 -2.422 6.151
222 2HD ARG 32 1HD ARG 32 -3.167 -1.462 5.745
223 HE ARG 32 HE ARG 32 -4.502 -0.987 8.364
224 1HH1 ARG 32 1HH2 ARG 32 -2.784 -3.542 8.000
225 2HH1 ARG 32 2HH2 ARG 32 -1.276 -2.998 8.655
226 1HH2 ARG 32 2HH1 ARG 32 -2.143 0.368 8.545
227 2HH2 ARG 32 1HH1 ARG 32 -0.911 -0.776 8.962
228 H CYS 33 H CYS 33 -3.593 0.728 3.354
229 HA CYS 33 HA CYS 33 -3.085 -0.817 0.875
230 1HB CYS 33 2HB CYS 33 -1.776 1.499 2.231
231 2HB CYS 33 1HB CYS 33 -0.767 0.453 1.233
232 H THR 34 H THR 34 -2.321 -2.841 1.110
233 HA THR 34 HA THR 34 -0.735 -3.514 3.539
234 HB THR 34 HB THR 34 -2.159 -5.269 1.514
235 HG1 THR 34 HG1 THR 34 -3.732 -4.909 2.843
236 1HG2 THR 34 1HG2 THR 34 -0.601 -6.031 4.002
237 2HG2 THR 34 2HG2 THR 34 -0.106 -6.355 2.341
238 3HG2 THR 34 3HG2 THR 34 -1.539 -7.140 3.003
239 H CYS 35 H CYS 35 1.419 -3.301 3.207
240 HA CYS 35 HA CYS 35 2.540 -3.789 0.496
241 1HB CYS 35 2HB CYS 35 4.087 -2.718 2.852
242 2HB CYS 35 1HB CYS 35 4.405 -2.490 1.135
243 H TYR 36 H TYR 36 4.542 -5.068 0.314
244 HA TYR 36 HA TYR 36 4.793 -7.130 2.467
245 1HB TYR 36 2HB TYR 36 5.568 -8.611 0.422
246 2HB TYR 36 1HB TYR 36 3.855 -8.419 0.777
247 HD1 TYR 36 HD1 TYR 36 6.633 -7.241 -1.398
248 HD2 TYR 36 HD2 TYR 36 2.389 -7.264 -0.724
249 HE1 TYR 36 HE1 TYR 36 6.267 -6.282 -3.656
250 HE2 TYR 36 HE2 TYR 36 2.025 -6.305 -2.979
251 HH TYR 36 HH TYR 36 3.252 -5.012 -4.651
252 H ARG 37 H ARG 37 6.945 -8.187 2.539
253 HA ARG 37 HA ARG 37 9.086 -6.257 2.526
254 1HB ARG 37 2HB ARG 37 9.074 -9.272 2.825
255 2HB ARG 37 1HB ARG 37 10.524 -8.285 3.004
256 1HG ARG 37 2HG ARG 37 9.750 -7.261 4.953
257 2HG ARG 37 1HG ARG 37 8.058 -7.582 4.570
258 1HD ARG 37 2HD ARG 37 8.553 -10.044 4.868
259 2HD ARG 37 1HD ARG 37 10.142 -9.585 5.481
260 HE ARG 37 HE ARG 37 8.958 -8.395 7.334
261 1HH1 ARG 37 1HH2 ARG 37 6.215 -8.257 6.259
262 2HH1 ARG 37 2HH2 ARG 37 5.421 -9.585 7.038
263 1HH2 ARG 37 2HH1 ARG 37 8.382 -11.152 7.969
264 2HH2 ARG 37 1HH1 ARG 37 6.653 -11.230 8.011
265 H CYS 38 H CYS 38 11.075 -6.398 1.268
266 HA CYS 38 HA CYS 38 10.544 -7.225 -1.537
267 1HB CYS 38 2HB CYS 38 11.437 -4.873 -0.779
268 2HB CYS 38 1HB CYS 38 12.989 -5.705 -0.676
269 H GLY 39 HN GLY 39 11.440 -9.068 -2.291
270 1HA GLY 39 2HA GLY 39 13.492 -10.453 -0.670
271 2HA GLY 39 1HA GLY 39 12.598 -11.151 -2.021
Start of MODEL 19
1 1H GLY 1 1H GLY 1 -7.566 3.407 2.125
2 2H GLY 1 2H GLY 1 -8.330 4.738 1.396
3 3H GLY 1 3H GLY 1 -8.626 4.376 3.029
4 1HA GLY 1 2HA GLY 1 -7.053 6.291 2.552
5 2HA GLY 1 1HA GLY 1 -6.518 5.075 3.710
6 H PHE 2 H PHE 2 -4.605 6.579 2.475
7 HA PHE 2 HA PHE 2 -2.624 6.440 1.231
8 1HB PHE 2 2HB PHE 2 -3.177 3.460 1.211
9 2HB PHE 2 1HB PHE 2 -1.611 4.253 1.052
10 HD1 PHE 2 HD1 PHE 2 -1.014 5.927 3.047
11 HD2 PHE 2 HD2 PHE 2 -3.810 2.675 3.310
12 HE1 PHE 2 HE1 PHE 2 -0.763 5.909 5.514
13 HE2 PHE 2 HE2 PHE 2 -3.558 2.658 5.777
14 HZ PHE 2 HZ PHE 2 -2.035 4.274 6.878
15 H GLY 3 H GLY 3 -5.212 6.711 -0.219
16 1HA GLY 3 2HA GLY 3 -5.816 6.926 -2.470
17 2HA GLY 3 1HA GLY 3 -4.212 6.344 -2.904
18 H CYS 4 H CYS 4 -6.837 4.770 -1.038
19 HA CYS 4 HA CYS 4 -6.599 2.439 -2.883
20 1HB CYS 4 2HB CYS 4 -7.451 2.746 -0.018
21 2HB CYS 4 1HB CYS 4 -8.028 1.368 -0.953
22 HA PRO 5 HA PRO 5 -7.867 0.573 -2.830
23 1HB PRO 5 2HB PRO 5 -9.227 -0.706 -4.840
24 2HB PRO 5 1HB PRO 5 -9.798 -0.630 -3.166
