Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
582981 | 2mfs RC | 19570 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 CYS 1 1HT CYS 1 -10.517 -2.593 -3.268
2 H2 CYS 1 2HT CYS 1 -10.155 -0.956 -3.102
3 H3 CYS 1 3HT CYS 1 -10.806 -1.809 -1.799
4 HA CYS 1 HA CYS 1 -8.428 -1.381 -1.601
5 HB2 CYS 1 2HB CYS 1 -7.829 -3.694 -1.001
6 HB3 CYS 1 1HB CYS 1 -9.440 -3.286 -0.434
7 H VAL 2 H VAL 2 -6.312 -1.877 -2.342
8 HA VAL 2 HA VAL 2 -6.277 -2.461 -5.196
9 HB VAL 2 HB VAL 2 -4.083 -1.240 -5.281
10 HG11 VAL 2 1HG1 VAL 2 -6.111 -0.148 -5.983
11 HG12 VAL 2 2HG1 VAL 2 -5.100 1.011 -5.112
12 HG13 VAL 2 3HG1 VAL 2 -6.491 0.280 -4.319
13 HG21 VAL 2 3HG2 VAL 2 -4.841 -0.404 -2.479
14 HG22 VAL 2 1HG2 VAL 2 -3.523 0.276 -3.434
15 HG23 VAL 2 2HG2 VAL 2 -3.463 -1.412 -2.922
16 H LEU 3 H LEU 3 -4.084 -3.283 -5.951
17 HA LEU 3 HA LEU 3 -3.704 -5.726 -4.386
18 HB2 LEU 3 2HB LEU 3 -3.156 -5.396 -7.329
19 HB3 LEU 3 1HB LEU 3 -3.329 -6.853 -6.356
20 HG LEU 3 HG LEU 3 -5.608 -4.983 -6.989
21 HD11 LEU 3 1HD1 LEU 3 -6.360 -6.707 -8.527
22 HD12 LEU 3 2HD1 LEU 3 -4.892 -7.628 -8.209
23 HD13 LEU 3 3HD1 LEU 3 -4.791 -6.053 -9.000
24 HD21 LEU 3 3HD2 LEU 3 -5.553 -7.740 -5.761
25 HD22 LEU 3 1HD2 LEU 3 -7.005 -6.837 -6.196
26 HD23 LEU 3 2HD2 LEU 3 -5.942 -6.232 -4.930
27 H ILE 4 H ILE 4 -1.517 -6.816 -5.112
28 HA ILE 4 HA ILE 4 0.531 -5.217 -4.038
29 HB ILE 4 HB ILE 4 2.117 -7.021 -4.729
30 HG12 ILE 4 2HG1 ILE 4 -0.387 -8.366 -5.787
31 HG13 ILE 4 1HG1 ILE 4 0.932 -7.751 -6.776
32 HG21 ILE 4 1HG2 ILE 4 1.050 -7.060 -2.569
33 HG22 ILE 4 2HG2 ILE 4 1.192 -8.702 -3.197
34 HG23 ILE 4 3HG2 ILE 4 -0.361 -7.869 -3.249
35 HD11 ILE 4 3HD1 ILE 4 2.440 -9.394 -5.766
36 HD12 ILE 4 1HD1 ILE 4 1.050 -10.167 -6.531
37 HD13 ILE 4 2HD1 ILE 4 1.111 -9.999 -4.776
38 H GLY 5 H GLY 5 2.127 -4.061 -4.823
39 HA2 GLY 5 2HA GLY 5 3.537 -3.100 -6.370
40 HA3 GLY 5 1HA GLY 5 2.746 -3.966 -7.665
41 H GLN 6 H GLN 6 0.173 -2.792 -6.223
42 HA GLN 6 HA GLN 6 0.132 -0.348 -7.798
43 HB2 GLN 6 2HB GLN 6 -2.059 -1.678 -6.181
44 HB3 GLN 6 1HB GLN 6 -2.275 -0.333 -7.288
45 HG2 GLN 6 2HG GLN 6 -1.545 -1.768 -9.154
46 HG3 GLN 6 1HG GLN 6 -1.418 -3.121 -8.041
47 HE21 GLN 6 1HE2 GLN 6 -3.049 -2.827 -10.400
48 HE22 GLN 6 2HE2 GLN 6 -4.686 -3.059 -9.911
49 H ARG 7 H ARG 7 -0.508 1.634 -6.762
50 HA ARG 7 HA ARG 7 0.933 1.749 -4.253
51 HB2 ARG 7 2HB ARG 7 1.064 4.141 -4.511
52 HB3 ARG 7 1HB ARG 7 1.552 3.359 -5.999
53 HG2 ARG 7 2HG ARG 7 -0.627 3.893 -6.985
54 HG3 ARG 7 1HG ARG 7 -1.100 4.680 -5.472
55 HD2 ARG 7 2HD ARG 7 0.811 6.211 -5.702
56 HD3 ARG 7 1HD ARG 7 1.216 5.444 -7.232
57 HE ARG 7 HE ARG 7 -1.450 6.478 -7.073
58 HH11 ARG 7 1HH1 ARG 7 1.895 7.086 -8.050
59 HH12 ARG 7 2HH1 ARG 7 1.546 8.488 -8.951
60 HH21 ARG 7 1HH2 ARG 7 -1.950 8.422 -8.341
61 HH22 ARG 7 2HH2 ARG 7 -0.717 9.274 -9.136
62 H CYS 8 H CYS 8 0.214 2.709 -2.415
63 HA CYS 8 HA CYS 8 -2.671 2.948 -2.119
64 HB2 CYS 8 2HB CYS 8 -2.561 1.461 -0.147
65 HB3 CYS 8 1HB CYS 8 -2.134 0.615 -1.631
66 H ASP 9 H ASP 9 -3.037 3.608 0.275
67 HA ASP 9 HA ASP 9 -0.847 4.960 1.557
68 HB2 ASP 9 2HB ASP 9 -1.866 6.690 0.016
69 HB3 ASP 9 1HB ASP 9 -3.388 6.439 0.875
70 H ASN 10 H ASN 10 -1.039 4.337 3.493
71 HA ASN 10 HA ASN 10 -3.037 2.633 4.452
72 HB2 ASN 10 2HB ASN 10 -0.902 4.134 5.955
73 HB3 ASN 10 1HB ASN 10 -1.978 2.975 6.716
74 HD21 ASN 10 1HD2 ASN 10 0.738 3.403 4.577
75 HD22 ASN 10 2HD2 ASN 10 1.125 1.720 4.481
76 H ASP 11 H ASP 11 -2.693 6.067 4.943
77 HA ASP 11 HA ASP 11 -4.867 5.947 6.864
78 HB2 ASP 11 2HB ASP 11 -3.009 8.176 6.132
79 HB3 ASP 11 1HB ASP 11 -4.432 8.425 7.136
80 H ARG 12 H ARG 12 -4.206 7.514 3.773
81 HA ARG 12 HA ARG 12 -6.861 8.694 3.835
82 HB2 ARG 12 2HB ARG 12 -4.620 8.915 1.851
83 HB3 ARG 12 1HB ARG 12 -6.138 9.794 1.750
84 HG2 ARG 12 2HG ARG 12 -5.661 11.017 3.718
85 HG3 ARG 12 1HG ARG 12 -4.282 9.980 4.100
86 HD2 ARG 12 2HD ARG 12 -4.514 11.762 1.691
87 HD3 ARG 12 1HD ARG 12 -3.620 12.153 3.159
88 HE ARG 12 HE ARG 12 -2.699 9.697 2.276
89 HH11 ARG 12 1HH1 ARG 12 -2.763 12.993 1.027
90 HH12 ARG 12 2HH1 ARG 12 -1.297 12.884 0.197
91 HH21 ARG 12 1HH2 ARG 12 -0.697 9.500 1.174
92 HH22 ARG 12 2HH2 ARG 12 -0.041 10.827 0.295
93 H GLY 13 H GLY 13 -5.204 6.082 2.299
94 HA2 GLY 13 2HA GLY 13 -6.326 4.313 1.232
95 HA3 GLY 13 1HA GLY 13 -7.634 5.403 0.795
96 HA PRO 14 HA PRO 14 -7.486 3.414 -0.752
97 HB2 PRO 14 2HB PRO 14 -6.561 1.740 -2.618
98 HB3 PRO 14 1HB PRO 14 -7.525 3.158 -3.057
99 HG2 PRO 14 2HG PRO 14 -4.562 2.774 -3.163
100 HG3 PRO 14 1HG PRO 14 -5.636 3.530 -4.351
101 HD2 PRO 14 2HD PRO 14 -4.138 4.932 -2.531
102 HD3 PRO 14 1HD PRO 14 -5.646 5.535 -3.245
103 H ARG 15 H ARG 15 -7.166 1.131 -0.165
104 HA ARG 15 HA ARG 15 -4.513 0.602 0.980
105 HB2 ARG 15 2HB ARG 15 -7.251 0.103 2.138
106 HB3 ARG 15 1HB ARG 15 -5.795 -0.642 2.784
107 HG2 ARG 15 2HG ARG 15 -4.870 1.526 3.314
108 HG3 ARG 15 1HG ARG 15 -6.242 2.327 2.549
109 HD2 ARG 15 2HD ARG 15 -6.435 0.475 4.904
110 HD3 ARG 15 1HD ARG 15 -6.374 2.234 5.024
111 HE ARG 15 HE ARG 15 -8.392 1.800 3.318
112 HH11 ARG 15 1HH1 ARG 15 -7.744 0.549 6.569
113 HH12 ARG 15 2HH1 ARG 15 -9.378 0.427 7.006
114 HH21 ARG 15 1HH2 ARG 15 -10.660 1.577 3.915
115 HH22 ARG 15 2HH2 ARG 15 -11.069 0.999 5.460
116 H CYS 16 H CYS 16 -4.026 -1.658 1.240
117 HA CYS 16 HA CYS 16 -4.363 -3.155 -1.187
118 HB2 CYS 16 2HB CYS 16 -3.238 -4.005 1.454
119 HB3 CYS 16 1HB CYS 16 -2.864 -4.637 -0.146
120 H CYS 17 H CYS 17 -5.381 -5.061 -1.527
121 HA CYS 17 HA CYS 17 -7.670 -5.642 0.056
122 HB2 CYS 17 2HB CYS 17 -6.246 -7.330 -2.028
123 HB3 CYS 17 1HB CYS 17 -7.858 -7.652 -1.393
124 H SER 18 H SER 18 -8.005 -7.335 1.467
125 HA SER 18 HA SER 18 -6.122 -7.614 3.436
126 HB2 SER 18 2HB SER 18 -8.612 -7.782 3.651
127 HB3 SER 18 1HB SER 18 -8.519 -9.404 2.976
128 HG SER 18 HG SER 18 -7.593 -8.407 5.421
129 H GLY 19 H GLY 19 -6.606 -9.680 0.655
130 HA2 GLY 19 2HA GLY 19 -4.668 -11.590 1.780
131 HA3 GLY 19 1HA GLY 19 -5.780 -11.941 0.465
132 H GLN 20 H GLN 20 -4.267 -8.893 0.343
133 HA GLN 20 HA GLN 20 -2.651 -9.844 -1.878
134 HB2 GLN 20 2HB GLN 20 -3.912 -7.192 -1.313
135 HB3 GLN 20 1HB GLN 20 -2.476 -7.201 -2.276
136 HG2 GLN 20 2HG GLN 20 -4.922 -8.827 -2.852
137 HG3 GLN 20 1HG GLN 20 -4.517 -7.305 -3.635
138 HE21 GLN 20 1HE2 GLN 20 -3.900 -10.702 -3.482
139 HE22 GLN 20 2HE2 GLN 20 -2.837 -10.766 -4.829
140 H GLY 21 H GLY 21 -2.190 -7.293 0.582
141 HA2 GLY 21 2HA GLY 21 0.329 -8.299 1.393
142 HA3 GLY 21 1HA GLY 21 0.518 -7.080 0.152
143 H ASN 22 H ASN 22 1.607 -6.378 2.304
144 HA ASN 22 HA ASN 22 -0.258 -4.823 3.920
145 HB2 ASN 22 2HB ASN 22 1.609 -6.066 5.023
146 HB3 ASN 22 1HB ASN 22 2.755 -5.109 4.096
147 HD21 ASN 22 1HD2 ASN 22 3.718 -4.226 5.900
148 HD22 ASN 22 2HD2 ASN 22 2.946 -3.063 6.897
149 H CYS 23 H CYS 23 -0.349 -2.620 3.749
150 HA CYS 23 HA CYS 23 0.781 -1.438 1.391
151 HB2 CYS 23 2HB CYS 23 -1.502 -0.847 2.151
152 HB3 CYS 23 1HB CYS 23 -0.835 -0.196 3.644
153 H VAL 24 H VAL 24 2.926 -1.239 1.564
154 HA VAL 24 HA VAL 24 4.086 -0.286 4.038
155 HB VAL 24 HB VAL 24 5.507 -0.882 1.460
156 HG11 VAL 24 1HG1 VAL 24 6.825 0.407 2.999
157 HG12 VAL 24 2HG1 VAL 24 7.475 -1.232 2.916
158 HG13 VAL 24 3HG1 VAL 24 6.496 -0.740 4.295
159 HG21 VAL 24 3HG2 VAL 24 6.017 -3.127 2.355
160 HG22 VAL 24 1HG2 VAL 24 4.286 -2.891 2.116
161 HG23 VAL 24 2HG2 VAL 24 4.973 -2.796 3.738
162 HA PRO 25 HA PRO 25 3.579 3.748 2.275
163 HB2 PRO 25 2HB PRO 25 5.248 4.766 4.451
164 HB3 PRO 25 1HB PRO 25 3.543 5.075 4.125
165 HG2 PRO 25 2HG PRO 25 4.384 3.551 6.202
166 HG3 PRO 25 1HG PRO 25 2.847 3.281 5.368
167 HD2 PRO 25 2HD PRO 25 5.433 1.778 5.066
168 HD3 PRO 25 1HD PRO 25 3.751 1.198 5.084
169 H LEU 26 H LEU 26 4.661 5.070 1.031
170 HA LEU 26 HA LEU 26 7.556 4.719 0.754
171 HB2 LEU 26 2HB LEU 26 5.501 5.205 -1.401
172 HB3 LEU 26 1HB LEU 26 7.230 5.262 -1.655
173 HG LEU 26 HG LEU 26 5.674 2.832 -0.820
174 HD11 LEU 26 1HD1 LEU 26 6.903 3.603 -3.468
175 HD12 LEU 26 2HD1 LEU 26 5.179 3.497 -3.110
176 HD13 LEU 26 3HD1 LEU 26 6.173 2.041 -3.100
177 HD21 LEU 26 3HD2 LEU 26 8.581 3.173 -1.562
178 HD22 LEU 26 1HD2 LEU 26 7.772 1.625 -1.308
179 HD23 LEU 26 2HD2 LEU 26 7.943 2.756 0.030
180 HA PRO 27 HA PRO 27 8.344 8.903 1.724
181 HB2 PRO 27 2HB PRO 27 9.630 8.956 -0.978
182 HB3 PRO 27 1HB PRO 27 10.234 9.585 0.561
183 HG2 PRO 27 2HG PRO 27 11.099 7.249 -0.371
184 HG3 PRO 27 1HG PRO 27 10.789 7.480 1.358
185 HD2 PRO 27 2HD PRO 27 9.233 5.918 -0.635
186 HD3 PRO 27 1HD PRO 27 9.352 5.707 1.115
187 H PHE 28 H PHE 28 7.682 8.750 -1.791
188 HA PHE 28 HA PHE 28 5.880 11.011 -1.345
189 HB2 PHE 28 2HB PHE 28 6.447 11.767 -3.682
190 HB3 PHE 28 1HB PHE 28 7.690 11.951 -2.446
191 HD1 PHE 28 2HD PHE 28 6.684 10.083 -5.451
192 HD2 PHE 28 1HD PHE 28 9.773 10.797 -2.618
193 HE1 PHE 28 2HE PHE 28 8.294 8.940 -6.919
194 HE2 PHE 28 1HE PHE 28 11.387 9.659 -4.079
195 HZ PHE 28 HZ PHE 28 10.651 8.729 -6.231
196 H LEU 29 H LEU 29 6.234 7.985 -2.840
197 HA LEU 29 HA LEU 29 3.839 8.276 -4.416
198 HB2 LEU 29 2HB LEU 29 5.440 5.803 -3.796
199 HB3 LEU 29 1HB LEU 29 4.034 5.817 -4.837
200 HG LEU 29 HG LEU 29 6.652 7.236 -5.343
201 HD11 LEU 29 1HD1 LEU 29 5.347 4.895 -6.715
202 HD12 LEU 29 2HD1 LEU 29 6.757 4.829 -5.662
203 HD13 LEU 29 3HD1 LEU 29 6.849 5.675 -7.208
204 HD21 LEU 29 3HD2 LEU 29 4.124 7.160 -7.005
205 HD22 LEU 29 1HD2 LEU 29 5.680 7.794 -7.545