25 1HG PRO 5 2HG PRO 5 -10.814 0.819 -5.555
26 2HG PRO 5 1HG PRO 5 -11.651 0.419 -4.048
27 1HD PRO 5 2HD PRO 5 -10.545 2.951 -4.758
28 2HD PRO 5 1HD PRO 5 -11.198 2.482 -3.174
29 H ASN 6 H ASN 6 -7.353 3.063 -4.734
30 HA ASN 6 HA ASN 6 -6.603 2.136 -7.308
31 1HB ASN 6 2HB ASN 6 -6.695 4.559 -6.398
32 2HB ASN 6 1HB ASN 6 -5.055 4.258 -5.822
33 1HD2 ASN 6 1HD2 ASN 6 -7.027 4.706 -8.721
34 2HD2 ASN 6 2HD2 ASN 6 -5.725 4.787 -9.808
35 H ASN 7 H ASN 7 -4.858 1.006 -8.054
36 HA ASN 7 HA ASN 7 -3.105 -0.319 -6.135
37 1HB ASN 7 2HB ASN 7 -3.349 -0.369 -9.146
38 2HB ASN 7 1HB ASN 7 -2.041 -1.209 -8.314
39 1HD2 ASN 7 1HD2 ASN 7 -2.668 -2.963 -6.780
40 2HD2 ASN 7 2HD2 ASN 7 -4.171 -3.731 -6.948
41 H TYR 8 H TYR 8 -2.669 2.173 -8.657
42 HA TYR 8 HA TYR 8 0.167 2.414 -8.398
43 1HB TYR 8 2HB TYR 8 -0.836 3.406 -10.322
44 2HB TYR 8 1HB TYR 8 -1.986 4.317 -9.348
45 HD1 TYR 8 HD1 TYR 8 -1.533 6.556 -8.882
46 HD2 TYR 8 HD2 TYR 8 1.721 3.903 -9.791
47 HE1 TYR 8 HE1 TYR 8 0.048 8.464 -8.793
48 HE2 TYR 8 HE2 TYR 8 3.302 5.812 -9.701
49 HH TYR 8 HH TYR 8 2.723 8.694 -10.076
50 H GLN 9 H GLN 9 -2.454 4.367 -6.920
51 HA GLN 9 HA GLN 9 -0.732 5.987 -5.317
52 1HB GLN 9 2HB GLN 9 -3.613 5.173 -4.830
53 2HB GLN 9 1HB GLN 9 -2.773 6.478 -3.994
54 1HG GLN 9 2HG GLN 9 -2.930 6.414 -7.007
55 2HG GLN 9 1HG GLN 9 -4.234 7.106 -6.043
56 1HE2 GLN 9 1HE2 GLN 9 -3.684 9.000 -4.660
57 2HE2 GLN 9 2HE2 GLN 9 -2.330 9.954 -5.030
58 H CYS 10 H CYS 10 -2.415 2.920 -4.590
59 HA CYS 10 HA CYS 10 -1.567 2.730 -1.860
60 1HB CYS 10 2HB CYS 10 -3.355 1.326 -2.992
61 2HB CYS 10 1HB CYS 10 -2.051 0.403 -3.737
62 H HIS 11 H HIS 11 -0.142 1.542 -4.902
63 HA HIS 11 HA HIS 11 2.091 0.193 -3.714
64 1HB HIS 11 2HB HIS 11 1.183 0.152 -6.178
65 2HB HIS 11 1HB HIS 11 2.260 1.530 -6.406
66 HD1 HIS 11 HD1 HIS 11 2.236 -2.108 -6.355
67 HD2 HIS 11 HD2 HIS 11 5.067 0.859 -5.616
68 HE1 HIS 11 HE1 HIS 11 4.503 -3.236 -6.465
69 H ARG 12 H ARG 12 1.635 3.527 -4.881
70 HA ARG 12 HA ARG 12 4.299 4.460 -4.534
71 1HB ARG 12 2HB ARG 12 2.217 5.634 -5.583
72 2HB ARG 12 1HB ARG 12 1.901 6.185 -3.938
73 1HG ARG 12 2HG ARG 12 4.644 6.642 -4.344
74 2HG ARG 12 1HG ARG 12 3.867 7.147 -5.845
75 1HD ARG 12 2HD ARG 12 3.286 9.061 -4.809
76 2HD ARG 12 1HD ARG 12 2.197 8.111 -3.800
77 HE ARG 12 HE ARG 12 3.803 8.205 -2.037
78 1HH1 ARG 12 1HH2 ARG 12 4.272 10.986 -3.108
79 2HH1 ARG 12 2HH2 ARG 12 5.997 11.022 -3.256
80 1HH2 ARG 12 2HH1 ARG 12 6.351 7.571 -3.049
81 2HH2 ARG 12 1HH1 ARG 12 7.180 9.083 -3.222
82 H HIS 13 H HIS 13 1.627 4.136 -2.210
83 HA HIS 13 HA HIS 13 2.937 5.492 -0.031
84 1HB HIS 13 2HB HIS 13 0.538 5.168 0.060
85 2HB HIS 13 1HB HIS 13 0.720 3.421 -0.087
86 HD1 HIS 13 HD1 HIS 13 2.100 6.104 2.268
87 HD2 HIS 13 HD2 HIS 13 0.541 2.241 2.393
88 HE1 HIS 13 HE1 HIS 13 2.105 5.408 4.703
89 H CYS 14 H CYS 14 2.719 2.054 -0.976
90 HA CYS 14 HA CYS 14 4.271 1.074 1.245
91 1HB CYS 14 2HB CYS 14 3.698 -0.089 -1.492
92 2HB CYS 14 1HB CYS 14 4.552 -0.964 -0.222
93 H LYS 15 H LYS 15 5.100 2.348 -1.937
94 HA LYS 15 HA LYS 15 7.833 1.485 -2.006
95 1HB LYS 15 2HB LYS 15 6.326 3.733 -3.344
96 2HB LYS 15 1HB LYS 15 8.063 3.530 -3.577
97 1HG LYS 15 2HG LYS 15 6.083 1.284 -4.022
98 2HG LYS 15 1HG LYS 15 6.579 2.384 -5.308
99 1HD LYS 15 2HD LYS 15 9.013 1.718 -4.398
100 2HD LYS 15 1HD LYS 15 8.146 0.260 -3.918
101 1HE LYS 15 2HE LYS 15 8.453 -0.453 -6.044