206 HD23 LEU 29 2HD2 LEU 29 4.827 8.577 -6.224
207 H GLY 30 H GLY 30 4.165 8.022 -1.215
208 HA2 GLY 30 2HA GLY 30 2.380 7.958 0.293
209 HA3 GLY 30 1HA GLY 30 1.381 7.217 -0.950
210 H GLY 31 H GLY 31 2.418 5.027 -1.638
211 HA2 GLY 31 2HA GLY 31 3.813 3.428 0.106
212 HA3 GLY 31 1HA GLY 31 2.113 3.315 0.559
213 H VAL 32 H VAL 32 3.299 1.133 -0.275
214 HA VAL 32 HA VAL 32 1.763 0.592 -2.674
215 HB VAL 32 HB VAL 32 4.022 1.143 -3.460
216 HG11 VAL 32 1HG1 VAL 32 4.857 -1.381 -2.050
217 HG12 VAL 32 2HG1 VAL 32 5.436 0.257 -1.691
218 HG13 VAL 32 3HG1 VAL 32 5.839 -0.528 -3.231
219 HG21 VAL 32 3HG2 VAL 32 4.306 -0.774 -4.989
220 HG22 VAL 32 1HG2 VAL 32 2.638 -0.215 -4.854
221 HG23 VAL 32 2HG2 VAL 32 3.150 -1.674 -4.007
222 H CYS 33 H CYS 33 1.168 -1.401 -2.878
223 HA CYS 33 HA CYS 33 1.011 -2.971 -0.444
224 HB2 CYS 33 2HB CYS 33 -0.115 -3.477 -3.193
225 HB3 CYS 33 1HB CYS 33 -0.478 -4.445 -1.763
226 H ALA 34 H ALA 34 2.465 -4.468 0.105
227 HA ALA 34 HA ALA 34 3.740 -6.052 -1.970
228 HB1 ALA 34 1HB ALA 34 5.240 -4.142 -1.632
229 HB2 ALA 34 2HB ALA 34 5.965 -5.630 -1.025
230 HB3 ALA 34 3HB ALA 34 5.269 -4.466 0.101
231 H VAL 35 H VAL 35 4.676 -7.978 -1.098
232 HA VAL 35 HA VAL 35 3.252 -8.904 1.247
233 HB VAL 35 HB VAL 35 5.054 -10.441 -0.655
234 HG11 VAL 35 1HG1 VAL 35 3.990 -12.447 0.279
235 HG12 VAL 35 2HG1 VAL 35 3.089 -11.435 1.408
236 HG13 VAL 35 3HG1 VAL 35 4.847 -11.525 1.516
237 HG21 VAL 35 3HG2 VAL 35 2.978 -11.305 -1.654
238 HG22 VAL 35 1HG2 VAL 35 3.113 -9.555 -1.835
239 HG23 VAL 35 2HG2 VAL 35 2.040 -10.235 -0.613
Start of MODEL 2
1 H1 CYS 1 1HT CYS 1 -10.661 -2.835 -3.481
2 H2 CYS 1 2HT CYS 1 -10.436 -1.167 -3.538
3 H3 CYS 1 3HT CYS 1 -11.105 -1.869 -2.159
4 HA CYS 1 HA CYS 1 -8.818 -1.268 -1.819
5 HB2 CYS 1 2HB CYS 1 -8.019 -3.502 -1.081
6 HB3 CYS 1 1HB CYS 1 -9.695 -3.227 -0.629
7 H VAL 2 H VAL 2 -6.528 -1.918 -2.350
8 HA VAL 2 HA VAL 2 -6.309 -2.348 -5.238
9 HB VAL 2 HB VAL 2 -4.184 -1.029 -5.142
10 HG11 VAL 2 1HG1 VAL 2 -5.264 1.164 -4.944
11 HG12 VAL 2 2HG1 VAL 2 -6.657 0.395 -4.183
12 HG13 VAL 2 3HG1 VAL 2 -6.247 0.018 -5.856
13 HG21 VAL 2 3HG2 VAL 2 -3.769 0.400 -3.198
14 HG22 VAL 2 1HG2 VAL 2 -3.661 -1.308 -2.775
15 HG23 VAL 2 2HG2 VAL 2 -5.097 -0.383 -2.341
16 H LEU 3 H LEU 3 -4.276 -3.347 -6.030
17 HA LEU 3 HA LEU 3 -3.693 -5.606 -4.282
18 HB2 LEU 3 2HB LEU 3 -3.066 -5.318 -7.208
19 HB3 LEU 3 1HB LEU 3 -3.060 -6.760 -6.215
20 HG LEU 3 HG LEU 3 -5.519 -5.215 -7.052
21 HD11 LEU 3 1HD1 LEU 3 -5.999 -7.152 -8.455
22 HD12 LEU 3 2HD1 LEU 3 -4.441 -7.849 -8.009
23 HD13 LEU 3 3HD1 LEU 3 -4.505 -6.339 -8.918
24 HD21 LEU 3 3HD2 LEU 3 -6.781 -7.127 -6.176
25 HD22 LEU 3 1HD2 LEU 3 -5.857 -6.321 -4.908
26 HD23 LEU 3 2HD2 LEU 3 -5.280 -7.845 -5.592
27 H ILE 4 H ILE 4 -1.334 -6.534 -5.039
28 HA ILE 4 HA ILE 4 0.531 -4.808 -3.886
29 HB ILE 4 HB ILE 4 2.299 -6.337 -4.724
30 HG12 ILE 4 2HG1 ILE 4 -0.007 -7.909 -5.888
31 HG13 ILE 4 1HG1 ILE 4 1.172 -7.006 -6.830
32 HG21 ILE 4 1HG2 ILE 4 1.278 -6.719 -2.584
33 HG22 ILE 4 2HG2 ILE 4 1.595 -8.265 -3.373
34 HG23 ILE 4 3HG2 ILE 4 -0.042 -7.612 -3.340
35 HD11 ILE 4 3HD1 ILE 4 1.680 -9.372 -6.820
36 HD12 ILE 4 1HD1 ILE 4 1.751 -9.369 -5.058
37 HD13 ILE 4 2HD1 ILE 4 2.945 -8.466 -5.990
38 H GLY 5 H GLY 5 2.104 -3.526 -4.583
39 HA2 GLY 5 2HA GLY 5 3.454 -2.352 -6.044
40 HA3 GLY 5 1HA GLY 5 2.711 -3.175 -7.401
41 H GLN 6 H GLN 6 0.087 -2.239 -5.948
42 HA GLN 6 HA GLN 6 -0.142 0.202 -7.486
43 HB2 GLN 6 2HB GLN 6 -2.127 -1.321 -5.792
44 HB3 GLN 6 1HB GLN 6 -2.517 0.067 -6.809
45 HG2 GLN 6 2HG GLN 6 -1.921 -1.198 -8.785
46 HG3 GLN 6 1HG GLN 6 -1.407 -2.552 -7.782
47 HE21 GLN 6 1HE2 GLN 6 -4.278 -0.641 -7.178
48 HE22 GLN 6 2HE2 GLN 6 -5.382 -1.928 -7.533
49 H ARG 7 H ARG 7 -0.981 2.125 -6.456
50 HA ARG 7 HA ARG 7 0.459 2.559 -3.996
51 HB2 ARG 7 2HB ARG 7 0.678 4.170 -5.854
52 HB3 ARG 7 1HB ARG 7 -1.043 4.515 -5.741
53 HG2 ARG 7 2HG ARG 7 -0.726 5.377 -3.483
54 HG3 ARG 7 1HG ARG 7 1.000 5.030 -3.593
55 HD2 ARG 7 2HD ARG 7 0.606 7.362 -4.040
56 HD3 ARG 7 1HD ARG 7 1.154 6.554 -5.505
57 HE ARG 7 HE ARG 7 -1.561 6.458 -5.662
58 HH11 ARG 7 1HH1 ARG 7 0.761 9.085 -5.268
59 HH12 ARG 7 2HH1 ARG 7 -0.187 10.233 -6.089
60 HH21 ARG 7 1HH2 ARG 7 -2.844 8.011 -6.783
61 HH22 ARG 7 2HH2 ARG 7 -2.291 9.616 -6.959
62 H CYS 8 H CYS 8 -0.398 2.875 -2.126
63 HA CYS 8 HA CYS 8 -3.313 2.932 -1.858
64 HB2 CYS 8 2HB CYS 8 -3.011 1.444 0.077
65 HB3 CYS 8 1HB CYS 8 -2.478 0.685 -1.421
66 H ASP 9 H ASP 9 -3.794 3.537 0.500
67 HA ASP 9 HA ASP 9 -1.766 5.091 1.848
68 HB2 ASP 9 2HB ASP 9 -2.988 6.724 0.319
69 HB3 ASP 9 1HB ASP 9 -4.454 6.337 1.230
70 H ASN 10 H ASN 10 -1.942 4.657 3.948
71 HA ASN 10 HA ASN 10 -4.015 2.848 4.794
72 HB2 ASN 10 2HB ASN 10 -1.784 4.099 6.411
73 HB3 ASN 10 1HB ASN 10 -2.883 2.867 6.996
74 HD21 ASN 10 1HD2 ASN 10 -0.130 3.543 4.967
75 HD22 ASN 10 2HD2 ASN 10 0.278 1.898 4.694
76 H ASP 11 H ASP 11 -3.552 6.221 4.927
77 HA ASP 11 HA ASP 11 -5.172 6.560 7.306
78 HB2 ASP 11 2HB ASP 11 -4.037 8.631 5.423
79 HB3 ASP 11 1HB ASP 11 -4.851 8.970 6.943
80 H ARG 12 H ARG 12 -5.362 7.617 3.925
81 HA ARG 12 HA ARG 12 -8.224 8.051 4.363
82 HB2 ARG 12 2HB ARG 12 -6.390 9.187 2.270
83 HB3 ARG 12 1HB ARG 12 -8.130 9.435 2.284
84 HG2 ARG 12 2HG ARG 12 -7.994 10.564 4.407
85 HG3 ARG 12 1HG ARG 12 -6.267 10.227 4.509
86 HD2 ARG 12 2HD ARG 12 -5.896 11.582 2.502
87 HD3 ARG 12 1HD ARG 12 -7.623 11.920 2.411
88 HE ARG 12 HE ARG 12 -7.382 12.985 4.611
89 HH11 ARG 12 1HH1 ARG 12 -4.507 12.724 2.516
90 HH12 ARG 12 2HH1 ARG 12 -3.708 14.046 3.211
91 HH21 ARG 12 1HH2 ARG 12 -6.245 14.851 5.562
92 HH22 ARG 12 2HH2 ARG 12 -4.700 15.254 4.984
93 H GLY 13 H GLY 13 -6.083 6.026 2.639
94 HA2 GLY 13 2HA GLY 13 -6.931 4.022 1.673
95 HA3 GLY 13 1HA GLY 13 -8.414 4.888 1.278
96 HA PRO 14 HA PRO 14 -8.265 3.051 -0.250
97 HB2 PRO 14 2HB PRO 14 -7.430 1.472 -2.253
98 HB3 PRO 14 1HB PRO 14 -8.538 2.818 -2.542
99 HG2 PRO 14 2HG PRO 14 -5.585 2.667 -2.995
100 HG3 PRO 14 1HG PRO 14 -6.838 3.385 -4.021
101 HD2 PRO 14 2HD PRO 14 -5.227 4.821 -2.323
102 HD3 PRO 14 1HD PRO 14 -6.836 5.348 -2.849
103 H ARG 15 H ARG 15 -7.793 0.903 0.511
104 HA ARG 15 HA ARG 15 -5.002 0.542 1.303
105 HB2 ARG 15 2HB ARG 15 -7.524 -0.621 2.489
106 HB3 ARG 15 1HB ARG 15 -5.902 -1.060 2.992
107 HG2 ARG 15 2HG ARG 15 -5.524 1.323 3.614
108 HG3 ARG 15 1HG ARG 15 -7.229 1.625 3.262
109 HD2 ARG 15 2HD ARG 15 -7.859 -0.075 4.916
110 HD3 ARG 15 1HD ARG 15 -6.156 -0.353 5.255
111 HE ARG 15 HE ARG 15 -6.973 2.370 5.604
112 HH11 ARG 15 1HH1 ARG 15 -6.692 -0.792 7.183
113 HH12 ARG 15 2HH1 ARG 15 -6.694 -0.151 8.758
114 HH21 ARG 15 1HH2 ARG 15 -6.945 3.228 7.773
115 HH22 ARG 15 2HH2 ARG 15 -6.860 2.167 9.100
116 H CYS 16 H CYS 16 -4.466 -1.848 1.592
117 HA CYS 16 HA CYS 16 -4.570 -3.004 -1.028
118 HB2 CYS 16 2HB CYS 16 -3.333 -4.009 1.521
119 HB3 CYS 16 1HB CYS 16 -2.926 -4.493 -0.126
120 H CYS 17 H CYS 17 -5.473 -4.974 -1.553
121 HA CYS 17 HA CYS 17 -7.676 -5.911 0.015
122 HB2 CYS 17 2HB CYS 17 -6.246 -7.308 -2.262
123 HB3 CYS 17 1HB CYS 17 -7.889 -7.585 -1.699
124 H SER 18 H SER 18 -7.772 -8.022 1.069
125 HA SER 18 HA SER 18 -5.455 -8.618 2.541
126 HB2 SER 18 2HB SER 18 -7.809 -8.920 3.370
127 HB3 SER 18 1HB SER 18 -7.973 -10.284 2.265
128 HG SER 18 HG SER 18 -7.353 -11.236 4.031
129 H GLY 19 H GLY 19 -3.824 -9.821 1.984
130 HA2 GLY 19 2HA GLY 19 -2.828 -11.792 1.076
131 HA3 GLY 19 1HA GLY 19 -4.158 -11.883 -0.082
132 H GLN 20 H GLN 20 -3.436 -8.734 0.129
133 HA GLN 20 HA GLN 20 -1.565 -8.871 -2.101
134 HB2 GLN 20 2HB GLN 20 -3.702 -6.855 -1.454
135 HB3 GLN 20 1HB GLN 20 -2.486 -6.628 -2.711
136 HG2 GLN 20 2HG GLN 20 -4.422 -8.921 -2.593
137 HG3 GLN 20 1HG GLN 20 -4.630 -7.467 -3.572
138 HE21 GLN 20 1HE2 GLN 20 -4.329 -10.269 -4.355
139 HE22 GLN 20 2HE2 GLN 20 -2.984 -10.285 -5.448
140 H GLY 21 H GLY 21 -0.744 -9.026 0.544
141 HA2 GLY 21 2HA GLY 21 1.162 -8.201 1.582
142 HA3 GLY 21 1HA GLY 21 1.135 -6.886 0.437
143 H ASN 22 H ASN 22 1.693 -5.601 2.132
144 HA ASN 22 HA ASN 22 -0.575 -4.698 3.790
145 HB2 ASN 22 2HB ASN 22 2.398 -4.551 4.418
146 HB3 ASN 22 1HB ASN 22 1.105 -3.916 5.415
147 HD21 ASN 22 1HD2 ASN 22 3.210 -5.911 5.925
148 HD22 ASN 22 2HD2 ASN 22 2.388 -7.295 6.533
149 H CYS 23 H CYS 23 -0.613 -2.356 3.967
150 HA CYS 23 HA CYS 23 0.447 -1.104 1.586
151 HB2 CYS 23 2HB CYS 23 -1.881 -0.608 2.308
152 HB3 CYS 23 1HB CYS 23 -1.256 0.046 3.815
153 H VAL 24 H VAL 24 2.559 -0.781 1.776
154 HA VAL 24 HA VAL 24 3.607 0.267 4.281
155 HB VAL 24 HB VAL 24 5.140 -0.559 1.851
156 HG11 VAL 24 1HG1 VAL 24 6.401 0.851 3.339
157 HG12 VAL 24 2HG1 VAL 24 7.048 -0.787 3.387
158 HG13 VAL 24 3HG1 VAL 24 6.031 -0.203 4.704
159 HG21 VAL 24 3HG2 VAL 24 4.467 -2.267 4.251
160 HG22 VAL 24 1HG2 VAL 24 5.593 -2.725 2.974
161 HG23 VAL 24 2HG2 VAL 24 3.882 -2.503 2.605
162 HA PRO 25 HA PRO 25 3.566 4.212 2.126
163 HB2 PRO 25 2HB PRO 25 4.775 5.325 4.531
164 HB3 PRO 25 1HB PRO 25 3.162 5.613 3.885
165 HG2 PRO 25 2HG PRO 25 3.657 4.208 6.187
166 HG3 PRO 25 1HG PRO 25 2.213 4.004 5.185
167 HD2 PRO 25 2HD PRO 25 4.652 2.258 5.342
168 HD3 PRO 25 1HD PRO 25 2.948 1.842 5.070
169 H LEU 26 H LEU 26 5.137 5.028 0.889
170 HA LEU 26 HA LEU 26 7.920 4.553 1.659
171 HB2 LEU 26 2HB LEU 26 6.731 3.978 -1.054
172 HB3 LEU 26 1HB LEU 26 8.443 3.964 -0.688
173 HG LEU 26 HG LEU 26 6.377 2.088 0.427