102 2HE LYS 15 1HE LYS 15 7.221 0.725 -6.496
103 1HZ LYS 15 1HZ LYS 15 9.061 2.386 -6.657
104 2HZ LYS 15 2HZ LYS 15 9.120 1.147 -7.820
105 3HZ LYS 15 3HZ LYS 15 10.164 1.107 -6.478
106 H SER 16 H SER 16 6.291 4.454 -0.726
107 HA SER 16 HA SER 16 8.742 5.770 -0.025
108 1HB SER 16 2HB SER 16 7.332 7.148 1.484
109 2HB SER 16 1HB SER 16 6.634 7.008 -0.124
110 HG SER 16 HG SER 16 5.821 5.890 2.310
111 H ILE 17 H ILE 17 6.870 3.243 1.545
112 HA ILE 17 HA ILE 17 8.210 3.488 4.124
113 HB ILE 17 HB ILE 17 6.684 1.126 2.975
114 1HG1 ILE 17 2HG1 ILE 17 5.576 3.123 4.938
115 2HG1 ILE 17 1HG1 ILE 17 5.523 3.472 3.211
116 1HG2 ILE 17 1HG2 ILE 17 7.484 1.898 5.799
117 2HG2 ILE 17 2HG2 ILE 17 8.037 0.490 4.892
118 3HG2 ILE 17 3HG2 ILE 17 6.355 0.599 5.411
119 1HD1 ILE 17 1HD1 ILE 17 4.669 0.768 3.599
120 2HD1 ILE 17 2HD1 ILE 17 3.734 2.132 2.982
121 3HD1 ILE 17 3HD1 ILE 17 3.771 1.798 4.714
122 HA PRO 18 HA PRO 18 11.878 1.406 2.733
123 1HB PRO 18 2HB PRO 18 13.114 1.363 5.190
124 2HB PRO 18 1HB PRO 18 13.049 2.792 4.143
125 1HG PRO 18 2HG PRO 18 11.516 2.221 6.636
126 2HG PRO 18 1HG PRO 18 11.973 3.781 5.933
127 1HD PRO 18 2HD PRO 18 9.417 2.581 5.772
128 2HD PRO 18 1HD PRO 18 9.986 3.953 4.799
129 H GLY 19 H GLY 19 12.335 -0.755 2.537
130 1HA GLY 19 2HA GLY 19 12.720 -2.971 3.481
131 2HA GLY 19 1HA GLY 19 11.505 -2.619 4.708
132 H ARG 20 H ARG 20 9.764 -1.416 2.472
133 HA ARG 20 HA ARG 20 8.653 -4.028 1.569
134 1HB ARG 20 2HB ARG 20 7.062 -1.567 1.123
135 2HB ARG 20 1HB ARG 20 6.551 -3.140 1.727
136 1HG ARG 20 2HG ARG 20 8.119 -1.111 3.353
137 2HG ARG 20 1HG ARG 20 6.373 -1.326 3.441
138 1HD ARG 20 2HD ARG 20 6.569 -3.501 4.357
139 2HD ARG 20 1HD ARG 20 8.260 -3.642 3.879
140 HE ARG 20 HE ARG 20 8.838 -2.084 5.683
141 1HH1 ARG 20 2HH1 ARG 20 5.617 -1.486 5.441
142 2HH1 ARG 20 1HH1 ARG 20 5.221 -1.763 7.104
143 1HH2 ARG 20 1HH2 ARG 20 8.309 -3.141 7.891
144 2HH2 ARG 20 2HH2 ARG 20 6.747 -2.700 8.494
145 H CYS 21 H CYS 21 8.379 -4.458 -0.623
146 HA CYS 21 HA CYS 21 9.764 -2.603 -2.479
147 1HB CYS 21 2HB CYS 21 9.555 -5.425 -2.301
148 2HB CYS 21 1HB CYS 21 8.733 -4.952 -3.788
149 H GLY 22 H GLY 22 6.567 -4.094 -2.003
150 1HA GLY 22 2HA GLY 22 5.364 -1.918 -3.590
151 2HA GLY 22 1HA GLY 22 5.109 -3.549 -4.207
152 H GLY 23 H GLY 23 2.785 -2.662 -3.716
153 1HA GLY 23 2HA GLY 23 1.832 -4.059 -1.364
154 2HA GLY 23 1HA GLY 23 1.735 -2.315 -1.152
155 H TYR 24 H TYR 24 -0.593 -3.627 -1.054
156 HA TYR 24 HA TYR 24 -1.996 -2.696 -3.486
157 1HB TYR 24 2HB TYR 24 -3.176 -4.803 -3.816
158 2HB TYR 24 1HB TYR 24 -1.441 -5.109 -3.882
159 HD1 TYR 24 HD1 TYR 24 -4.544 -5.731 -2.074
160 HD2 TYR 24 HD2 TYR 24 -0.268 -6.104 -1.898
161 HE1 TYR 24 HE1 TYR 24 -4.762 -7.356 -0.215
162 HE2 TYR 24 HE2 TYR 24 -0.486 -7.728 -0.039
163 HH TYR 24 HH TYR 24 -2.679 -8.073 1.855
164 H CYS 25 H CYS 25 -4.428 -2.761 -3.115
165 HA CYS 25 HA CYS 25 -5.000 -1.955 -0.321
166 1HB CYS 25 2HB CYS 25 -6.709 -1.803 -2.825
167 2HB CYS 25 1HB CYS 25 -7.157 -1.155 -1.249
168 H GLY 26 H GLY 26 -5.900 -3.397 1.079
169 1HA GLY 26 2HA GLY 26 -8.076 -5.135 0.423
170 2HA GLY 26 1HA GLY 26 -6.582 -6.067 0.390
171 H GLY 27 H GLY 27 -9.029 -5.773 2.319
172 1HA GLY 27 2HA GLY 27 -8.419 -6.799 4.631
173 2HA GLY 27 1HA GLY 27 -7.496 -5.311 4.840
174 H TRP 28 H TRP 28 -8.633 -3.328 5.091