174 HD11 LEU 26 1HD1 LEU 26 8.644 1.646 -1.512
175 HD12 LEU 26 2HD1 LEU 26 6.930 1.687 -1.917
176 HD13 LEU 26 3HD1 LEU 26 7.562 0.400 -0.888
177 HD21 LEU 26 3HD2 LEU 26 8.107 2.491 2.080
178 HD22 LEU 26 1HD2 LEU 26 9.356 2.197 0.867
179 HD23 LEU 26 2HD2 LEU 26 8.299 0.884 1.383
180 HA PRO 27 HA PRO 27 9.049 8.705 0.861
181 HB2 PRO 27 2HB PRO 27 10.939 7.493 -1.131
182 HB3 PRO 27 1HB PRO 27 11.230 8.766 0.069
183 HG2 PRO 27 2HG PRO 27 11.990 6.298 0.584
184 HG3 PRO 27 1HG PRO 27 11.220 7.273 1.847
185 HD2 PRO 27 2HD PRO 27 10.099 4.993 0.287
186 HD3 PRO 27 1HD PRO 27 9.752 5.520 1.938
187 H PHE 28 H PHE 28 9.452 7.195 -2.367
188 HA PHE 28 HA PHE 28 8.139 9.581 -3.399
189 HB2 PHE 28 2HB PHE 28 9.113 8.880 -5.634
190 HB3 PHE 28 1HB PHE 28 10.232 9.411 -4.384
191 HD1 PHE 28 1HD PHE 28 8.990 6.505 -6.270
192 HD2 PHE 28 2HD PHE 28 11.869 7.955 -3.495
193 HE1 PHE 28 1HE PHE 28 10.307 4.449 -6.557
194 HE2 PHE 28 2HE PHE 28 13.182 5.899 -3.777
195 HZ PHE 28 HZ PHE 28 12.408 4.156 -5.292
196 H LEU 29 H LEU 29 7.667 6.271 -3.163
197 HA LEU 29 HA LEU 29 5.626 6.197 -5.219
198 HB2 LEU 29 2HB LEU 29 6.390 4.121 -3.167
199 HB3 LEU 29 1HB LEU 29 5.198 3.879 -4.425
200 HG LEU 29 HG LEU 29 8.139 4.397 -4.892
201 HD11 LEU 29 1HD1 LEU 29 6.522 1.869 -5.135
202 HD12 LEU 29 2HD1 LEU 29 7.758 2.208 -3.922
203 HD13 LEU 29 3HD1 LEU 29 8.204 2.065 -5.621
204 HD21 LEU 29 3HD2 LEU 29 7.633 3.802 -7.220
205 HD22 LEU 29 1HD2 LEU 29 6.764 5.252 -6.718
206 HD23 LEU 29 2HD2 LEU 29 5.920 3.706 -6.817
207 H GLY 30 H GLY 30 5.702 7.179 -1.993
208 HA2 GLY 30 2HA GLY 30 3.974 8.156 -0.809
209 HA3 GLY 30 1HA GLY 30 2.823 7.502 -1.976
210 H GLY 31 H GLY 31 2.772 5.096 -1.971
211 HA2 GLY 31 2HA GLY 31 3.527 3.562 0.212
212 HA3 GLY 31 1HA GLY 31 1.856 4.082 0.461
213 H VAL 32 H VAL 32 3.253 1.536 -0.307
214 HA VAL 32 HA VAL 32 1.380 0.926 -2.473
215 HB VAL 32 HB VAL 32 2.985 -0.493 -3.682
216 HG11 VAL 32 1HG1 VAL 32 3.878 2.368 -3.489
217 HG12 VAL 32 2HG1 VAL 32 2.619 1.708 -4.541
218 HG13 VAL 32 3HG1 VAL 32 4.300 1.243 -4.783
219 HG21 VAL 32 3HG2 VAL 32 5.066 0.672 -1.839
220 HG22 VAL 32 1HG2 VAL 32 5.409 -0.280 -3.287
221 HG23 VAL 32 2HG2 VAL 32 4.555 -1.013 -1.930
222 H CYS 33 H CYS 33 0.782 -1.154 -2.653
223 HA CYS 33 HA CYS 33 0.792 -2.667 -0.230
224 HB2 CYS 33 2HB CYS 33 -0.280 -3.267 -2.981
225 HB3 CYS 33 1HB CYS 33 -0.634 -4.204 -1.522
226 H ALA 34 H ALA 34 2.372 -3.990 0.299
227 HA ALA 34 HA ALA 34 3.828 -5.383 -1.813
228 HB1 ALA 34 1HB ALA 34 5.173 -3.447 -1.173
229 HB2 ALA 34 2HB ALA 34 5.941 -4.944 -0.641
230 HB3 ALA 34 3HB ALA 34 5.082 -3.932 0.519
231 H VAL 35 H VAL 35 4.051 -7.479 -1.354
232 HA VAL 35 HA VAL 35 3.257 -8.306 1.292
233 HB VAL 35 HB VAL 35 1.955 -9.388 -0.453
234 HG11 VAL 35 1HG1 VAL 35 2.917 -10.934 -2.097
235 HG12 VAL 35 2HG1 VAL 35 4.533 -10.446 -1.588
236 HG13 VAL 35 3HG1 VAL 35 3.450 -9.271 -2.332
237 HG21 VAL 35 3HG2 VAL 35 2.398 -10.708 1.533
238 HG22 VAL 35 1HG2 VAL 35 3.872 -11.345 0.806
239 HG23 VAL 35 2HG2 VAL 35 2.300 -11.756 0.119
Start of MODEL 3
1 H1 CYS 1 1HT CYS 1 -10.415 -1.184 -3.512
2 H2 CYS 1 2HT CYS 1 -11.054 -1.909 -2.112
3 H3 CYS 1 3HT CYS 1 -10.561 -2.853 -3.422
4 HA CYS 1 HA CYS 1 -8.762 -1.187 -1.831
5 HB2 CYS 1 2HB CYS 1 -7.931 -3.398 -1.017
6 HB3 CYS 1 1HB CYS 1 -9.577 -3.057 -0.505
7 H VAL 2 H VAL 2 -6.522 -1.619 -2.407
8 HA VAL 2 HA VAL 2 -6.282 -2.275 -5.236
9 HB VAL 2 HB VAL 2 -4.057 -1.065 -5.132
10 HG11 VAL 2 1HG1 VAL 2 -6.010 0.000 -6.070
11 HG12 VAL 2 2HG1 VAL 2 -5.068 1.182 -5.160
12 HG13 VAL 2 3HG1 VAL 2 -6.541 0.503 -4.467
13 HG21 VAL 2 3HG2 VAL 2 -3.692 -1.173 -2.720
14 HG22 VAL 2 1HG2 VAL 2 -5.113 -0.164 -2.451
15 HG23 VAL 2 2HG2 VAL 2 -3.704 0.501 -3.275
16 H LEU 3 H LEU 3 -4.147 -3.156 -5.904
17 HA LEU 3 HA LEU 3 -3.758 -5.551 -4.245
18 HB2 LEU 3 2HB LEU 3 -3.238 -5.321 -7.201
19 HB3 LEU 3 1HB LEU 3 -3.358 -6.765 -6.207
20 HG LEU 3 HG LEU 3 -5.684 -4.944 -6.844
21 HD11 LEU 3 1HD1 LEU 3 -4.879 -6.015 -8.852
22 HD12 LEU 3 2HD1 LEU 3 -6.420 -6.710 -8.353
23 HD13 LEU 3 3HD1 LEU 3 -4.917 -7.584 -8.051
24 HD21 LEU 3 3HD2 LEU 3 -5.570 -7.683 -5.578
25 HD22 LEU 3 1HD2 LEU 3 -7.042 -6.819 -6.028
26 HD23 LEU 3 2HD2 LEU 3 -5.993 -6.168 -4.774
27 H ILE 4 H ILE 4 -1.536 -6.671 -5.044
28 HA ILE 4 HA ILE 4 0.546 -5.183 -3.958
29 HB ILE 4 HB ILE 4 2.102 -6.860 -4.980
30 HG12 ILE 4 2HG1 ILE 4 -0.463 -8.080 -6.049
31 HG13 ILE 4 1HG1 ILE 4 0.801 -7.342 -7.023
32 HG21 ILE 4 1HG2 ILE 4 1.205 -7.196 -2.771
33 HG22 ILE 4 2HG2 ILE 4 1.299 -8.741 -3.619
34 HG23 ILE 4 3HG2 ILE 4 -0.254 -7.924 -3.443
35 HD11 ILE 4 3HD1 ILE 4 1.082 -9.818 -5.336
36 HD12 ILE 4 1HD1 ILE 4 2.355 -9.088 -6.313
37 HD13 ILE 4 2HD1 ILE 4 0.924 -9.765 -7.092
38 H GLY 5 H GLY 5 2.038 -3.844 -4.629
39 HA2 GLY 5 2HA GLY 5 3.499 -2.782 -6.107
40 HA3 GLY 5 1HA GLY 5 2.682 -3.551 -7.454
41 H GLN 6 H GLN 6 0.130 -2.558 -6.089
42 HA GLN 6 HA GLN 6 -0.000 -0.101 -7.565
43 HB2 GLN 6 2HB GLN 6 -2.036 -1.641 -5.953
44 HB3 GLN 6 1HB GLN 6 -2.402 -0.161 -6.835
45 HG2 GLN 6 2HG GLN 6 -1.816 -1.226 -8.933
46 HG3 GLN 6 1HG GLN 6 -1.321 -2.679 -8.077
47 HE21 GLN 6 1HE2 GLN 6 -2.761 -3.914 -9.249
48 HE22 GLN 6 2HE2 GLN 6 -4.467 -3.862 -8.979
49 H ARG 7 H ARG 7 -0.954 1.804 -6.546
50 HA ARG 7 HA ARG 7 0.694 2.489 -4.272
51 HB2 ARG 7 2HB ARG 7 0.685 3.929 -6.196
52 HB3 ARG 7 1HB ARG 7 -1.059 4.071 -6.138
53 HG2 ARG 7 2HG ARG 7 -0.811 5.210 -3.928
54 HG3 ARG 7 1HG ARG 7 0.936 5.219 -4.204
55 HD2 ARG 7 2HD ARG 7 -0.131 7.316 -4.904
56 HD3 ARG 7 1HD ARG 7 0.630 6.479 -6.258
57 HE ARG 7 HE ARG 7 -2.236 6.193 -5.702
58 HH11 ARG 7 1HH1 ARG 7 0.312 7.241 -7.940
59 HH12 ARG 7 2HH1 ARG 7 -0.734 7.402 -9.267
60 HH21 ARG 7 1HH2 ARG 7 -3.635 6.362 -7.544
61 HH22 ARG 7 2HH2 ARG 7 -3.006 6.866 -9.054
62 H CYS 8 H CYS 8 -0.056 2.754 -2.294
63 HA CYS 8 HA CYS 8 -2.960 2.840 -1.895
64 HB2 CYS 8 2HB CYS 8 -2.689 1.376 0.026
65 HB3 CYS 8 1HB CYS 8 -2.092 0.591 -1.432
66 H ASP 9 H ASP 9 -3.436 3.490 0.393
67 HA ASP 9 HA ASP 9 -1.456 5.150 1.720
68 HB2 ASP 9 2HB ASP 9 -2.821 6.632 0.145
69 HB3 ASP 9 1HB ASP 9 -4.225 6.179 1.110
70 H ASN 10 H ASN 10 -1.531 4.555 3.719
71 HA ASN 10 HA ASN 10 -3.163 2.512 4.691
72 HB2 ASN 10 2HB ASN 10 -1.415 4.440 6.225
73 HB3 ASN 10 1HB ASN 10 -2.145 2.995 6.909
74 HD21 ASN 10 1HD2 ASN 10 -1.253 0.992 6.430
75 HD22 ASN 10 2HD2 ASN 10 0.232 0.835 5.566
76 H ASP 11 H ASP 11 -3.380 5.978 5.232
77 HA ASP 11 HA ASP 11 -5.555 5.520 7.109
78 HB2 ASP 11 2HB ASP 11 -3.859 7.116 7.773
79 HB3 ASP 11 1HB ASP 11 -4.165 8.069 6.327
80 H ARG 12 H ARG 12 -5.056 7.429 4.139
81 HA ARG 12 HA ARG 12 -7.840 8.216 4.157
82 HB2 ARG 12 2HB ARG 12 -5.669 8.790 2.157
83 HB3 ARG 12 1HB ARG 12 -7.239 9.574 2.245
84 HG2 ARG 12 2HG ARG 12 -6.676 10.656 4.287
85 HG3 ARG 12 1HG ARG 12 -5.221 9.672 4.466
86 HD2 ARG 12 2HD ARG 12 -5.736 11.670 2.271
87 HD3 ARG 12 1HD ARG 12 -4.682 11.920 3.666
88 HE ARG 12 HE ARG 12 -3.649 9.697 2.645
89 HH11 ARG 12 1HH1 ARG 12 -4.502 12.737 1.046
90 HH12 ARG 12 2HH1 ARG 12 -3.362 12.551 -0.198
91 HH21 ARG 12 1HH2 ARG 12 -2.092 9.473 0.972
92 HH22 ARG 12 2HH2 ARG 12 -1.965 10.642 -0.274
93 H GLY 13 H GLY 13 -5.793 5.983 2.480
94 HA2 GLY 13 2HA GLY 13 -6.733 4.107 1.349
95 HA3 GLY 13 1HA GLY 13 -8.129 5.106 0.946
96 HA PRO 14 HA PRO 14 -7.934 3.287 -0.719
97 HB2 PRO 14 2HB PRO 14 -6.858 1.729 -2.633
98 HB3 PRO 14 1HB PRO 14 -7.957 3.057 -3.016
99 HG2 PRO 14 2HG PRO 14 -4.977 2.958 -3.187
100 HG3 PRO 14 1HG PRO 14 -6.138 3.690 -4.306
101 HD2 PRO 14 2HD PRO 14 -4.706 5.103 -2.445
102 HD3 PRO 14 1HD PRO 14 -6.277 5.620 -3.086
103 H ARG 15 H ARG 15 -7.621 1.172 0.025
104 HA ARG 15 HA ARG 15 -5.005 0.714 1.248
105 HB2 ARG 15 2HB ARG 15 -7.789 -0.046 2.102
106 HB3 ARG 15 1HB ARG 15 -6.351 -0.741 2.835
107 HG2 ARG 15 2HG ARG 15 -5.628 1.459 3.556
108 HG3 ARG 15 1HG ARG 15 -7.029 2.193 2.774
109 HD2 ARG 15 2HD ARG 15 -8.515 0.989 4.248
110 HD3 ARG 15 1HD ARG 15 -7.144 0.148 4.975
111 HE ARG 15 HE ARG 15 -6.411 2.544 5.551
112 HH11 ARG 15 1HH1 ARG 15 -9.734 1.379 5.587
113 HH12 ARG 15 2HH1 ARG 15 -10.251 2.455 6.793
114 HH21 ARG 15 1HH2 ARG 15 -7.074 3.982 7.208
115 HH22 ARG 15 2HH2 ARG 15 -8.689 4.014 7.747
116 H CYS 16 H CYS 16 -4.362 -1.472 1.426
117 HA CYS 16 HA CYS 16 -4.543 -2.848 -1.063
118 HB2 CYS 16 2HB CYS 16 -3.216 -3.591 1.531
119 HB3 CYS 16 1HB CYS 16 -2.878 -4.276 -0.060
120 H CYS 17 H CYS 17 -5.469 -4.812 -1.473
121 HA CYS 17 HA CYS 17 -7.651 -5.640 0.135
122 HB2 CYS 17 2HB CYS 17 -6.229 -7.197 -2.031
123 HB3 CYS 17 1HB CYS 17 -7.842 -7.506 -1.410
124 H SER 18 H SER 18 -7.852 -7.891 1.015
125 HA SER 18 HA SER 18 -6.276 -8.185 3.203
126 HB2 SER 18 2HB SER 18 -8.481 -9.202 2.996
127 HB3 SER 18 1HB SER 18 -7.862 -10.353 1.815
128 HG SER 18 HG SER 18 -6.989 -10.101 4.501
129 H GLY 19 H GLY 19 -5.952 -10.228 0.274
130 HA2 GLY 19 2HA GLY 19 -3.505 -11.333 1.428
131 HA3 GLY 19 1HA GLY 19 -4.380 -11.970 0.045
132 H GLN 20 H GLN 20 -3.638 -8.608 0.337
133 HA GLN 20 HA GLN 20 -1.770 -8.912 -1.891
134 HB2 GLN 20 2HB GLN 20 -3.624 -6.645 -1.201
135 HB3 GLN 20 1HB GLN 20 -2.428 -6.544 -2.480
136 HG2 GLN 20 2HG GLN 20 -4.675 -8.542 -2.337
137 HG3 GLN 20 1HG GLN 20 -4.677 -7.081 -3.324
138 HE21 GLN 20 1HE2 GLN 20 -4.953 -9.831 -4.136
139 HE22 GLN 20 2HE2 GLN 20 -3.663 -10.163 -5.228
140 H GLY 21 H GLY 21 -1.157 -9.103 0.943
141 HA2 GLY 21 2HA GLY 21 0.903 -8.559 1.983