175 HA TRP 28 HA TRP 28 -11.368 -3.655 6.156
176 1HB TRP 28 2HB TRP 28 -9.626 -2.311 7.368
177 2HB TRP 28 1HB TRP 28 -9.644 -1.163 6.032
178 HD1 TRP 28 HD1 TRP 28 -11.987 -2.615 8.726
179 HE1 TRP 28 HE1 TRP 28 -13.827 -0.880 9.218
180 HE3 TRP 28 HE3 TRP 28 -10.874 0.887 5.179
181 HZ2 TRP 28 HZ2 TRP 28 -14.709 1.658 8.242
182 HZ3 TRP 28 HZ3 TRP 28 -12.226 2.951 4.987
183 HH2 TRP 28 HH2 TRP 28 -14.143 3.341 6.509
184 H HIS 29 H HIS 29 -12.656 -3.932 4.311
185 HA HIS 29 HA HIS 29 -13.902 -3.302 2.436
186 1HB HIS 29 2HB HIS 29 -13.152 -0.497 3.323
187 2HB HIS 29 1HB HIS 29 -14.516 -0.940 2.301
188 HD1 HIS 29 HD1 HIS 29 -14.684 0.442 5.196
189 HD2 HIS 29 HD2 HIS 29 -15.348 -3.583 4.352
190 HE1 HIS 29 HE1 HIS 29 -16.090 -0.466 7.098
191 H ARG 30 H ARG 30 -10.980 -3.755 2.165
192 HA ARG 30 HA ARG 30 -9.305 -3.557 0.550
193 1HB ARG 30 2HB ARG 30 -11.422 -4.053 -0.862
194 2HB ARG 30 1HB ARG 30 -11.380 -2.337 -1.268
195 1HG ARG 30 2HG ARG 30 -9.356 -2.517 -2.414
196 2HG ARG 30 1HG ARG 30 -8.872 -3.965 -1.531
197 1HD ARG 30 2HD ARG 30 -9.518 -5.045 -3.430
198 2HD ARG 30 1HD ARG 30 -11.139 -4.856 -2.761
199 HE ARG 30 HE ARG 30 -10.018 -2.790 -4.605
200 1HH1 ARG 30 1HH2 ARG 30 -11.131 -5.013 -6.146
201 2HH1 ARG 30 2HH2 ARG 30 -12.809 -4.607 -6.291
202 1HH2 ARG 30 2HH1 ARG 30 -12.733 -2.283 -3.706
203 2HH2 ARG 30 1HH1 ARG 30 -13.721 -3.055 -4.900
204 H LEU 31 H LEU 31 -9.839 -1.307 2.393
205 HA LEU 31 HA LEU 31 -8.946 0.990 0.712
206 1HB LEU 31 2HB LEU 31 -10.343 0.877 3.392
207 2HB LEU 31 1HB LEU 31 -9.622 2.355 2.757
208 HG LEU 31 HG LEU 31 -11.561 0.743 1.102
209 1HD1 LEU 31 1HD1 LEU 31 -12.251 2.977 3.033
210 2HD1 LEU 31 2HD1 LEU 31 -12.660 1.277 3.261
211 3HD1 LEU 31 3HD1 LEU 31 -13.369 2.182 1.924
212 1HD2 LEU 31 1HD2 LEU 31 -10.182 2.503 0.018
213 2HD2 LEU 31 2HD2 LEU 31 -10.817 3.686 1.162
214 3HD2 LEU 31 3HD2 LEU 31 -11.896 2.914 0.001
215 H ARG 32 H ARG 32 -7.972 -1.209 3.217
216 HA ARG 32 HA ARG 32 -5.799 0.484 4.226
217 1HB ARG 32 2HB ARG 32 -7.020 -1.343 5.557
218 2HB ARG 32 1HB ARG 32 -6.094 -2.505 4.609
219 1HG ARG 32 2HG ARG 32 -4.570 -2.264 6.294
220 2HG ARG 32 1HG ARG 32 -4.101 -0.828 5.385
221 1HD ARG 32 2HD ARG 32 -4.413 -0.025 7.586
222 2HD ARG 32 1HD ARG 32 -5.917 0.398 6.765
223 HE ARG 32 HE ARG 32 -5.859 -2.178 8.233
224 1HH1 ARG 32 1HH2 ARG 32 -8.217 -0.390 7.225
225 2HH1 ARG 32 2HH2 ARG 32 -8.850 0.151 8.742
226 1HH2 ARG 32 2HH1 ARG 32 -6.043 -0.824 10.550
227 2HH2 ARG 32 1HH1 ARG 32 -7.610 -0.092 10.635
228 H CYS 33 H CYS 33 -3.663 0.405 3.544
229 HA CYS 33 HA CYS 33 -3.128 -1.096 1.048
230 1HB CYS 33 2HB CYS 33 -1.927 1.269 2.412
231 2HB CYS 33 1HB CYS 33 -0.861 0.289 1.404
232 H THR 34 H THR 34 -2.307 -3.108 1.268
233 HA THR 34 HA THR 34 -0.632 -3.754 3.638
234 HB THR 34 HB THR 34 -1.904 -5.556 1.551
235 HG1 THR 34 HG1 THR 34 -3.575 -5.206 2.761
236 1HG2 THR 34 1HG2 THR 34 -1.331 -7.067 3.797
237 2HG2 THR 34 2HG2 THR 34 0.080 -6.017 3.661
238 3HG2 THR 34 3HG2 THR 34 -0.384 -7.051 2.309
239 H CYS 35 H CYS 35 1.529 -3.518 3.321
240 HA CYS 35 HA CYS 35 2.638 -3.817 0.576
241 1HB CYS 35 2HB CYS 35 4.219 -2.887 2.963
242 2HB CYS 35 1HB CYS 35 4.464 -2.507 1.259
243 H TYR 36 H TYR 36 4.584 -5.104 0.256
244 HA TYR 36 HA TYR 36 4.932 -7.255 2.307
245 1HB TYR 36 2HB TYR 36 5.650 -8.639 0.187
246 2HB TYR 36 1HB TYR 36 3.943 -8.452 0.571
247 HD1 TYR 36 HD1 TYR 36 2.477 -7.121 -0.813
248 HD2 TYR 36 HD2 TYR 36 6.693 -7.296 -1.628
249 HE1 TYR 36 HE1 TYR 36 2.094 -6.056 -3.018
250 HE2 TYR 36 HE2 TYR 36 6.308 -6.230 -3.834
251 HH TYR 36 HH TYR 36 3.545 -6.123 -5.370
252 H ARG 37 H ARG 37 7.105 -8.274 2.286
253 HA ARG 37 HA ARG 37 9.197 -6.254 2.144
254 1HB ARG 37 2HB ARG 37 9.211 -9.211 2.785
255 2HB ARG 37 1HB ARG 37 10.681 -8.237 2.766
256 1HG ARG 37 2HG ARG 37 8.610 -6.885 4.271
257 2HG ARG 37 1HG ARG 37 8.855 -8.514 4.900
258 1HD ARG 37 2HD ARG 37 10.578 -7.567 6.047
259 2HD ARG 37 1HD ARG 37 11.441 -7.707 4.515
260 HE ARG 37 HE ARG 37 10.391 -5.298 4.136
261 1HH1 ARG 37 2HH1 ARG 37 9.488 -4.958 6.930
262 2HH1 ARG 37 1HH1 ARG 37 10.856 -4.221 7.695
263 1HH2 ARG 37 1HH2 ARG 37 13.069 -5.092 5.162
264 2HH2 ARG 37 2HH2 ARG 37 12.892 -4.294 6.688
265 H CYS 38 H CYS 38 11.208 -6.546 0.911
266 HA CYS 38 HA CYS 38 10.639 -7.586 -1.817
267 1HB CYS 38 2HB CYS 38 11.565 -5.175 -1.191
268 2HB CYS 38 1HB CYS 38 13.109 -6.024 -1.174
269 H GLY 39 HN GLY 39 11.580 -9.452 -2.470
270 1HA GLY 39 2HA GLY 39 13.616 -10.721 -0.745
271 2HA GLY 39 1HA GLY 39 12.760 -11.499 -2.075
Start of MODEL 20
1 1H GLY 1 1H GLY 1 -8.689 4.564 1.623
2 2H GLY 1 2H GLY 1 -8.831 4.418 3.310
3 3H GLY 1 3H GLY 1 -7.706 3.465 2.463
4 1HA GLY 1 2HA GLY 1 -7.574 6.424 2.476
5 2HA GLY 1 1HA GLY 1 -6.776 5.443 3.704
6 H PHE 2 H PHE 2 -5.039 6.872 2.349
7 HA PHE 2 HA PHE 2 -3.135 6.807 0.988
8 1HB PHE 2 2HB PHE 2 -3.592 3.812 0.916
9 2HB PHE 2 1HB PHE 2 -2.066 4.666 0.706
10 HD1 PHE 2 HD1 PHE 2 -4.229 3.062 3.046
11 HD2 PHE 2 HD2 PHE 2 -1.280 6.167 2.696
12 HE1 PHE 2 HE1 PHE 2 -3.841 2.969 5.493
13 HE2 PHE 2 HE2 PHE 2 -0.892 6.074 5.144
14 HZ PHE 2 HZ PHE 2 -2.172 4.474 6.542
15 H GLY 3 H GLY 3 -5.794 7.073 -0.294
16 1HA GLY 3 2HA GLY 3 -6.647 7.192 -2.467
17 2HA GLY 3 1HA GLY 3 -5.007 6.888 -3.035
18 H CYS 4 H CYS 4 -7.323 4.901 -1.155
19 HA CYS 4 HA CYS 4 -6.751 2.639 -3.004
20 1HB CYS 4 2HB CYS 4 -7.729 2.848 -0.173
21 2HB CYS 4 1HB CYS 4 -8.104 1.403 -1.112
22 HA PRO 5 HA PRO 5 -7.751 0.622 -2.984
23 1HB PRO 5 2HB PRO 5 -8.831 -0.827 -5.047
24 2HB PRO 5 1HB PRO 5 -9.480 -0.836 -3.399
25 1HG PRO 5 2HG PRO 5 -10.577 0.471 -5.837
26 2HG PRO 5 1HG PRO 5 -11.420 -0.056 -4.370
27 1HD PRO 5 2HD PRO 5 -10.658 2.612 -5.023
28 2HD PRO 5 1HD PRO 5 -11.296 2.041 -3.465
29 H ASN 6 H ASN 6 -7.563 3.161 -4.919
30 HA ASN 6 HA ASN 6 -6.575 2.369 -7.438
31 1HB ASN 6 2HB ASN 6 -6.979 4.759 -6.439
32 2HB ASN 6 1HB ASN 6 -5.295 4.640 -5.933
33 1HD2 ASN 6 1HD2 ASN 6 -4.180 5.928 -7.444
34 2HD2 ASN 6 2HD2 ASN 6 -4.311 5.756 -9.126
35 H ASN 7 H ASN 7 -4.990 0.943 -7.833
36 HA ASN 7 HA ASN 7 -3.028 0.106 -5.919
37 1HB ASN 7 2HB ASN 7 -3.436 -0.320 -8.862
38 2HB ASN 7 1HB ASN 7 -1.912 -0.814 -8.125
39 1HD2 ASN 7 1HD2 ASN 7 -5.464 -1.295 -7.878
40 2HD2 ASN 7 2HD2 ASN 7 -5.358 -2.810 -7.122
41 H TYR 8 H TYR 8 -3.007 2.658 -8.348
42 HA TYR 8 HA TYR 8 -0.168 3.054 -8.457
43 1HB TYR 8 2HB TYR 8 -2.060 4.045 -9.965
44 2HB TYR 8 1HB TYR 8 -2.146 5.309 -8.740
45 HD1 TYR 8 HD1 TYR 8 -0.257 6.824 -8.349
46 HD2 TYR 8 HD2 TYR 8 -0.086 3.782 -11.377
47 HE1 TYR 8 HE1 TYR 8 1.731 7.925 -9.341
48 HE2 TYR 8 HE2 TYR 8 1.902 4.883 -12.369
49 HH TYR 8 HH TYR 8 3.820 6.828 -10.956
50 H GLN 9 H GLN 9 -2.707 4.501 -6.399
51 HA GLN 9 HA GLN 9 -0.867 6.200 -4.949