142 HA3 GLY 21 1HA GLY 21 1.042 -7.247 0.851
143 H ASN 22 H ASN 22 1.531 -5.747 2.224
144 HA ASN 22 HA ASN 22 -0.671 -4.752 3.858
145 HB2 ASN 22 2HB ASN 22 0.847 -4.056 5.608
146 HB3 ASN 22 1HB ASN 22 1.110 -5.772 5.342
147 HD21 ASN 22 1HD2 ASN 22 3.094 -6.431 4.423
148 HD22 ASN 22 2HD2 ASN 22 4.457 -5.369 4.368
149 H CYS 23 H CYS 23 -0.580 -2.424 4.010
150 HA CYS 23 HA CYS 23 0.493 -1.284 1.600
151 HB2 CYS 23 2HB CYS 23 -1.766 -0.641 2.343
152 HB3 CYS 23 1HB CYS 23 -1.102 -0.039 3.857
153 H VAL 24 H VAL 24 2.600 -1.060 1.712
154 HA VAL 24 HA VAL 24 3.710 0.044 4.137
155 HB VAL 24 HB VAL 24 4.788 -2.010 3.365
156 HG11 VAL 24 1HG1 VAL 24 4.346 -1.906 0.998
157 HG12 VAL 24 2HG1 VAL 24 6.067 -2.143 1.285
158 HG13 VAL 24 3HG1 VAL 24 5.460 -0.552 0.824
159 HG21 VAL 24 3HG2 VAL 24 6.573 0.390 3.009
160 HG22 VAL 24 1HG2 VAL 24 7.125 -1.257 3.308
161 HG23 VAL 24 2HG2 VAL 24 6.178 -0.409 4.530
162 HA PRO 25 HA PRO 25 3.654 3.894 1.953
163 HB2 PRO 25 2HB PRO 25 5.187 5.008 4.181
164 HB3 PRO 25 1HB PRO 25 3.544 5.385 3.662
165 HG2 PRO 25 2HG PRO 25 4.104 4.034 5.950
166 HG3 PRO 25 1HG PRO 25 2.610 3.814 5.027
167 HD2 PRO 25 2HD PRO 25 5.036 2.083 5.143
168 HD3 PRO 25 1HD PRO 25 3.309 1.662 5.021
169 H LEU 26 H LEU 26 4.985 4.929 0.661
170 HA LEU 26 HA LEU 26 7.858 4.386 0.831
171 HB2 LEU 26 2HB LEU 26 6.002 4.269 -1.500
172 HB3 LEU 26 1HB LEU 26 7.617 4.855 -1.794
173 HG LEU 26 HG LEU 26 8.528 2.702 -0.964
174 HD11 LEU 26 1HD1 LEU 26 7.041 0.790 -0.688
175 HD12 LEU 26 2HD1 LEU 26 5.649 1.874 -0.807
176 HD13 LEU 26 3HD1 LEU 26 6.779 2.031 0.535
177 HD21 LEU 26 3HD2 LEU 26 6.505 2.466 -3.175
178 HD22 LEU 26 1HD2 LEU 26 7.843 1.356 -2.880
179 HD23 LEU 26 2HD2 LEU 26 8.171 3.030 -3.327
180 HA PRO 27 HA PRO 27 8.633 8.640 1.530
181 HB2 PRO 27 2HB PRO 27 10.607 8.254 -0.685
182 HB3 PRO 27 1HB PRO 27 10.811 9.082 0.864
183 HG2 PRO 27 2HG PRO 27 11.725 6.614 0.564
184 HG3 PRO 27 1HG PRO 27 10.924 7.096 2.068
185 HD2 PRO 27 2HD PRO 27 9.932 5.345 -0.117
186 HD3 PRO 27 1HD PRO 27 9.538 5.340 1.613
187 H PHE 28 H PHE 28 8.838 7.990 -1.989
188 HA PHE 28 HA PHE 28 7.638 10.637 -2.479
189 HB2 PHE 28 2HB PHE 28 8.773 8.693 -4.476
190 HB3 PHE 28 1HB PHE 28 8.267 10.339 -4.791
191 HD1 PHE 28 2HD PHE 28 9.620 12.216 -3.866
192 HD2 PHE 28 1HD PHE 28 10.863 8.166 -3.695
193 HE1 PHE 28 2HE PHE 28 11.943 12.941 -3.506
194 HE2 PHE 28 1HE PHE 28 13.176 8.874 -3.342
195 HZ PHE 28 HZ PHE 28 13.720 11.233 -3.257
196 H LEU 29 H LEU 29 7.184 7.217 -3.110
197 HA LEU 29 HA LEU 29 5.098 7.699 -4.996
198 HB2 LEU 29 2HB LEU 29 5.760 5.046 -3.743
199 HB3 LEU 29 1HB LEU 29 4.936 5.330 -5.259
200 HG LEU 29 HG LEU 29 7.852 5.625 -4.627
201 HD11 LEU 29 1HD1 LEU 29 7.167 3.442 -5.254
202 HD12 LEU 29 2HD1 LEU 29 8.180 4.164 -6.503
203 HD13 LEU 29 3HD1 LEU 29 6.432 4.062 -6.736
204 HD21 LEU 29 3HD2 LEU 29 7.362 7.634 -5.856
205 HD22 LEU 29 1HD2 LEU 29 6.473 6.727 -7.088
206 HD23 LEU 29 2HD2 LEU 29 8.218 6.518 -6.896
207 H GLY 30 H GLY 30 5.115 7.519 -1.637
208 HA2 GLY 30 2HA GLY 30 3.196 8.098 -0.387
209 HA3 GLY 30 1HA GLY 30 2.194 7.406 -1.662
210 H GLY 31 H GLY 31 2.688 5.054 -2.064
211 HA2 GLY 31 2HA GLY 31 3.814 3.403 -0.155
212 HA3 GLY 31 1HA GLY 31 2.116 3.617 0.274
213 H VAL 32 H VAL 32 3.335 1.221 -0.511
214 HA VAL 32 HA VAL 32 1.594 0.625 -2.778
215 HB VAL 32 HB VAL 32 3.194 -0.862 -3.880
216 HG11 VAL 32 1HG1 VAL 32 4.281 1.924 -3.640
217 HG12 VAL 32 2HG1 VAL 32 3.064 1.338 -4.779
218 HG13 VAL 32 3HG1 VAL 32 4.723 0.753 -4.885
219 HG21 VAL 32 3HG2 VAL 32 4.603 -1.488 -2.011
220 HG22 VAL 32 1HG2 VAL 32 5.258 0.148 -1.923
221 HG23 VAL 32 2HG2 VAL 32 5.589 -0.862 -3.332
222 H CYS 33 H CYS 33 0.899 -1.476 -2.867
223 HA CYS 33 HA CYS 33 0.793 -2.844 -0.332
224 HB2 CYS 33 2HB CYS 33 -0.295 -3.610 -3.039
225 HB3 CYS 33 1HB CYS 33 -0.756 -4.326 -1.492
226 H ALA 34 H ALA 34 2.150 -4.481 0.266
227 HA ALA 34 HA ALA 34 3.473 -6.015 -1.803
228 HB1 ALA 34 1HB ALA 34 4.970 -4.104 -1.453
229 HB2 ALA 34 2HB ALA 34 5.704 -5.605 -0.892
230 HB3 ALA 34 3HB ALA 34 5.027 -4.466 0.272
231 H VAL 35 H VAL 35 3.821 -8.052 -1.173
232 HA VAL 35 HA VAL 35 3.363 -8.635 1.627
233 HB VAL 35 HB VAL 35 1.534 -9.569 0.300
234 HG11 VAL 35 1HG1 VAL 35 1.837 -11.280 -1.392
235 HG12 VAL 35 2HG1 VAL 35 3.580 -11.059 -1.286
236 HG13 VAL 35 3HG1 VAL 35 2.560 -9.739 -1.860
237 HG21 VAL 35 3HG2 VAL 35 3.394 -11.747 1.234
238 HG22 VAL 35 1HG2 VAL 35 1.667 -11.936 0.934
239 HG23 VAL 35 2HG2 VAL 35 2.228 -10.871 2.224
Start of MODEL 4
1 H1 CYS 1 1HT CYS 1 -10.050 -0.858 -3.610
2 H2 CYS 1 2HT CYS 1 -10.820 -1.656 -2.327
3 H3 CYS 1 3HT CYS 1 -10.377 -2.492 -3.738
4 HA CYS 1 HA CYS 1 -8.432 -1.210 -1.978
5 HB2 CYS 1 2HB CYS 1 -7.863 -3.517 -1.289
6 HB3 CYS 1 1HB CYS 1 -9.480 -3.063 -0.782
7 H VAL 2 H VAL 2 -6.285 -1.676 -2.572
8 HA VAL 2 HA VAL 2 -6.054 -2.320 -5.410
9 HB VAL 2 HB VAL 2 -3.863 -1.131 -5.359
10 HG11 VAL 2 1HG1 VAL 2 -5.850 0.030 -6.116
11 HG12 VAL 2 2HG1 VAL 2 -4.781 1.133 -5.250
12 HG13 VAL 2 3HG1 VAL 2 -6.225 0.502 -4.459
13 HG21 VAL 2 3HG2 VAL 2 -3.330 0.322 -3.483
14 HG22 VAL 2 1HG2 VAL 2 -3.357 -1.368 -2.984
15 HG23 VAL 2 2HG2 VAL 2 -4.714 -0.310 -2.585
16 H LEU 3 H LEU 3 -3.814 -3.210 -5.996
17 HA LEU 3 HA LEU 3 -3.443 -5.556 -4.286
18 HB2 LEU 3 2HB LEU 3 -2.746 -5.280 -7.197
19 HB3 LEU 3 1HB LEU 3 -2.873 -6.740 -6.249
20 HG LEU 3 HG LEU 3 -5.185 -4.990 -7.071
21 HD11 LEU 3 1HD1 LEU 3 -4.310 -7.670 -8.100
22 HD12 LEU 3 2HD1 LEU 3 -4.190 -6.133 -8.956
23 HD13 LEU 3 3HD1 LEU 3 -5.774 -6.808 -8.571
24 HD21 LEU 3 3HD2 LEU 3 -6.589 -6.829 -6.270
25 HD22 LEU 3 1HD2 LEU 3 -5.626 -6.132 -4.970
26 HD23 LEU 3 2HD2 LEU 3 -5.152 -7.673 -5.691
27 H ILE 4 H ILE 4 -1.105 -6.528 -4.959
28 HA ILE 4 HA ILE 4 0.781 -4.823 -3.813
29 HB ILE 4 HB ILE 4 2.538 -6.424 -4.572
30 HG12 ILE 4 2HG1 ILE 4 0.210 -7.924 -5.808
31 HG13 ILE 4 1HG1 ILE 4 1.485 -7.109 -6.705
32 HG21 ILE 4 1HG2 ILE 4 1.749 -8.301 -3.211
33 HG22 ILE 4 2HG2 ILE 4 0.124 -7.616 -3.236
34 HG23 ILE 4 3HG2 ILE 4 1.439 -6.737 -2.457
35 HD11 ILE 4 3HD1 ILE 4 1.840 -9.473 -4.870
36 HD12 ILE 4 1HD1 ILE 4 3.126 -8.663 -5.766
37 HD13 ILE 4 2HD1 ILE 4 1.846 -9.511 -6.634
38 H GLY 5 H GLY 5 2.215 -3.441 -4.458
39 HA2 GLY 5 2HA GLY 5 3.709 -2.415 -5.912
40 HA3 GLY 5 1HA GLY 5 2.896 -3.119 -7.292
41 H GLN 6 H GLN 6 0.306 -2.243 -5.979
42 HA GLN 6 HA GLN 6 0.232 0.335 -7.259
43 HB2 GLN 6 2HB GLN 6 -1.835 -1.370 -5.935
44 HB3 GLN 6 1HB GLN 6 -2.185 0.212 -6.593
45 HG2 GLN 6 2HG GLN 6 -1.820 -0.445 -8.784
46 HG3 GLN 6 1HG GLN 6 -0.909 -1.874 -8.303
47 HE21 GLN 6 1HE2 GLN 6 -4.119 -0.513 -8.579
48 HE22 GLN 6 2HE2 GLN 6 -4.919 -2.048 -8.461
49 H ARG 7 H ARG 7 -0.566 2.138 -6.239
50 HA ARG 7 HA ARG 7 0.561 2.423 -3.580
51 HB2 ARG 7 2HB ARG 7 0.473 4.817 -3.932
52 HB3 ARG 7 1HB ARG 7 1.207 4.044 -5.322
53 HG2 ARG 7 2HG ARG 7 -0.971 4.212 -6.500
54 HG3 ARG 7 1HG ARG 7 -1.584 5.110 -5.109
55 HD2 ARG 7 2HD ARG 7 0.763 5.913 -6.824
56 HD3 ARG 7 1HD ARG 7 -0.847 6.614 -6.917
57 HE ARG 7 HE ARG 7 0.027 6.837 -4.294
58 HH11 ARG 7 1HH1 ARG 7 0.881 8.125 -7.467
59 HH12 ARG 7 2HH1 ARG 7 1.502 9.592 -6.868
60 HH21 ARG 7 1HH2 ARG 7 0.952 8.821 -3.464
61 HH22 ARG 7 2HH2 ARG 7 1.576 9.982 -4.538
62 H CYS 8 H CYS 8 -0.503 3.261 -1.848
63 HA CYS 8 HA CYS 8 -3.401 3.333 -1.964
64 HB2 CYS 8 2HB CYS 8 -3.466 1.744 -0.044
65 HB3 CYS 8 1HB CYS 8 -2.957 1.011 -1.561
66 H ASP 9 H ASP 9 -4.160 3.777 0.406
67 HA ASP 9 HA ASP 9 -2.251 5.343 1.944
68 HB2 ASP 9 2HB ASP 9 -3.491 6.925 0.360
69 HB3 ASP 9 1HB ASP 9 -4.962 6.408 1.200
70 H ASN 10 H ASN 10 -2.433 4.513 3.835
71 HA ASN 10 HA ASN 10 -4.432 2.744 4.720
72 HB2 ASN 10 2HB ASN 10 -2.281 4.217 6.179
73 HB3 ASN 10 1HB ASN 10 -3.426 3.202 7.039
74 HD21 ASN 10 1HD2 ASN 10 -0.542 3.016 6.658
75 HD22 ASN 10 2HD2 ASN 10 -0.241 1.448 5.999
76 H ASP 11 H ASP 11 -4.186 6.182 5.033
77 HA ASP 11 HA ASP 11 -6.016 6.306 7.263
78 HB2 ASP 11 2HB ASP 11 -4.848 8.538 5.594
79 HB3 ASP 11 1HB ASP 11 -5.734 8.730 7.101
80 H ARG 12 H ARG 12 -5.975 7.490 3.965
81 HA ARG 12 HA ARG 12 -8.802 8.194 4.169
82 HB2 ARG 12 2HB ARG 12 -6.711 8.857 2.125
83 HB3 ARG 12 1HB ARG 12 -8.366 9.454 2.115
84 HG2 ARG 12 2HG ARG 12 -8.035 10.760 4.019
85 HG3 ARG 12 1HG ARG 12 -6.571 9.883 4.467
86 HD2 ARG 12 2HD ARG 12 -6.859 11.604 2.017
87 HD3 ARG 12 1HD ARG 12 -6.131 12.130 3.537
88 HE ARG 12 HE ARG 12 -4.898 9.753 2.657
89 HH11 ARG 12 1HH1 ARG 12 -5.055 13.199 1.829
90 HH12 ARG 12 2HH1 ARG 12 -3.489 13.272 1.196
91 HH21 ARG 12 1HH2 ARG 12 -2.740 9.851 1.775
92 HH22 ARG 12 2HH2 ARG 12 -2.119 11.331 1.163
93 H GLY 13 H GLY 13 -6.784 5.836 2.736
94 HA2 GLY 13 2HA GLY 13 -7.530 3.914 1.691
95 HA3 GLY 13 1HA GLY 13 -9.056 4.702 1.311
96 HA PRO 14 HA PRO 14 -8.610 2.746 -0.097
97 HB2 PRO 14 2HB PRO 14 -7.739 1.262 -2.132
98 HB3 PRO 14 1HB PRO 14 -8.946 2.527 -2.396
99 HG2 PRO 14 2HG PRO 14 -6.014 2.559 -2.965
100 HG3 PRO 14 1HG PRO 14 -7.349 3.203 -3.935
101 HD2 PRO 14 2HD PRO 14 -5.742 4.699 -2.238
102 HD3 PRO 14 1HD PRO 14 -7.351 5.181 -2.806
103 H ARG 15 H ARG 15 -7.773 0.578 0.442
104 HA ARG 15 HA ARG 15 -4.882 0.610 0.955
105 HB2 ARG 15 2HB ARG 15 -6.982 -0.835 2.584
106 HB3 ARG 15 1HB ARG 15 -5.251 -0.935 2.847
107 HG2 ARG 15 2HG ARG 15 -5.257 1.518 3.280
108 HG3 ARG 15 1HG ARG 15 -7.019 1.466 3.212
109 HD2 ARG 15 2HD ARG 15 -6.368 1.319 5.516
110 HD3 ARG 15 1HD ARG 15 -6.967 -0.264 5.018