52 1HB GLN 9 2HB GLN 9 -3.649 5.215 -4.246
53 2HB GLN 9 1HB GLN 9 -2.769 6.445 -3.342
54 1HG GLN 9 2HG GLN 9 -2.897 6.931 -6.251
55 2HG GLN 9 1HG GLN 9 -4.457 6.984 -5.432
56 1HE2 GLN 9 1HE2 GLN 9 -4.909 9.154 -4.989
57 2HE2 GLN 9 2HE2 GLN 9 -3.795 10.262 -4.347
58 H CYS 10 H CYS 10 -2.254 2.971 -4.380
59 HA CYS 10 HA CYS 10 -1.088 2.630 -1.765
60 1HB CYS 10 2HB CYS 10 -2.965 1.253 -3.053
61 2HB CYS 10 1HB CYS 10 -1.581 0.277 -3.549
62 H HIS 11 H HIS 11 -0.017 1.842 -5.064
63 HA HIS 11 HA HIS 11 2.364 0.427 -4.292
64 1HB HIS 11 2HB HIS 11 1.332 0.323 -6.571
65 2HB HIS 11 1HB HIS 11 1.849 1.985 -6.845
66 HD1 HIS 11 HD1 HIS 11 3.708 -1.032 -5.390
67 HD2 HIS 11 HD2 HIS 11 4.111 1.820 -8.406
68 HE1 HIS 11 HE1 HIS 11 5.948 -1.461 -6.485
69 H ARG 12 H ARG 12 1.782 3.839 -5.222
70 HA ARG 12 HA ARG 12 4.497 4.703 -4.901
71 1HB ARG 12 2HB ARG 12 2.562 5.968 -6.024
72 2HB ARG 12 1HB ARG 12 2.061 6.429 -4.397
73 1HG ARG 12 2HG ARG 12 4.936 6.835 -5.001
74 2HG ARG 12 1HG ARG 12 3.822 7.872 -5.894
75 1HD ARG 12 2HD ARG 12 3.229 9.043 -4.036
76 2HD ARG 12 1HD ARG 12 3.184 7.598 -3.026
77 HE ARG 12 HE ARG 12 5.715 7.787 -2.937
78 1HH1 ARG 12 1HH2 ARG 12 5.976 9.992 -4.957
79 2HH1 ARG 12 2HH2 ARG 12 6.135 11.391 -3.949
80 1HH2 ARG 12 2HH1 ARG 12 4.943 9.799 -1.098
81 2HH2 ARG 12 1HH1 ARG 12 5.549 11.281 -1.756
82 H HIS 13 H HIS 13 1.769 4.441 -2.644
83 HA HIS 13 HA HIS 13 3.042 5.740 -0.418
84 1HB HIS 13 2HB HIS 13 0.613 5.368 -0.477
85 2HB HIS 13 1HB HIS 13 0.865 3.623 -0.479
86 HD1 HIS 13 HD1 HIS 13 2.154 6.493 1.706
87 HD2 HIS 13 HD2 HIS 13 0.528 2.672 2.077
88 HE1 HIS 13 HE1 HIS 13 2.033 6.003 4.188
89 H CYS 14 H CYS 14 2.726 2.284 -1.310
90 HA CYS 14 HA CYS 14 4.278 1.276 0.878
91 1HB CYS 14 2HB CYS 14 3.704 0.161 -1.879
92 2HB CYS 14 1HB CYS 14 4.576 -0.739 -0.638
93 H LYS 15 H LYS 15 5.157 2.500 -2.323
94 HA LYS 15 HA LYS 15 7.878 1.635 -2.368
95 1HB LYS 15 2HB LYS 15 6.377 3.885 -3.697
96 2HB LYS 15 1HB LYS 15 8.125 3.744 -3.886
97 1HG LYS 15 2HG LYS 15 6.674 1.208 -4.271
98 2HG LYS 15 1HG LYS 15 6.273 2.449 -5.457
99 1HD LYS 15 2HD LYS 15 8.559 2.691 -6.120
100 2HD LYS 15 1HD LYS 15 9.127 1.742 -4.744
101 1HE LYS 15 2HE LYS 15 7.623 -0.147 -5.762
102 2HE LYS 15 1HE LYS 15 7.740 0.804 -7.243
103 1HZ LYS 15 1HZ LYS 15 9.487 -0.919 -6.999
104 2HZ LYS 15 2HZ LYS 15 10.086 -0.078 -5.651
105 3HZ LYS 15 3HZ LYS 15 10.102 0.650 -7.186
106 H SER 16 H SER 16 6.373 4.598 -1.046
107 HA SER 16 HA SER 16 8.890 5.800 -0.288
108 1HB SER 16 2HB SER 16 7.490 7.346 1.057
109 2HB SER 16 1HB SER 16 6.898 7.184 -0.592
110 HG SER 16 HG SER 16 5.148 6.242 0.139
111 H ILE 17 H ILE 17 6.867 3.363 1.174
112 HA ILE 17 HA ILE 17 7.990 3.712 3.860
113 HB ILE 17 HB ILE 17 6.327 1.460 2.681
114 1HG1 ILE 17 2HG1 ILE 17 5.385 3.546 4.644
115 2HG1 ILE 17 1HG1 ILE 17 5.392 3.899 2.916
116 1HG2 ILE 17 1HG2 ILE 17 7.586 0.688 4.625
117 2HG2 ILE 17 2HG2 ILE 17 5.900 0.915 5.089
118 3HG2 ILE 17 3HG2 ILE 17 7.107 2.118 5.541
119 1HD1 ILE 17 1HD1 ILE 17 3.643 2.090 4.460
120 2HD1 ILE 17 2HD1 ILE 17 4.241 1.417 2.944
121 3HD1 ILE 17 3HD1 ILE 17 3.335 2.929 2.940
122 HA PRO 18 HA PRO 18 11.593 1.303 2.875
123 1HB PRO 18 2HB PRO 18 12.657 1.381 5.410
124 2HB PRO 18 1HB PRO 18 12.755 2.727 4.261
125 1HG PRO 18 2HG PRO 18 11.030 2.443 6.677
126 2HG PRO 18 1HG PRO 18 11.626 3.914 5.889