111 HE ARG 15 HE ARG 15 -4.096 0.408 5.175
112 HH11 ARG 15 1HH1 ARG 15 -6.732 -1.877 5.861
113 HH12 ARG 15 2HH1 ARG 15 -5.710 -3.064 6.511
114 HH21 ARG 15 1HH2 ARG 15 -2.715 -1.203 6.134
115 HH22 ARG 15 2HH2 ARG 15 -3.367 -2.680 6.642
116 H CYS 16 H CYS 16 -4.153 -1.789 1.336
117 HA CYS 16 HA CYS 16 -4.318 -3.139 -1.120
118 HB2 CYS 16 2HB CYS 16 -3.462 -4.201 1.559
119 HB3 CYS 16 1HB CYS 16 -2.937 -4.751 -0.034
120 H CYS 17 H CYS 17 -5.471 -4.945 -1.706
121 HA CYS 17 HA CYS 17 -7.779 -5.748 -0.229
122 HB2 CYS 17 2HB CYS 17 -6.301 -7.215 -2.441
123 HB3 CYS 17 1HB CYS 17 -7.923 -7.581 -1.887
124 H SER 18 H SER 18 -8.058 -7.821 0.813
125 HA SER 18 HA SER 18 -6.045 -8.552 2.578
126 HB2 SER 18 2HB SER 18 -8.480 -8.868 2.949
127 HB3 SER 18 1HB SER 18 -8.495 -10.102 1.694
128 HG SER 18 HG SER 18 -8.167 -11.352 3.303
129 H GLY 19 H GLY 19 -4.225 -9.525 2.054
130 HA2 GLY 19 2HA GLY 19 -3.092 -11.536 1.396
131 HA3 GLY 19 1HA GLY 19 -4.270 -11.724 0.099
132 H GLN 20 H GLN 20 -3.593 -8.539 0.206
133 HA GLN 20 HA GLN 20 -1.536 -8.788 -1.868
134 HB2 GLN 20 2HB GLN 20 -3.587 -6.635 -1.372
135 HB3 GLN 20 1HB GLN 20 -2.335 -6.528 -2.600
136 HG2 GLN 20 2HG GLN 20 -4.441 -8.662 -2.449
137 HG3 GLN 20 1HG GLN 20 -4.510 -7.239 -3.486
138 HE21 GLN 20 1HE2 GLN 20 -4.449 -10.091 -4.118
139 HE22 GLN 20 2HE2 GLN 20 -3.112 -10.308 -5.183
140 H GLY 21 H GLY 21 -0.934 -8.812 0.931
141 HA2 GLY 21 2HA GLY 21 0.968 -7.968 2.038
142 HA3 GLY 21 1HA GLY 21 1.034 -6.742 0.809
143 H ASN 22 H ASN 22 1.312 -5.079 2.018
144 HA ASN 22 HA ASN 22 -0.951 -3.998 3.467
145 HB2 ASN 22 2HB ASN 22 0.496 -5.220 5.182
146 HB3 ASN 22 1HB ASN 22 1.826 -4.214 4.661
147 HD21 ASN 22 1HD2 ASN 22 2.063 -3.372 6.706
148 HD22 ASN 22 2HD2 ASN 22 0.967 -2.204 7.362
149 H CYS 23 H CYS 23 -0.569 -1.681 3.699
150 HA CYS 23 HA CYS 23 0.877 -0.565 1.527
151 HB2 CYS 23 2HB CYS 23 -0.509 0.722 3.892
152 HB3 CYS 23 1HB CYS 23 0.230 1.627 2.577
153 H VAL 24 H VAL 24 2.950 -0.900 1.657
154 HA VAL 24 HA VAL 24 4.405 -0.282 4.087
155 HB VAL 24 HB VAL 24 5.369 -1.469 1.479
156 HG11 VAL 24 1HG1 VAL 24 6.738 -1.317 4.148
157 HG12 VAL 24 2HG1 VAL 24 7.155 -0.376 2.714
158 HG13 VAL 24 3HG1 VAL 24 7.372 -2.131 2.716
159 HG21 VAL 24 3HG2 VAL 24 5.444 -3.631 2.691
160 HG22 VAL 24 1HG2 VAL 24 3.806 -2.989 2.550
161 HG23 VAL 24 2HG2 VAL 24 4.680 -2.848 4.072
162 HA PRO 25 HA PRO 25 5.034 3.746 2.370
163 HB2 PRO 25 2HB PRO 25 7.447 3.801 4.093
164 HB3 PRO 25 1HB PRO 25 6.072 4.909 4.058
165 HG2 PRO 25 2HG PRO 25 6.375 3.143 6.043
166 HG3 PRO 25 1HG PRO 25 4.776 3.556 5.404
167 HD2 PRO 25 2HD PRO 25 6.426 1.099 4.887
168 HD3 PRO 25 1HD PRO 25 4.672 1.284 5.105
169 H LEU 26 H LEU 26 5.914 4.292 0.591
170 HA LEU 26 HA LEU 26 8.499 3.186 -0.230
171 HB2 LEU 26 2HB LEU 26 6.597 2.346 -1.554
172 HB3 LEU 26 1HB LEU 26 6.129 4.000 -1.916
173 HG LEU 26 HG LEU 26 8.316 4.258 -3.115
174 HD11 LEU 26 1HD1 LEU 26 9.544 2.436 -2.078
175 HD12 LEU 26 2HD1 LEU 26 9.494 2.246 -3.829
176 HD13 LEU 26 3HD1 LEU 26 8.446 1.265 -2.808
177 HD21 LEU 26 3HD2 LEU 26 7.582 3.069 -5.125
178 HD22 LEU 26 1HD2 LEU 26 6.241 3.889 -4.325
179 HD23 LEU 26 2HD2 LEU 26 6.436 2.144 -4.154
180 HA PRO 27 HA PRO 27 9.470 7.600 -0.060
181 HB2 PRO 27 2HB PRO 27 11.915 7.039 -1.539
182 HB3 PRO 27 1HB PRO 27 11.721 7.490 0.157
183 HG2 PRO 27 2HG PRO 27 12.529 5.015 -0.611
184 HG3 PRO 27 1HG PRO 27 11.573 5.310 0.854
185 HD2 PRO 27 2HD PRO 27 10.699 4.345 -1.823
186 HD3 PRO 27 1HD PRO 27 10.281 3.759 -0.193
187 H PHE 28 H PHE 28 7.797 6.971 -2.105
188 HA PHE 28 HA PHE 28 8.528 8.905 -4.161
189 HB2 PHE 28 2HB PHE 28 7.742 6.055 -4.799
190 HB3 PHE 28 1HB PHE 28 7.585 7.358 -5.953
191 HD1 PHE 28 1HD PHE 28 9.646 8.500 -6.757
192 HD2 PHE 28 2HD PHE 28 9.752 4.929 -4.451
193 HE1 PHE 28 1HE PHE 28 11.913 8.048 -7.564
194 HE2 PHE 28 2HE PHE 28 12.026 4.480 -5.251
195 HZ PHE 28 HZ PHE 28 13.095 6.040 -6.818
196 H LEU 29 H LEU 29 6.142 6.378 -3.679
197 HA LEU 29 HA LEU 29 4.027 8.218 -4.435
198 HB2 LEU 29 2HB LEU 29 3.863 5.242 -4.046
199 HB3 LEU 29 1HB LEU 29 2.750 6.271 -4.923
200 HG LEU 29 HG LEU 29 5.561 5.550 -5.747
201 HD11 LEU 29 1HD1 LEU 29 2.919 4.808 -6.953
202 HD12 LEU 29 2HD1 LEU 29 4.027 3.751 -6.068
203 HD13 LEU 29 3HD1 LEU 29 4.514 4.440 -7.615
204 HD21 LEU 29 3HD2 LEU 29 5.140 6.758 -7.818
205 HD22 LEU 29 1HD2 LEU 29 5.096 7.829 -6.426
206 HD23 LEU 29 2HD2 LEU 29 3.584 7.326 -7.195
207 H GLY 30 H GLY 30 5.410 7.358 -1.625
208 HA2 GLY 30 2HA GLY 30 4.564 8.026 0.464
209 HA3 GLY 30 1HA GLY 30 2.927 7.809 -0.152
210 H GLY 31 H GLY 31 2.252 5.637 -0.591
211 HA2 GLY 31 2HA GLY 31 3.774 3.536 0.717
212 HA3 GLY 31 1HA GLY 31 2.154 3.858 1.327
213 H VAL 32 H VAL 32 3.466 1.621 -0.152
214 HA VAL 32 HA VAL 32 1.277 1.292 -2.081
215 HB VAL 32 HB VAL 32 2.639 0.224 -3.757
216 HG11 VAL 32 1HG1 VAL 32 2.480 2.581 -4.074
217 HG12 VAL 32 2HG1 VAL 32 4.063 2.010 -4.586
218 HG13 VAL 32 3HG1 VAL 32 3.888 2.849 -3.043
219 HG21 VAL 32 3HG2 VAL 32 4.298 -0.848 -2.374
220 HG22 VAL 32 1HG2 VAL 32 5.047 0.713 -2.016
221 HG23 VAL 32 2HG2 VAL 32 5.063 0.065 -3.667
222 H CYS 33 H CYS 33 0.790 -0.897 -2.540
223 HA CYS 33 HA CYS 33 0.919 -2.495 -0.193
224 HB2 CYS 33 2HB CYS 33 -0.176 -3.056 -2.937
225 HB3 CYS 33 1HB CYS 33 -0.361 -4.132 -1.550
226 H ALA 34 H ALA 34 2.370 -3.935 0.356
227 HA ALA 34 HA ALA 34 3.822 -5.354 -1.688
228 HB1 ALA 34 1HB ALA 34 5.252 -3.428 -1.192
229 HB2 ALA 34 2HB ALA 34 5.986 -4.916 -0.593
230 HB3 ALA 34 3HB ALA 34 5.188 -3.813 0.527
231 H VAL 35 H VAL 35 4.442 -7.343 -1.018
232 HA VAL 35 HA VAL 35 3.242 -8.221 1.444
233 HB VAL 35 HB VAL 35 3.809 -10.576 0.591
234 HG11 VAL 35 1HG1 VAL 35 1.978 -8.831 -1.048
235 HG12 VAL 35 2HG1 VAL 35 1.572 -9.630 0.470
236 HG13 VAL 35 3HG1 VAL 35 1.915 -10.591 -0.966
237 HG21 VAL 35 3HG2 VAL 35 5.516 -9.943 -1.062
238 HG22 VAL 35 1HG2 VAL 35 4.297 -9.051 -1.974
239 HG23 VAL 35 2HG2 VAL 35 4.174 -10.800 -1.822
Start of MODEL 5
1 H1 CYS 1 1HT CYS 1 -10.327 -1.013 -3.935
2 H2 CYS 1 2HT CYS 1 -11.083 -1.894 -2.693
3 H3 CYS 1 3HT CYS 1 -10.396 -2.695 -4.029
4 HA CYS 1 HA CYS 1 -8.889 -1.133 -2.049
5 HB2 CYS 1 2HB CYS 1 -8.090 -3.249 -1.245
6 HB3 CYS 1 1HB CYS 1 -9.845 -3.356 -1.275
7 H VAL 2 H VAL 2 -6.524 -1.727 -2.371
8 HA VAL 2 HA VAL 2 -6.068 -2.114 -5.189
9 HB VAL 2 HB VAL 2 -3.848 -0.924 -4.865
10 HG11 VAL 2 1HG1 VAL 2 -5.683 0.146 -5.983
11 HG12 VAL 2 2HG1 VAL 2 -4.910 1.324 -4.910
12 HG13 VAL 2 3HG1 VAL 2 -6.424 0.559 -4.442
13 HG21 VAL 2 3HG2 VAL 2 -3.690 0.623 -2.968
14 HG22 VAL 2 1HG2 VAL 2 -3.726 -1.056 -2.427
15 HG23 VAL 2 2HG2 VAL 2 -5.173 -0.056 -2.295
16 H LEU 3 H LEU 3 -4.036 -3.014 -5.819
17 HA LEU 3 HA LEU 3 -3.737 -5.443 -4.211
18 HB2 LEU 3 2HB LEU 3 -3.241 -5.256 -7.166
19 HB3 LEU 3 1HB LEU 3 -3.509 -6.651 -6.129
20 HG LEU 3 HG LEU 3 -5.631 -4.641 -6.891
21 HD11 LEU 3 1HD1 LEU 3 -6.555 -6.417 -8.288
22 HD12 LEU 3 2HD1 LEU 3 -5.161 -7.430 -7.914
23 HD13 LEU 3 3HD1 LEU 3 -4.946 -5.927 -8.816
24 HD21 LEU 3 3HD2 LEU 3 -5.874 -7.292 -5.473
25 HD22 LEU 3 1HD2 LEU 3 -7.211 -6.254 -5.962
26 HD23 LEU 3 2HD2 LEU 3 -6.075 -5.697 -4.735
27 H ILE 4 H ILE 4 -1.580 -6.602 -5.089
28 HA ILE 4 HA ILE 4 0.568 -5.163 -4.095
29 HB ILE 4 HB ILE 4 2.048 -6.848 -5.229
30 HG12 ILE 4 2HG1 ILE 4 -0.593 -8.060 -6.094
31 HG13 ILE 4 1HG1 ILE 4 0.563 -7.278 -7.165
32 HG21 ILE 4 1HG2 ILE 4 1.273 -7.147 -2.966
33 HG22 ILE 4 2HG2 ILE 4 1.325 -8.693 -3.809
34 HG23 ILE 4 3HG2 ILE 4 -0.221 -7.883 -3.550
35 HD11 ILE 4 3HD1 ILE 4 1.082 -9.763 -5.550
36 HD12 ILE 4 1HD1 ILE 4 2.196 -9.003 -6.682
37 HD13 ILE 4 2HD1 ILE 4 0.691 -9.715 -7.268
38 H GLY 5 H GLY 5 2.037 -3.862 -4.823
39 HA2 GLY 5 2HA GLY 5 3.407 -2.752 -6.328
40 HA3 GLY 5 1HA GLY 5 2.569 -3.516 -7.659
41 H GLN 6 H GLN 6 0.086 -2.425 -5.966
42 HA GLN 6 HA GLN 6 -0.006 0.118 -7.391
43 HB2 GLN 6 2HB GLN 6 -2.086 -1.460 -5.891
44 HB3 GLN 6 1HB GLN 6 -2.398 0.076 -6.684
45 HG2 GLN 6 2HG GLN 6 -1.932 -0.834 -8.828
46 HG3 GLN 6 1HG GLN 6 -1.354 -2.342 -8.125
47 HE21 GLN 6 1HE2 GLN 6 -2.794 -3.489 -9.342
48 HE22 GLN 6 2HE2 GLN 6 -4.486 -3.555 -8.999
49 H ARG 7 H ARG 7 -0.783 2.000 -6.208
50 HA ARG 7 HA ARG 7 0.736 2.120 -3.758
51 HB2 ARG 7 2HB ARG 7 0.596 4.532 -3.899
52 HB3 ARG 7 1HB ARG 7 1.155 3.858 -5.414
53 HG2 ARG 7 2HG ARG 7 -1.141 4.138 -6.314
54 HG3 ARG 7 1HG ARG 7 -1.575 4.948 -4.799
55 HD2 ARG 7 2HD ARG 7 -0.993 6.578 -6.515
56 HD3 ARG 7 1HD ARG 7 0.186 6.609 -5.200
57 HE ARG 7 HE ARG 7 0.775 4.917 -7.464
58 HH11 ARG 7 1HH1 ARG 7 1.393 8.008 -5.870
59 HH12 ARG 7 2HH1 ARG 7 2.842 8.319 -6.707
60 HH21 ARG 7 1HH2 ARG 7 2.786 5.347 -8.617
61 HH22 ARG 7 2HH2 ARG 7 3.631 6.796 -8.304
62 H CYS 8 H CYS 8 0.037 2.954 -1.875
63 HA CYS 8 HA CYS 8 -2.832 2.793 -1.398
64 HB2 CYS 8 2HB CYS 8 -2.337 0.642 -0.970
65 HB3 CYS 8 1HB CYS 8 -0.723 0.981 -0.303
66 H ASP 9 H ASP 9 -3.421 3.422 0.557
67 HA ASP 9 HA ASP 9 -1.697 4.907 2.340
68 HB2 ASP 9 2HB ASP 9 -2.478 6.582 0.573
69 HB3 ASP 9 1HB ASP 9 -4.109 6.316 1.198
70 H ASN 10 H ASN 10 -2.282 4.263 4.211
71 HA ASN 10 HA ASN 10 -4.402 2.479 4.643
72 HB2 ASN 10 2HB ASN 10 -2.651 3.887 6.646
73 HB3 ASN 10 1HB ASN 10 -3.770 2.591 7.035
74 HD21 ASN 10 1HD2 ASN 10 -0.713 3.423 5.660
75 HD22 ASN 10 2HD2 ASN 10 -0.158 1.813 5.436
76 H ASP 11 H ASP 11 -4.068 5.872 5.532
77 HA ASP 11 HA ASP 11 -6.609 5.637 6.915
78 HB2 ASP 11 2HB ASP 11 -4.603 7.882 6.942
79 HB3 ASP 11 1HB ASP 11 -6.174 7.977 7.729
80 H ARG 12 H ARG 12 -5.318 7.242 4.077
81 HA ARG 12 HA ARG 12 -7.878 8.616 3.775
82 HB2 ARG 12 2HB ARG 12 -5.246 8.991 2.382
83 HB3 ARG 12 1HB ARG 12 -6.700 9.927 2.058
84 HG2 ARG 12 2HG ARG 12 -6.680 10.895 4.194
85 HG3 ARG 12 1HG ARG 12 -5.484 9.743 4.782
86 HD2 ARG 12 2HD ARG 12 -4.974 11.761 2.611
87 HD3 ARG 12 1HD ARG 12 -4.545 11.991 4.309
88 HE ARG 12 HE ARG 12 -3.538 9.580 3.087
89 HH11 ARG 12 1HH1 ARG 12 -2.835 12.964 3.888
90 HH12 ARG 12 2HH1 ARG 12 -1.147 12.764 3.770
91 HH21 ARG 12 1HH2 ARG 12 -1.260 9.348 2.924
92 HH22 ARG 12 2HH2 ARG 12 -0.226 10.691 3.200
93 H GLY 13 H GLY 13 -6.242 5.889 2.569
94 HA2 GLY 13 2HA GLY 13 -7.148 4.321 1.129
95 HA3 GLY 13 1HA GLY 13 -8.335 5.503 0.596
96 HA PRO 14 HA PRO 14 -7.895 3.422 -0.820
97 HB2 PRO 14 2HB PRO 14 -6.873 1.850 -2.719
98 HB3 PRO 14 1HB PRO 14 -7.841 3.268 -3.136
99 HG2 PRO 14 2HG PRO 14 -4.881 2.911 -3.211
100 HG3 PRO 14 1HG PRO 14 -5.931 3.789 -4.333
101 HD2 PRO 14 2HD PRO 14 -4.427 4.931 -2.287
102 HD3 PRO 14 1HD PRO 14 -5.799 5.700 -3.102
103 H ARG 15 H ARG 15 -7.606 1.228 -0.091
104 HA ARG 15 HA ARG 15 -4.980 0.769 1.151
105 HB2 ARG 15 2HB ARG 15 -7.669 -0.251 2.044
106 HB3 ARG 15 1HB ARG 15 -6.138 -0.502 2.861
107 HG2 ARG 15 2HG ARG 15 -5.997 1.986 3.149
108 HG3 ARG 15 1HG ARG 15 -7.655 2.070 2.547
109 HD2 ARG 15 2HD ARG 15 -6.678 0.577 4.958
110 HD3 ARG 15 1HD ARG 15 -7.681 2.027 4.957
111 HE ARG 15 HE ARG 15 -9.292 0.530 3.676
112 HH11 ARG 15 1HH1 ARG 15 -7.164 -0.585 6.278
113 HH12 ARG 15 2HH1 ARG 15 -8.171 -1.887 6.733
114 HH21 ARG 15 1HH2 ARG 15 -10.674 -1.274 4.317
115 HH22 ARG 15 2HH2 ARG 15 -10.207 -2.251 5.631
116 H CYS 16 H CYS 16 -4.318 -1.416 1.349
117 HA CYS 16 HA CYS 16 -4.597 -2.882 -1.094
118 HB2 CYS 16 2HB CYS 16 -3.170 -3.603 1.457
119 HB3 CYS 16 1HB CYS 16 -2.873 -4.252 -0.152
120 H CYS 17 H CYS 17 -5.682 -4.809 -1.382
121 HA CYS 17 HA CYS 17 -7.470 -5.679 0.667
122 HB2 CYS 17 2HB CYS 17 -6.775 -6.762 -2.013
123 HB3 CYS 17 1HB CYS 17 -7.442 -7.900 -0.849
124 H SER 18 H SER 18 -7.491 -7.768 1.789
125 HA SER 18 HA SER 18 -5.383 -7.898 3.498
126 HB2 SER 18 2HB SER 18 -6.405 -10.152 4.164
127 HB3 SER 18 1HB SER 18 -7.443 -8.727 4.235
128 HG SER 18 HG SER 18 -8.587 -9.439 2.610
129 H GLY 19 H GLY 19 -5.881 -10.085 0.739
130 HA2 GLY 19 2HA GLY 19 -3.374 -11.437 1.360
131 HA3 GLY 19 1HA GLY 19 -4.514 -11.872 0.094
132 H GLN 20 H GLN 20 -3.783 -8.573 0.141
133 HA GLN 20 HA GLN 20 -2.084 -8.934 -2.201
134 HB2 GLN 20 2HB GLN 20 -3.977 -6.750 -1.420
135 HB3 GLN 20 1HB GLN 20 -2.795 -6.554 -2.706
136 HG2 GLN 20 2HG GLN 20 -4.940 -8.658 -2.601
137 HG3 GLN 20 1HG GLN 20 -5.003 -7.173 -3.550
138 HE21 GLN 20 1HE2 GLN 20 -5.120 -9.888 -4.506
139 HE22 GLN 20 2HE2 GLN 20 -3.803 -10.068 -5.599
140 H GLY 21 H GLY 21 -1.025 -9.078 0.404
141 HA2 GLY 21 2HA GLY 21 1.134 -8.419 1.063
142 HA3 GLY 21 1HA GLY 21 0.968 -7.023 0.023
143 H ASN 22 H ASN 22 1.836 -5.882 1.746
144 HA ASN 22 HA ASN 22 -0.122 -5.152 3.803
145 HB2 ASN 22 2HB ASN 22 2.909 -5.111 3.936
146 HB3 ASN 22 1HB ASN 22 1.825 -4.554 5.201
147 HD21 ASN 22 1HD2 ASN 22 3.251 -7.295 3.643
148 HD22 ASN 22 2HD2 ASN 22 2.719 -8.460 4.805
149 H CYS 23 H CYS 23 -0.211 -2.890 4.147
150 HA CYS 23 HA CYS 23 0.586 -1.371 1.823
151 HB2 CYS 23 2HB CYS 23 -1.674 -1.064 2.883
152 HB3 CYS 23 1HB CYS 23 -0.874 -0.464 4.330
153 H VAL 24 H VAL 24 2.711 -1.087 1.864
154 HA VAL 24 HA VAL 24 3.939 -0.085 4.312
155 HB VAL 24 HB VAL 24 4.941 -2.162 3.534
156 HG11 VAL 24 1HG1 VAL 24 4.407 -2.104 1.187
157 HG12 VAL 24 2HG1 VAL 24 6.140 -2.359 1.402
158 HG13 VAL 24 3HG1 VAL 24 5.532 -0.770 0.936
159 HG21 VAL 24 3HG2 VAL 24 7.310 -1.489 3.314
160 HG22 VAL 24 1HG2 VAL 24 6.463 -0.621 4.595
161 HG23 VAL 24 2HG2 VAL 24 6.784 0.174 3.055
162 HA PRO 25 HA PRO 25 3.946 3.826 2.323
163 HB2 PRO 25 2HB PRO 25 5.592 5.138 4.078
164 HB3 PRO 25 1HB PRO 25 3.884 4.814 4.388
165 HG2 PRO 25 2HG PRO 25 6.295 3.363 5.373
166 HG3 PRO 25 1HG PRO 25 4.786 3.737 6.220
167 HD2 PRO 25 2HD PRO 25 5.352 1.295 5.180
168 HD3 PRO 25 1HD PRO 25 3.697 1.907 5.325
169 H LEU 26 H LEU 26 5.150 4.941 0.924
170 HA LEU 26 HA LEU 26 7.945 4.141 0.560
171 HB2 LEU 26 2HB LEU 26 5.913 4.723 -1.583
172 HB3 LEU 26 1HB LEU 26 7.619 4.482 -1.863
173 HG LEU 26 HG LEU 26 5.675 2.449 -0.842
174 HD11 LEU 26 1HD1 LEU 26 6.138 1.377 -3.028
175 HD12 LEU 26 2HD1 LEU 26 7.107 2.780 -3.471
176 HD13 LEU 26 3HD1 LEU 26 5.377 2.959 -3.188
177 HD21 LEU 26 3HD2 LEU 26 7.525 0.842 -1.098
178 HD22 LEU 26 1HD2 LEU 26 7.884 2.064 0.121
179 HD23 LEU 26 2HD2 LEU 26 8.614 2.173 -1.480
180 HA PRO 27 HA PRO 27 9.207 8.338 0.847
181 HB2 PRO 27 2HB PRO 27 10.576 7.859 -1.761
182 HB3 PRO 27 1HB PRO 27 11.205 8.549 -0.260
183 HG2 PRO 27 2HG PRO 27 11.785 6.050 -0.918
184 HG3 PRO 27 1HG PRO 27 11.428 6.486 0.761
185 HD2 PRO 27 2HD PRO 27 9.712 5.046 -1.219
186 HD3 PRO 27 1HD PRO 27 9.828 4.845 0.533
187 H PHE 28 H PHE 28 8.791 7.734 -2.651
188 HA PHE 28 HA PHE 28 7.622 10.413 -2.910
189 HB2 PHE 28 2HB PHE 28 8.487 8.514 -5.090
190 HB3 PHE 28 1HB PHE 28 8.049 10.205 -5.281
191 HD1 PHE 28 2HD PHE 28 9.555 11.952 -4.273
192 HD2 PHE 28 1HD PHE 28 10.640 7.851 -4.570
193 HE1 PHE 28 2HE PHE 28 11.923 12.555 -3.989
194 HE2 PHE 28 1HE PHE 28 13.000 8.443 -4.286
195 HZ PHE 28 HZ PHE 28 13.647 10.785 -3.999
196 H LEU 29 H LEU 29 6.985 7.044 -3.603
197 HA LEU 29 HA LEU 29 4.537 7.626 -4.971
198 HB2 LEU 29 2HB LEU 29 5.920 5.053 -4.310
199 HB3 LEU 29 1HB LEU 29 4.285 5.053 -4.926
200 HG LEU 29 HG LEU 29 5.090 6.205 -6.981
201 HD11 LEU 29 1HD1 LEU 29 7.086 7.301 -6.117
202 HD12 LEU 29 2HD1 LEU 29 7.458 6.300 -7.515
203 HD13 LEU 29 3HD1 LEU 29 7.863 5.735 -5.900
204 HD21 LEU 29 3HD2 LEU 29 6.439 3.597 -6.333
205 HD22 LEU 29 1HD2 LEU 29 6.202 4.253 -7.953
206 HD23 LEU 29 2HD2 LEU 29 4.809 3.812 -6.967
207 H GLY 30 H GLY 30 5.121 7.686 -1.802
208 HA2 GLY 30 2HA GLY 30 3.501 8.116 -0.177
209 HA3 GLY 30 1HA GLY 30 2.278 7.467 -1.261
210 H GLY 31 H GLY 31 2.625 5.072 -1.689
211 HA2 GLY 31 2HA GLY 31 3.873 3.442 0.222
212 HA3 GLY 31 1HA GLY 31 2.174 3.658 0.654
213 H VAL 32 H VAL 32 3.238 1.198 -0.087
214 HA VAL 32 HA VAL 32 1.663 0.747 -2.517
215 HB VAL 32 HB VAL 32 4.065 1.057 -3.100
216 HG11 VAL 32 1HG1 VAL 32 4.431 -1.560 -1.675
217 HG12 VAL 32 2HG1 VAL 32 5.201 -0.015 -1.275
218 HG13 VAL 32 3HG1 VAL 32 5.606 -0.859 -2.780
219 HG21 VAL 32 3HG2 VAL 32 2.635 -0.078 -4.653
220 HG22 VAL 32 1HG2 VAL 32 2.875 -1.607 -3.809
221 HG23 VAL 32 2HG2 VAL 32 4.222 -0.850 -4.659
222 H CYS 33 H CYS 33 1.079 -1.330 -2.771
223 HA CYS 33 HA CYS 33 0.787 -2.913 -0.340
224 HB2 CYS 33 2HB CYS 33 -0.191 -3.439 -3.152
225 HB3 CYS 33 1HB CYS 33 -0.715 -4.277 -1.691
226 H ALA 34 H ALA 34 2.511 -4.165 0.141
227 HA ALA 34 HA ALA 34 3.692 -5.777 -1.948
228 HB1 ALA 34 1HB ALA 34 5.318 -3.798 -0.358
229 HB2 ALA 34 2HB ALA 34 4.980 -3.716 -2.088
230 HB3 ALA 34 3HB ALA 34 5.970 -5.025 -1.443
231 H VAL 35 H VAL 35 5.242 -7.305 -1.013
232 HA VAL 35 HA VAL 35 5.213 -7.590 1.802
233 HB VAL 35 HB VAL 35 3.119 -8.702 1.315
234 HG11 VAL 35 1HG1 VAL 35 4.574 -10.481 -0.620
235 HG12 VAL 35 2HG1 VAL 35 3.386 -9.241 -1.022
236 HG13 VAL 35 3HG1 VAL 35 2.896 -10.669 -0.109
237 HG21 VAL 35 3HG2 VAL 35 3.558 -10.975 2.184
238 HG22 VAL 35 1HG2 VAL 35 4.399 -9.703 3.077
239 HG23 VAL 35 2HG2 VAL 35 5.277 -10.698 1.915
Start of MODEL 6
1 H1 CYS 1 1HT CYS 1 -10.624 -2.237 -3.290
2 H2 CYS 1 2HT CYS 1 -10.227 -0.598 -3.379
3 H3 CYS 1 3HT CYS 1 -10.918 -1.220 -1.963
4 HA CYS 1 HA CYS 1 -8.548 -0.881 -1.729
5 HB2 CYS 1 2HB CYS 1 -7.970 -3.205 -1.058
6 HB3 CYS 1 1HB CYS 1 -9.546 -2.713 -0.465
7 H VAL 2 H VAL 2 -6.381 -1.694 -2.372
8 HA VAL 2 HA VAL 2 -6.333 -2.264 -5.237
9 HB VAL 2 HB VAL 2 -4.039 -1.256 -5.247
10 HG11 VAL 2 1HG1 VAL 2 -4.800 1.083 -5.135
11 HG12 VAL 2 2HG1 VAL 2 -6.296 0.531 -4.372
12 HG13 VAL 2 3HG1 VAL 2 -5.910 0.038 -6.018
13 HG21 VAL 2 3HG2 VAL 2 -3.501 -1.493 -2.882
14 HG22 VAL 2 1HG2 VAL 2 -4.784 -0.356 -2.464
15 HG23 VAL 2 2HG2 VAL 2 -3.383 0.195 -3.382
16 H LEU 3 H LEU 3 -4.193 -3.286 -5.912
17 HA LEU 3 HA LEU 3 -3.930 -5.688 -4.241
18 HB2 LEU 3 2HB LEU 3 -3.322 -5.491 -7.187
19 HB3 LEU 3 1HB LEU 3 -3.506 -6.925 -6.194
20 HG LEU 3 HG LEU 3 -5.743 -5.053 -6.985
21 HD11 LEU 3 1HD1 LEU 3 -6.503 -6.882 -8.406
22 HD12 LEU 3 2HD1 LEU 3 -5.059 -7.803 -7.987
23 HD13 LEU 3 3HD1 LEU 3 -4.913 -6.290 -8.884
24 HD21 LEU 3 3HD2 LEU 3 -7.226 -6.800 -6.097
25 HD22 LEU 3 1HD2 LEU 3 -6.188 -6.120 -4.843
26 HD23 LEU 3 2HD2 LEU 3 -5.817 -7.700 -5.536
27 H ILE 4 H ILE 4 -1.683 -6.861 -5.101
28 HA ILE 4 HA ILE 4 0.387 -5.406 -3.945
29 HB ILE 4 HB ILE 4 1.960 -7.063 -5.000
30 HG12 ILE 4 2HG1 ILE 4 -0.601 -8.260 -6.094
31 HG13 ILE 4 1HG1 ILE 4 0.679 -7.525 -7.050
32 HG21 ILE 4 1HG2 ILE 4 1.165 -8.968 -3.679
33 HG22 ILE 4 2HG2 ILE 4 -0.395 -8.165 -3.493
34 HG23 ILE 4 3HG2 ILE 4 1.058 -7.441 -2.802
35 HD11 ILE 4 3HD1 ILE 4 0.910 -10.023 -5.385
36 HD12 ILE 4 1HD1 ILE 4 2.217 -9.284 -6.307
37 HD13 ILE 4 2HD1 ILE 4 0.812 -9.937 -7.144
38 H GLY 5 H GLY 5 2.005 -4.176 -4.611
39 HA2 GLY 5 2HA GLY 5 3.435 -3.039 -6.031
40 HA3 GLY 5 1HA GLY 5 2.609 -3.698 -7.425
41 H GLN 6 H GLN 6 0.083 -2.757 -5.988
42 HA GLN 6 HA GLN 6 -0.008 -0.236 -7.342
43 HB2 GLN 6 2HB GLN 6 -2.080 -1.756 -5.776
44 HB3 GLN 6 1HB GLN 6 -2.405 -0.272 -6.664