127 1HD PRO 18 2HD PRO 18 9.017 2.838 5.645
128 2HD PRO 18 1HD PRO 18 9.722 4.111 4.626
129 H GLY 19 H GLY 19 12.164 -0.882 3.090
130 1HA GLY 19 2HA GLY 19 12.234 -3.015 4.230
131 2HA GLY 19 1HA GLY 19 10.898 -2.486 5.249
132 H ARG 20 H ARG 20 9.704 -1.456 2.488
133 HA ARG 20 HA ARG 20 8.639 -4.123 1.658
134 1HB ARG 20 2HB ARG 20 7.073 -1.544 1.503
135 2HB ARG 20 1HB ARG 20 6.466 -3.193 1.381
136 1HG ARG 20 2HG ARG 20 7.778 -2.118 3.891
137 2HG ARG 20 1HG ARG 20 6.040 -2.032 3.612
138 1HD ARG 20 2HD ARG 20 6.604 -4.671 3.016
139 2HD ARG 20 1HD ARG 20 7.700 -4.340 4.358
140 HE ARG 20 HE ARG 20 4.734 -4.246 4.482
141 1HH1 ARG 20 1HH2 ARG 20 6.091 -2.055 6.106
142 2HH1 ARG 20 2HH2 ARG 20 6.243 -2.823 7.651
143 1HH2 ARG 20 2HH1 ARG 20 5.686 -6.022 6.412
144 2HH2 ARG 20 1HH1 ARG 20 6.011 -5.075 7.824
145 H CYS 21 H CYS 21 8.215 -4.385 -0.586
146 HA CYS 21 HA CYS 21 9.740 -2.514 -2.324
147 1HB CYS 21 2HB CYS 21 9.314 -5.382 -2.283
148 2HB CYS 21 1HB CYS 21 8.861 -4.712 -3.850
149 H GLY 22 H GLY 22 6.612 -4.251 -2.263
150 1HA GLY 22 2HA GLY 22 5.375 -1.941 -3.657
151 2HA GLY 22 1HA GLY 22 5.186 -3.539 -4.379
152 H GLY 23 H GLY 23 2.829 -2.520 -3.785
153 1HA GLY 23 2HA GLY 23 1.861 -4.198 -1.605
154 2HA GLY 23 1HA GLY 23 1.756 -2.479 -1.237
155 H TYR 24 H TYR 24 -0.595 -3.354 -1.163
156 HA TYR 24 HA TYR 24 -1.970 -2.369 -3.542
157 1HB TYR 24 2HB TYR 24 -3.220 -4.430 -4.007
158 2HB TYR 24 1HB TYR 24 -1.492 -4.730 -4.184
159 HD1 TYR 24 HD1 TYR 24 -0.236 -5.950 -2.407
160 HD2 TYR 24 HD2 TYR 24 -4.502 -5.469 -2.251
161 HE1 TYR 24 HE1 TYR 24 -0.375 -7.737 -0.694
162 HE2 TYR 24 HE2 TYR 24 -4.642 -7.257 -0.539
163 HH TYR 24 HH TYR 24 -3.016 -8.241 1.228
164 H CYS 25 H CYS 25 -4.371 -2.328 -3.143
165 HA CYS 25 HA CYS 25 -4.898 -1.696 -0.322
166 1HB CYS 25 2HB CYS 25 -6.722 -1.571 -2.744
167 2HB CYS 25 1HB CYS 25 -7.085 -0.910 -1.148
168 H GLY 26 H GLY 26 -5.701 -3.167 1.091
169 1HA GLY 26 2HA GLY 26 -7.835 -4.979 0.523
170 2HA GLY 26 1HA GLY 26 -6.312 -5.854 0.407
171 H GLY 27 H GLY 27 -8.656 -5.709 2.458
172 1HA GLY 27 2HA GLY 27 -7.903 -6.714 4.725
173 2HA GLY 27 1HA GLY 27 -7.011 -5.203 4.900
174 H TRP 28 H TRP 28 -8.284 -3.198 4.922
175 HA TRP 28 HA TRP 28 -10.869 -3.594 6.310
176 1HB TRP 28 2HB TRP 28 -9.074 -2.096 7.266
177 2HB TRP 28 1HB TRP 28 -9.318 -1.022 5.890
178 HD1 TRP 28 HD1 TRP 28 -11.204 -2.446 8.925
179 HE1 TRP 28 HE1 TRP 28 -13.111 -0.827 9.533
180 HE3 TRP 28 HE3 TRP 28 -10.830 0.856 5.047
181 HZ2 TRP 28 HZ2 TRP 28 -14.319 1.555 8.515
182 HZ3 TRP 28 HZ3 TRP 28 -12.370 2.791 4.893
183 HH2 TRP 28 HH2 TRP 28 -14.113 3.144 6.618
184 H HIS 29 H HIS 29 -12.228 -4.092 4.539
185 HA HIS 29 HA HIS 29 -13.651 -3.640 2.738
186 1HB HIS 29 2HB HIS 29 -13.092 -0.740 3.430
187 2HB HIS 29 1HB HIS 29 -14.498 -1.369 2.579
188 HD1 HIS 29 HD1 HIS 29 -14.448 0.162 5.433
189 HD2 HIS 29 HD2 HIS 29 -14.937 -3.929 4.810
190 HE1 HIS 29 HE1 HIS 29 -15.586 -0.747 7.505
191 H ARG 30 H ARG 30 -10.735 -3.873 2.280
192 HA ARG 30 HA ARG 30 -9.193 -3.622 0.548
193 1HB ARG 30 2HB ARG 30 -11.304 -4.328 -0.730
194 2HB ARG 30 1HB ARG 30 -11.498 -2.621 -1.132
195 1HG ARG 30 2HG ARG 30 -9.644 -2.589 -2.504
196 2HG ARG 30 1HG ARG 30 -8.809 -3.837 -1.582
197 1HD ARG 30 2HD ARG 30 -11.276 -4.436 -3.221
198 2HD ARG 30 1HD ARG 30 -9.655 -4.512 -3.908
199 HE ARG 30 HE ARG 30 -10.828 -6.542 -2.289