45 HG2 GLN 6 2HG GLN 6 -1.768 -1.366 -8.748
46 HG3 GLN 6 1HG GLN 6 -1.404 -2.846 -7.870
47 HE21 GLN 6 1HE2 GLN 6 -2.861 -4.009 -9.037
48 HE22 GLN 6 2HE2 GLN 6 -4.570 -3.851 -8.874
49 H ARG 7 H ARG 7 -0.761 1.640 -6.347
50 HA ARG 7 HA ARG 7 0.750 2.181 -3.943
51 HB2 ARG 7 2HB ARG 7 0.985 3.518 -6.034
52 HB3 ARG 7 1HB ARG 7 -0.688 3.999 -5.894
53 HG2 ARG 7 2HG ARG 7 1.329 4.661 -3.772
54 HG3 ARG 7 1HG ARG 7 1.145 5.656 -5.205
55 HD2 ARG 7 2HD ARG 7 -1.253 5.958 -4.606
56 HD3 ARG 7 1HD ARG 7 -0.946 5.074 -3.106
57 HE ARG 7 HE ARG 7 0.936 7.087 -3.315
58 HH11 ARG 7 1HH1 ARG 7 -2.568 6.864 -2.888
59 HH12 ARG 7 2HH1 ARG 7 -2.712 8.331 -2.055
60 HH21 ARG 7 1HH2 ARG 7 0.754 9.125 -2.166
61 HH22 ARG 7 2HH2 ARG 7 -0.753 9.676 -1.652
62 H CYS 8 H CYS 8 -0.166 2.578 -2.017
63 HA CYS 8 HA CYS 8 -3.085 2.859 -1.915
64 HB2 CYS 8 2HB CYS 8 -3.088 1.373 0.026
65 HB3 CYS 8 1HB CYS 8 -2.495 0.549 -1.411
66 H ASP 9 H ASP 9 -3.732 3.549 0.345
67 HA ASP 9 HA ASP 9 -1.741 5.044 1.823
68 HB2 ASP 9 2HB ASP 9 -2.710 6.675 0.131
69 HB3 ASP 9 1HB ASP 9 -4.285 6.390 0.884
70 H ASN 10 H ASN 10 -2.108 4.682 3.862
71 HA ASN 10 HA ASN 10 -4.235 2.969 4.653
72 HB2 ASN 10 2HB ASN 10 -2.204 4.446 6.324
73 HB3 ASN 10 1HB ASN 10 -3.253 3.164 6.902
74 HD21 ASN 10 1HD2 ASN 10 -2.783 1.060 6.386
75 HD22 ASN 10 2HD2 ASN 10 -1.279 0.574 5.702
76 H ASP 11 H ASP 11 -3.590 6.368 4.940
77 HA ASP 11 HA ASP 11 -5.556 6.864 6.961
78 HB2 ASP 11 2HB ASP 11 -4.037 8.768 5.183
79 HB3 ASP 11 1HB ASP 11 -5.105 9.261 6.484
80 H ARG 12 H ARG 12 -5.308 7.769 3.561
81 HA ARG 12 HA ARG 12 -8.065 8.710 3.576
82 HB2 ARG 12 2HB ARG 12 -5.850 8.901 1.566
83 HB3 ARG 12 1HB ARG 12 -7.453 9.583 1.341
84 HG2 ARG 12 2HG ARG 12 -7.139 11.185 2.988
85 HG3 ARG 12 1HG ARG 12 -5.816 10.288 3.738
86 HD2 ARG 12 2HD ARG 12 -5.705 11.537 1.006
87 HD3 ARG 12 1HD ARG 12 -5.089 12.296 2.475
88 HE ARG 12 HE ARG 12 -4.020 9.699 2.194
89 HH11 ARG 12 1HH1 ARG 12 -3.659 12.953 0.812
90 HH12 ARG 12 2HH1 ARG 12 -2.042 12.731 0.359
91 HH21 ARG 12 1HH2 ARG 12 -1.793 9.419 1.618
92 HH22 ARG 12 2HH2 ARG 12 -0.939 10.687 0.851
93 H GLY 13 H GLY 13 -6.243 6.036 2.525
94 HA2 GLY 13 2HA GLY 13 -7.139 4.058 1.687
95 HA3 GLY 13 1HA GLY 13 -8.571 4.930 1.150
96 HA PRO 14 HA PRO 14 -8.206 2.813 0.066
97 HB2 PRO 14 2HB PRO 14 -7.575 1.099 -1.877
98 HB3 PRO 14 1HB PRO 14 -8.712 2.423 -2.174
99 HG2 PRO 14 2HG PRO 14 -5.875 2.125 -3.008
100 HG3 PRO 14 1HG PRO 14 -7.210 2.944 -3.835
101 HD2 PRO 14 2HD PRO 14 -5.195 4.138 -2.263
102 HD3 PRO 14 1HD PRO 14 -6.668 4.915 -2.868
103 H ARG 15 H ARG 15 -7.569 0.655 0.794
104 HA ARG 15 HA ARG 15 -4.687 0.457 1.272
105 HB2 ARG 15 2HB ARG 15 -6.920 -0.925 2.774
106 HB3 ARG 15 1HB ARG 15 -5.209 -1.041 3.134
107 HG2 ARG 15 2HG ARG 15 -5.221 1.414 3.572
108 HG3 ARG 15 1HG ARG 15 -6.979 1.365 3.428
109 HD2 ARG 15 2HD ARG 15 -5.294 -0.172 5.398
110 HD3 ARG 15 1HD ARG 15 -6.303 1.226 5.759
111 HE ARG 15 HE ARG 15 -8.021 -0.603 4.688
112 HH11 ARG 15 1HH1 ARG 15 -5.732 -0.685 7.384
113 HH12 ARG 15 2HH1 ARG 15 -6.651 -1.757 8.336
114 HH21 ARG 15 1HH2 ARG 15 -9.308 -2.069 6.008
115 HH22 ARG 15 2HH2 ARG 15 -8.740 -2.552 7.526
116 H CYS 16 H CYS 16 -4.197 -2.040 1.672
117 HA CYS 16 HA CYS 16 -4.380 -3.256 -0.885
118 HB2 CYS 16 2HB CYS 16 -3.502 -4.460 1.730
119 HB3 CYS 16 1HB CYS 16 -3.010 -4.933 0.104
120 H CYS 17 H CYS 17 -5.718 -4.904 -1.535
121 HA CYS 17 HA CYS 17 -7.984 -5.620 0.010
122 HB2 CYS 17 2HB CYS 17 -6.743 -7.137 -2.307
123 HB3 CYS 17 1HB CYS 17 -8.380 -7.321 -1.707
124 H SER 18 H SER 18 -8.377 -7.788 0.947
125 HA SER 18 HA SER 18 -6.284 -8.593 2.619
126 HB2 SER 18 2HB SER 18 -8.715 -8.883 3.130
127 HB3 SER 18 1HB SER 18 -8.785 -10.123 1.884
128 HG SER 18 HG SER 18 -7.317 -10.157 4.288
129 H GLY 19 H GLY 19 -4.517 -9.613 2.043
130 HA2 GLY 19 2HA GLY 19 -3.420 -11.599 1.310
131 HA3 GLY 19 1HA GLY 19 -4.696 -11.817 0.119
132 H GLN 20 H GLN 20 -3.631 -8.600 0.391
133 HA GLN 20 HA GLN 20 -2.015 -8.957 -2.042
134 HB2 GLN 20 2HB GLN 20 -3.824 -6.686 -1.275
135 HB3 GLN 20 1HB GLN 20 -2.723 -6.626 -2.640
136 HG2 GLN 20 2HG GLN 20 -4.968 -8.586 -2.269
137 HG3 GLN 20 1HG GLN 20 -5.001 -7.165 -3.310
138 HE21 GLN 20 1HE2 GLN 20 -5.347 -9.936 -3.987
139 HE22 GLN 20 2HE2 GLN 20 -4.150 -10.291 -5.184
140 H GLY 21 H GLY 21 -1.070 -8.913 0.747
141 HA2 GLY 21 2HA GLY 21 1.072 -8.187 1.481
142 HA3 GLY 21 1HA GLY 21 1.005 -6.963 0.238
143 H ASN 22 H ASN 22 1.822 -5.656 1.969
144 HA ASN 22 HA ASN 22 -0.394 -4.477 3.468
145 HB2 ASN 22 2HB ASN 22 2.437 -4.915 4.480
146 HB3 ASN 22 1HB ASN 22 1.234 -3.922 5.285
147 HD21 ASN 22 1HD2 ASN 22 2.365 -7.115 4.697
148 HD22 ASN 22 2HD2 ASN 22 1.223 -7.904 5.723
149 H CYS 23 H CYS 23 -0.195 -2.232 3.700
150 HA CYS 23 HA CYS 23 1.109 -0.924 1.587
151 HB2 CYS 23 2HB CYS 23 -0.268 0.116 4.060
152 HB3 CYS 23 1HB CYS 23 0.509 1.183 2.903
153 H VAL 24 H VAL 24 3.188 -1.183 1.543
154 HA VAL 24 HA VAL 24 4.715 -0.387 3.847
155 HB VAL 24 HB VAL 24 6.724 -1.190 2.576
156 HG11 VAL 24 1HG1 VAL 24 4.493 -3.194 2.772
157 HG12 VAL 24 2HG1 VAL 24 5.569 -2.691 4.075
158 HG13 VAL 24 3HG1 VAL 24 6.215 -3.569 2.690
159 HG21 VAL 24 3HG2 VAL 24 4.722 -2.090 0.495
160 HG22 VAL 24 1HG2 VAL 24 6.442 -2.481 0.511
161 HG23 VAL 24 2HG2 VAL 24 5.919 -0.814 0.280
162 HA PRO 25 HA PRO 25 4.497 3.563 2.020
163 HB2 PRO 25 2HB PRO 25 5.672 4.962 4.014
164 HB3 PRO 25 1HB PRO 25 4.022 4.342 4.116
165 HG2 PRO 25 2HG PRO 25 6.530 3.263 5.298
166 HG3 PRO 25 1HG PRO 25 4.899 3.328 5.987
167 HD2 PRO 25 2HD PRO 25 6.013 1.082 4.851
168 HD3 PRO 25 1HD PRO 25 4.269 1.381 4.969
169 H LEU 26 H LEU 26 5.708 4.824 0.869
170 HA LEU 26 HA LEU 26 8.593 4.682 1.008
171 HB2 LEU 26 2HB LEU 26 6.926 4.225 -1.472
172 HB3 LEU 26 1HB LEU 26 8.641 4.581 -1.513
173 HG LEU 26 HG LEU 26 7.475 2.192 -0.119
174 HD11 LEU 26 1HD1 LEU 26 7.026 2.067 -2.532
175 HD12 LEU 26 2HD1 LEU 26 8.256 0.894 -2.063
176 HD13 LEU 26 3HD1 LEU 26 8.727 2.393 -2.865
177 HD21 LEU 26 3HD2 LEU 26 9.657 2.840 0.709
178 HD22 LEU 26 1HD2 LEU 26 10.295 2.883 -0.936
179 HD23 LEU 26 2HD2 LEU 26 9.785 1.353 -0.226
180 HA PRO 27 HA PRO 27 7.453 8.950 1.146
181 HB2 PRO 27 2HB PRO 27 9.935 9.944 1.460
182 HB3 PRO 27 1HB PRO 27 9.108 9.052 2.747
183 HG2 PRO 27 2HG PRO 27 11.165 8.098 0.786
184 HG3 PRO 27 1HG PRO 27 11.074 7.803 2.531
185 HD2 PRO 27 2HD PRO 27 10.250 5.990 0.692
186 HD3 PRO 27 1HD PRO 27 9.493 6.137 2.284
187 H PHE 28 H PHE 28 7.310 8.108 -1.355
188 HA PHE 28 HA PHE 28 8.384 10.341 -2.911
189 HB2 PHE 28 2HB PHE 28 8.502 7.469 -3.900
190 HB3 PHE 28 1HB PHE 28 9.042 8.899 -4.763
191 HD1 PHE 28 2HD PHE 28 11.089 10.095 -3.987
192 HD2 PHE 28 1HD PHE 28 9.877 6.362 -2.346
193 HE1 PHE 28 2HE PHE 28 13.340 9.775 -3.044
194 HE2 PHE 28 1HE PHE 28 12.118 6.039 -1.402
195 HZ PHE 28 HZ PHE 28 13.849 7.740 -1.744
196 H LEU 29 H LEU 29 6.596 7.317 -3.225
197 HA LEU 29 HA LEU 29 4.482 8.774 -4.616
198 HB2 LEU 29 2HB LEU 29 3.820 6.748 -5.701
199 HB3 LEU 29 1HB LEU 29 5.531 6.980 -5.934
200 HG LEU 29 HG LEU 29 4.286 5.000 -4.005
201 HD11 LEU 29 1HD1 LEU 29 5.018 3.307 -5.609
202 HD12 LEU 29 2HD1 LEU 29 5.535 4.584 -6.710
203 HD13 LEU 29 3HD1 LEU 29 3.828 4.408 -6.301
204 HD21 LEU 29 3HD2 LEU 29 6.510 5.611 -3.237
205 HD22 LEU 29 1HD2 LEU 29 7.161 5.404 -4.864
206 HD23 LEU 29 2HD2 LEU 29 6.572 4.013 -3.965
207 H GLY 30 H GLY 30 5.071 7.731 -1.586
208 HA2 GLY 30 2HA GLY 30 3.287 8.027 0.008
209 HA3 GLY 30 1HA GLY 30 2.211 7.271 -1.154
210 H GLY 31 H GLY 31 2.590 5.032 -1.662
211 HA2 GLY 31 2HA GLY 31 4.294 3.362 -0.251
212 HA3 GLY 31 1HA GLY 31 2.772 3.465 0.637
213 H VAL 32 H VAL 32 3.703 1.128 -0.533
214 HA VAL 32 HA VAL 32 1.598 0.714 -2.536
215 HB VAL 32 HB VAL 32 3.029 -0.818 -3.836
216 HG11 VAL 32 1HG1 VAL 32 2.807 1.414 -4.654
217 HG12 VAL 32 2HG1 VAL 32 4.447 0.831 -4.942
218 HG13 VAL 32 3HG1 VAL 32 4.134 1.965 -3.626
219 HG21 VAL 32 3HG2 VAL 32 5.457 -0.839 -3.559
220 HG22 VAL 32 1HG2 VAL 32 4.638 -1.456 -2.126
221 HG23 VAL 32 2HG2 VAL 32 5.310 0.178 -2.121
222 H CYS 33 H CYS 33 0.880 -1.423 -2.707
223 HA CYS 33 HA CYS 33 0.953 -2.863 -0.215
224 HB2 CYS 33 2HB CYS 33 -0.497 -3.324 -2.815
225 HB3 CYS 33 1HB CYS 33 -0.647 -4.379 -1.413
226 H ALA 34 H ALA 34 2.678 -4.112 0.169
227 HA ALA 34 HA ALA 34 3.459 -5.955 -1.930
228 HB1 ALA 34 1HB ALA 34 5.831 -5.497 -1.569
229 HB2 ALA 34 2HB ALA 34 5.417 -4.217 -0.430
230 HB3 ALA 34 3HB ALA 34 4.991 -4.052 -2.135
231 H VAL 35 H VAL 35 4.572 -7.763 -1.109
232 HA VAL 35 HA VAL 35 3.928 -8.331 1.665
233 HB VAL 35 HB VAL 35 4.965 -10.216 -0.475
234 HG11 VAL 35 1HG1 VAL 35 3.799 -10.759 2.253
235 HG12 VAL 35 2HG1 VAL 35 5.479 -10.989 1.768
236 HG13 VAL 35 3HG1 VAL 35 4.208 -11.992 1.065
237 HG21 VAL 35 3HG2 VAL 35 2.139 -9.852 0.532
238 HG22 VAL 35 1HG2 VAL 35 2.672 -11.076 -0.617
239 HG23 VAL 35 2HG2 VAL 35 2.736 -9.368 -1.055
Start of MODEL 7
1 H1 CYS 1 1HT CYS 1 -10.562 -2.485 -3.758
2 H2 CYS 1 2HT CYS 1 -10.196 -0.866 -3.588
3 H3 CYS 1 3HT CYS 1 -10.951 -1.685 -2.307
4 HA CYS 1 HA CYS 1 -8.599 -1.338 -1.887
5 HB2 CYS 1 2HB CYS 1 -7.989 -3.655 -1.422
6 HB3 CYS 1 1HB CYS 1 -9.672 -3.391 -1.002
7 H VAL 2 H VAL 2 -6.439 -1.711 -2.469
8 HA VAL 2 HA VAL 2 -6.097 -2.107 -5.342
9 HB VAL 2 HB VAL 2 -3.923 -0.855 -5.094
10 HG11 VAL 2 1HG1 VAL 2 -6.443 0.628 -4.375
11 HG12 VAL 2 2HG1 VAL 2 -5.877 0.245 -6.000
12 HG13 VAL 2 3HG1 VAL 2 -4.969 1.369 -4.990