200 1HH1 ARG 30 1HH2 ARG 30 -8.067 -6.096 -3.904
201 2HH1 ARG 30 2HH2 ARG 30 -6.982 -6.727 -2.710
202 1HH2 ARG 30 2HH1 ARG 30 -9.368 -6.770 -0.182
203 2HH2 ARG 30 1HH1 ARG 30 -7.724 -7.120 -0.600
204 H LEU 31 H LEU 31 -9.845 -1.329 2.352
205 HA LEU 31 HA LEU 31 -9.097 0.942 0.565
206 1HB LEU 31 2HB LEU 31 -10.444 0.909 3.278
207 2HB LEU 31 1HB LEU 31 -9.898 2.380 2.473
208 HG LEU 31 HG LEU 31 -11.728 0.429 1.078
209 1HD1 LEU 31 1HD1 LEU 31 -12.761 1.113 3.247
210 2HD1 LEU 31 2HD1 LEU 31 -13.639 1.731 1.848
211 3HD1 LEU 31 3HD1 LEU 31 -12.578 2.799 2.766
212 1HD2 LEU 31 1HD2 LEU 31 -11.267 3.418 0.803
213 2HD2 LEU 31 2HD2 LEU 31 -12.312 2.434 -0.221
214 3HD2 LEU 31 3HD2 LEU 31 -10.567 2.184 -0.245
215 H ARG 32 H ARG 32 -7.985 -1.095 3.141
216 HA ARG 32 HA ARG 32 -5.962 0.789 4.120
217 1HB ARG 32 2HB ARG 32 -7.139 -1.223 5.374
218 2HB ARG 32 1HB ARG 32 -5.845 -2.168 4.635
219 1HG ARG 32 2HG ARG 32 -4.157 -0.944 5.751
220 2HG ARG 32 1HG ARG 32 -5.255 0.379 6.143
221 1HD ARG 32 2HD ARG 32 -6.561 -1.270 7.567
222 2HD ARG 32 1HD ARG 32 -5.234 -2.407 7.328
223 HE ARG 32 HE ARG 32 -4.352 0.190 8.337
224 1HH1 ARG 32 2HH1 ARG 32 -2.956 -2.320 9.042
225 2HH1 ARG 32 1HH1 ARG 32 -3.480 -2.611 10.667
226 1HH2 ARG 32 1HH2 ARG 32 -6.187 -0.440 10.462
227 2HH2 ARG 32 2HH2 ARG 32 -5.316 -1.542 11.475
228 H CYS 33 H CYS 33 -3.763 0.755 3.573
229 HA CYS 33 HA CYS 33 -3.100 -0.667 1.068
230 1HB CYS 33 2HB CYS 33 -2.097 1.715 2.493
231 2HB CYS 33 1HB CYS 33 -0.844 0.738 1.727
232 H THR 34 H THR 34 -2.225 -2.653 1.203
233 HA THR 34 HA THR 34 -0.575 -3.344 3.594
234 HB THR 34 HB THR 34 -2.077 -5.109 1.635
235 HG1 THR 34 HG1 THR 34 -3.600 -4.886 3.039
236 1HG2 THR 34 1HG2 THR 34 -0.124 -6.324 2.281
237 2HG2 THR 34 2HG2 THR 34 -1.423 -6.914 3.320
238 3HG2 THR 34 3HG2 THR 34 -0.243 -5.763 3.949
239 H CYS 35 H CYS 35 1.570 -3.159 3.160
240 HA CYS 35 HA CYS 35 2.532 -3.620 0.383
241 1HB CYS 35 2HB CYS 35 4.233 -2.598 2.652
242 2HB CYS 35 1HB CYS 35 4.428 -2.331 0.921
243 H TYR 36 H TYR 36 3.847 -5.340 -0.120
244 HA TYR 36 HA TYR 36 4.297 -7.337 2.016
245 1HB TYR 36 2HB TYR 36 5.237 -8.693 -0.016
246 2HB TYR 36 1HB TYR 36 3.499 -8.464 0.136
247 HD1 TYR 36 HD1 TYR 36 6.556 -7.266 -1.613
248 HD2 TYR 36 HD2 TYR 36 2.261 -7.204 -1.480
249 HE1 TYR 36 HE1 TYR 36 6.500 -6.214 -3.857
250 HE2 TYR 36 HE2 TYR 36 2.207 -6.148 -3.723
251 HH TYR 36 HH TYR 36 4.291 -6.227 -5.842
252 H ARG 37 H ARG 37 6.349 -8.115 2.597
253 HA ARG 37 HA ARG 37 8.482 -6.186 2.578
254 1HB ARG 37 2HB ARG 37 8.401 -9.107 3.363
255 2HB ARG 37 1HB ARG 37 9.819 -8.083 3.586
256 1HG ARG 37 2HG ARG 37 8.768 -6.741 5.188
257 2HG ARG 37 1HG ARG 37 7.151 -7.169 4.629
258 1HD ARG 37 2HD ARG 37 7.226 -8.494 6.510
259 2HD ARG 37 1HD ARG 37 7.968 -9.613 5.366
260 HE ARG 37 HE ARG 37 9.342 -8.219 7.551
261 1HH1 ARG 37 2HH1 ARG 37 9.836 -11.077 6.817
262 2HH1 ARG 37 1HH1 ARG 37 11.368 -10.993 6.014
263 1HH2 ARG 37 1HH2 ARG 37 11.212 -7.556 5.517
264 2HH2 ARG 37 2HH2 ARG 37 12.149 -8.992 5.275
265 H CYS 38 H CYS 38 10.424 -6.167 1.432
266 HA CYS 38 HA CYS 38 10.389 -7.583 -1.159
267 1HB CYS 38 2HB CYS 38 11.062 -5.074 -0.653
268 2HB CYS 38 1HB CYS 38 12.634 -5.791 -0.299
269 H GLY 39 HN GLY 39 11.465 -9.457 -1.463
270 1HA GLY 39 2HA GLY 39 13.343 -10.418 0.606
271 2HA GLY 39 1HA GLY 39 12.692 -11.376 -0.723