13 HG21 VAL 2 3HG2 VAL 2 -5.047 -0.180 -2.376
14 HG22 VAL 2 1HG2 VAL 2 -3.646 0.582 -3.130
15 HG23 VAL 2 2HG2 VAL 2 -3.595 -1.129 -2.699
16 H LEU 3 H LEU 3 -3.818 -2.832 -5.884
17 HA LEU 3 HA LEU 3 -3.464 -5.356 -4.421
18 HB2 LEU 3 2HB LEU 3 -2.594 -4.724 -7.220
19 HB3 LEU 3 1HB LEU 3 -2.731 -6.269 -6.394
20 HG LEU 3 HG LEU 3 -5.103 -4.569 -7.105
21 HD11 LEU 3 1HD1 LEU 3 -5.423 -6.120 -8.952
22 HD12 LEU 3 2HD1 LEU 3 -3.893 -6.907 -8.558
23 HD13 LEU 3 3HD1 LEU 3 -3.911 -5.233 -9.108
24 HD21 LEU 3 3HD2 LEU 3 -4.836 -7.462 -6.271
25 HD22 LEU 3 1HD2 LEU 3 -6.337 -6.656 -6.729
26 HD23 LEU 3 2HD2 LEU 3 -5.476 -6.153 -5.277
27 H ILE 4 H ILE 4 -1.178 -6.262 -4.956
28 HA ILE 4 HA ILE 4 0.783 -4.669 -3.750
29 HB ILE 4 HB ILE 4 2.434 -6.360 -4.551
30 HG12 ILE 4 2HG1 ILE 4 0.008 -7.710 -5.776
31 HG13 ILE 4 1HG1 ILE 4 1.320 -6.967 -6.681
32 HG21 ILE 4 1HG2 ILE 4 -0.027 -7.432 -3.196
33 HG22 ILE 4 2HG2 ILE 4 1.347 -6.639 -2.424
34 HG23 ILE 4 3HG2 ILE 4 1.554 -8.210 -3.199
35 HD11 ILE 4 3HD1 ILE 4 1.525 -9.396 -6.612
36 HD12 ILE 4 1HD1 ILE 4 1.564 -9.347 -4.852
37 HD13 ILE 4 2HD1 ILE 4 2.876 -8.622 -5.783
38 H GLY 5 H GLY 5 2.308 -3.376 -4.447
39 HA2 GLY 5 2HA GLY 5 3.735 -2.322 -5.975
40 HA3 GLY 5 1HA GLY 5 2.923 -3.174 -7.281
41 H GLN 6 H GLN 6 0.360 -2.106 -5.803
42 HA GLN 6 HA GLN 6 0.250 0.311 -7.410
43 HB2 GLN 6 2HB GLN 6 -1.923 -1.188 -5.939
44 HB3 GLN 6 1HB GLN 6 -2.188 0.236 -6.933
45 HG2 GLN 6 2HG GLN 6 -1.302 -1.027 -8.878
46 HG3 GLN 6 1HG GLN 6 -1.202 -2.455 -7.850
47 HE21 GLN 6 1HE2 GLN 6 -2.755 -2.029 -10.246
48 HE22 GLN 6 2HE2 GLN 6 -4.408 -2.275 -9.808
49 H ARG 7 H ARG 7 -0.797 2.215 -6.463
50 HA ARG 7 HA ARG 7 0.538 2.809 -3.978
51 HB2 ARG 7 2HB ARG 7 0.762 4.374 -5.825
52 HB3 ARG 7 1HB ARG 7 -0.981 4.558 -5.912
53 HG2 ARG 7 2HG ARG 7 -0.999 5.618 -3.721
54 HG3 ARG 7 1HG ARG 7 0.746 5.392 -3.587
55 HD2 ARG 7 2HD ARG 7 -0.646 7.030 -5.711
56 HD3 ARG 7 1HD ARG 7 0.141 7.679 -4.275
57 HE ARG 7 HE ARG 7 1.992 6.097 -5.590
58 HH11 ARG 7 1HH1 ARG 7 0.245 9.092 -6.232
59 HH12 ARG 7 2HH1 ARG 7 1.469 9.777 -7.191
60 HH21 ARG 7 1HH2 ARG 7 3.637 6.984 -6.899
61 HH22 ARG 7 2HH2 ARG 7 3.490 8.545 -7.578
62 H CYS 8 H CYS 8 -0.358 2.883 -2.131
63 HA CYS 8 HA CYS 8 -3.284 2.917 -1.860
64 HB2 CYS 8 2HB CYS 8 -2.909 1.430 0.097
65 HB3 CYS 8 1HB CYS 8 -2.412 0.692 -1.423
66 H ASP 9 H ASP 9 -3.798 3.468 0.538
67 HA ASP 9 HA ASP 9 -1.858 5.193 1.872
68 HB2 ASP 9 2HB ASP 9 -3.348 6.708 0.457
69 HB3 ASP 9 1HB ASP 9 -4.721 6.061 1.356
70 H ASN 10 H ASN 10 -1.906 4.650 3.959
71 HA ASN 10 HA ASN 10 -3.621 2.524 4.814
72 HB2 ASN 10 2HB ASN 10 -1.513 4.080 6.265
73 HB3 ASN 10 1HB ASN 10 -2.538 2.926 7.099
74 HD21 ASN 10 1HD2 ASN 10 0.115 3.362 4.973
75 HD22 ASN 10 2HD2 ASN 10 0.526 1.692 4.844
76 H ASP 11 H ASP 11 -3.733 5.918 5.199
77 HA ASP 11 HA ASP 11 -5.469 5.673 7.515
78 HB2 ASP 11 2HB ASP 11 -4.142 8.060 6.268
79 HB3 ASP 11 1HB ASP 11 -5.358 8.198 7.532
80 H ARG 12 H ARG 12 -5.542 7.042 4.296
81 HA ARG 12 HA ARG 12 -8.424 7.448 4.683
82 HB2 ARG 12 2HB ARG 12 -6.570 8.680 2.669
83 HB3 ARG 12 1HB ARG 12 -8.295 8.993 2.772
84 HG2 ARG 12 2HG ARG 12 -8.015 9.938 4.991
85 HG3 ARG 12 1HG ARG 12 -6.289 9.574 4.939
86 HD2 ARG 12 2HD ARG 12 -6.663 11.892 4.408
87 HD3 ARG 12 1HD ARG 12 -6.060 11.041 2.989
88 HE ARG 12 HE ARG 12 -8.890 11.703 3.430
89 HH11 ARG 12 1HH1 ARG 12 -6.117 11.357 1.256
90 HH12 ARG 12 2HH1 ARG 12 -6.867 12.079 -0.080
91 HH21 ARG 12 1HH2 ARG 12 -9.957 12.697 1.571
92 HH22 ARG 12 2HH2 ARG 12 -9.129 12.856 0.097
93 H GLY 13 H GLY 13 -6.172 5.591 2.880
94 HA2 GLY 13 2HA GLY 13 -6.855 3.695 1.657
95 HA3 GLY 13 1HA GLY 13 -8.424 4.457 1.404
96 HA PRO 14 HA PRO 14 -8.303 2.882 -0.476
97 HB2 PRO 14 2HB PRO 14 -7.129 1.544 -2.508
98 HB3 PRO 14 1HB PRO 14 -8.376 2.767 -2.778
99 HG2 PRO 14 2HG PRO 14 -5.406 3.013 -3.011
100 HG3 PRO 14 1HG PRO 14 -6.668 3.650 -4.080
101 HD2 PRO 14 2HD PRO 14 -5.393 5.169 -2.221
102 HD3 PRO 14 1HD PRO 14 -7.065 5.467 -2.732
103 H ARG 15 H ARG 15 -7.834 0.844 0.254
104 HA ARG 15 HA ARG 15 -5.148 0.475 1.327
105 HB2 ARG 15 2HB ARG 15 -7.876 -0.429 2.255
106 HB3 ARG 15 1HB ARG 15 -6.388 -1.085 2.921
107 HG2 ARG 15 2HG ARG 15 -5.726 1.095 3.721
108 HG3 ARG 15 1HG ARG 15 -7.117 1.837 2.939
109 HD2 ARG 15 2HD ARG 15 -8.628 0.723 4.430
110 HD3 ARG 15 1HD ARG 15 -7.324 -0.253 5.106
111 HE ARG 15 HE ARG 15 -6.378 2.005 5.811
112 HH11 ARG 15 1HH1 ARG 15 -9.888 1.433 5.684
113 HH12 ARG 15 2HH1 ARG 15 -10.207 2.508 6.978
114 HH21 ARG 15 1HH2 ARG 15 -6.844 3.395 7.547
115 HH22 ARG 15 2HH2 ARG 15 -8.443 3.657 8.070
116 H CYS 16 H CYS 16 -4.461 -1.780 1.456
117 HA CYS 16 HA CYS 16 -4.504 -3.019 -1.089
118 HB2 CYS 16 2HB CYS 16 -3.526 -4.094 1.545
119 HB3 CYS 16 1HB CYS 16 -3.011 -4.592 -0.065
120 H CYS 17 H CYS 17 -5.508 -4.892 -1.766
121 HA CYS 17 HA CYS 17 -7.907 -5.743 -0.541
122 HB2 CYS 17 2HB CYS 17 -6.142 -7.167 -2.545
123 HB3 CYS 17 1HB CYS 17 -7.809 -7.588 -2.189
124 H SER 18 H SER 18 -8.356 -7.833 0.420
125 HA SER 18 HA SER 18 -6.598 -8.500 2.484
126 HB2 SER 18 2HB SER 18 -8.921 -10.083 1.366
127 HB3 SER 18 1HB SER 18 -8.256 -10.191 3.001
128 HG SER 18 HG SER 18 -8.834 -7.981 3.270
129 H GLY 19 H GLY 19 -4.675 -9.375 2.086
130 HA2 GLY 19 2HA GLY 19 -3.377 -11.323 1.640
131 HA3 GLY 19 1HA GLY 19 -4.535 -11.768 0.390
132 H GLN 20 H GLN 20 -3.381 -8.516 0.749
133 HA GLN 20 HA GLN 20 -1.651 -8.861 -1.581
134 HB2 GLN 20 2HB GLN 20 -3.751 -6.772 -1.153
135 HB3 GLN 20 1HB GLN 20 -2.352 -6.440 -2.165
136 HG2 GLN 20 2HG GLN 20 -4.295 -8.700 -2.566
137 HG3 GLN 20 1HG GLN 20 -4.280 -7.179 -3.465
138 HE21 GLN 20 1HE2 GLN 20 -2.666 -10.217 -2.965
139 HE22 GLN 20 2HE2 GLN 20 -1.657 -10.116 -4.355
140 H GLY 21 H GLY 21 -0.896 -8.927 1.083
141 HA2 GLY 21 2HA GLY 21 1.021 -8.160 2.166
142 HA3 GLY 21 1HA GLY 21 1.154 -6.970 0.904
143 H ASN 22 H ASN 22 1.822 -5.759 2.682
144 HA ASN 22 HA ASN 22 -0.387 -4.517 4.131
145 HB2 ASN 22 2HB ASN 22 1.358 -5.445 5.573
146 HB3 ASN 22 1HB ASN 22 2.591 -4.556 4.688
147 HD21 ASN 22 1HD2 ASN 22 -0.062 -4.316 6.917
148 HD22 ASN 22 2HD2 ASN 22 0.321 -2.734 7.503
149 H CYS 23 H CYS 23 -0.588 -2.299 3.904
150 HA CYS 23 HA CYS 23 0.551 -1.135 1.551
151 HB2 CYS 23 2HB CYS 23 -1.732 -0.572 2.261
152 HB3 CYS 23 1HB CYS 23 -1.116 0.081 3.776
153 H VAL 24 H VAL 24 2.702 -0.859 1.710
154 HA VAL 24 HA VAL 24 3.742 0.240 4.184
155 HB VAL 24 HB VAL 24 5.332 -0.809 1.854
156 HG11 VAL 24 1HG1 VAL 24 7.147 -1.047 3.500
157 HG12 VAL 24 2HG1 VAL 24 6.103 -0.318 4.719
158 HG13 VAL 24 3HG1 VAL 24 6.600 0.622 3.313
159 HG21 VAL 24 3HG2 VAL 24 3.928 -2.623 2.688
160 HG22 VAL 24 1HG2 VAL 24 4.482 -2.313 4.333
161 HG23 VAL 24 2HG2 VAL 24 5.614 -2.912 3.119
162 HA PRO 25 HA PRO 25 4.023 4.104 1.929
163 HB2 PRO 25 2HB PRO 25 5.535 5.128 4.201
164 HB3 PRO 25 1HB PRO 25 3.928 5.587 3.639
165 HG2 PRO 25 2HG PRO 25 4.349 4.227 5.944
166 HG3 PRO 25 1HG PRO 25 2.876 4.057 4.975
167 HD2 PRO 25 2HD PRO 25 5.258 2.231 5.120
168 HD3 PRO 25 1HD PRO 25 3.520 1.865 5.023
169 H LEU 26 H LEU 26 5.437 4.553 0.437
170 HA LEU 26 HA LEU 26 8.319 4.347 0.948
171 HB2 LEU 26 2HB LEU 26 6.719 3.615 -1.507
172 HB3 LEU 26 1HB LEU 26 8.386 4.102 -1.667
173 HG LEU 26 HG LEU 26 9.046 2.143 -0.269
174 HD11 LEU 26 1HD1 LEU 26 7.097 1.764 1.025
175 HD12 LEU 26 2HD1 LEU 26 7.405 0.323 0.045
176 HD13 LEU 26 3HD1 LEU 26 6.137 1.460 -0.411
177 HD21 LEU 26 3HD2 LEU 26 7.428 1.510 -2.725
178 HD22 LEU 26 1HD2 LEU 26 8.634 0.455 -1.986
179 HD23 LEU 26 2HD2 LEU 26 9.121 2.001 -2.681
180 HA PRO 27 HA PRO 27 8.053 8.773 0.835
181 HB2 PRO 27 2HB PRO 27 10.655 8.356 -0.577
182 HB3 PRO 27 1HB PRO 27 10.231 9.544 0.664
183 HG2 PRO 27 2HG PRO 27 11.528 7.345 1.360
184 HG3 PRO 27 1HG PRO 27 10.205 7.963 2.365
185 HD2 PRO 27 2HD PRO 27 10.265 5.582 0.588
186 HD3 PRO 27 1HD PRO 27 9.320 5.877 2.059
187 H PHE 28 H PHE 28 9.281 7.398 -2.267
188 HA PHE 28 HA PHE 28 8.218 9.759 -3.635
189 HB2 PHE 28 2HB PHE 28 9.734 7.413 -4.787
190 HB3 PHE 28 1HB PHE 28 9.274 8.862 -5.665
191 HD1 PHE 28 1HD PHE 28 10.200 11.091 -4.779
192 HD2 PHE 28 2HD PHE 28 11.752 7.282 -3.705
193 HE1 PHE 28 1HE PHE 28 12.326 12.142 -4.125
194 HE2 PHE 28 2HE PHE 28 13.870 8.324 -3.044
195 HZ PHE 28 HZ PHE 28 14.162 10.742 -3.252
196 H LEU 29 H LEU 29 7.357 6.495 -3.138
197 HA LEU 29 HA LEU 29 5.536 6.480 -5.434
198 HB2 LEU 29 2HB LEU 29 6.278 4.265 -3.518
199 HB3 LEU 29 1HB LEU 29 5.177 4.090 -4.861
200 HG LEU 29 HG LEU 29 7.180 3.104 -5.502
201 HD11 LEU 29 1HD1 LEU 29 7.939 4.388 -7.435
202 HD12 LEU 29 2HD1 LEU 29 7.096 5.801 -6.807
203 HD13 LEU 29 3HD1 LEU 29 6.182 4.362 -7.272
204 HD21 LEU 29 3HD2 LEU 29 8.743 4.012 -3.889
205 HD22 LEU 29 1HD2 LEU 29 8.670 5.595 -4.659
206 HD23 LEU 29 2HD2 LEU 29 9.395 4.238 -5.510
207 H GLY 30 H GLY 30 5.515 7.330 -2.318
208 HA2 GLY 30 2HA GLY 30 3.737 8.168 -1.071
209 HA3 GLY 30 1HA GLY 30 2.610 7.364 -2.171
210 H GLY 31 H GLY 31 2.518 5.079 -2.085
211 HA2 GLY 31 2HA GLY 31 3.624 3.592 0.013
212 HA3 GLY 31 1HA GLY 31 1.932 3.986 0.352
213 H VAL 32 H VAL 32 3.381 1.498 -0.457
214 HA VAL 32 HA VAL 32 1.523 0.834 -2.598
215 HB VAL 32 HB VAL 32 3.179 -0.531 -3.801
216 HG11 VAL 32 1HG1 VAL 32 2.801 1.692 -4.635
217 HG12 VAL 32 2HG1 VAL 32 4.492 1.248 -4.861
218 HG13 VAL 32 3HG1 VAL 32 4.033 2.340 -3.554
219 HG21 VAL 32 3HG2 VAL 32 4.732 -1.003 -1.972
220 HG22 VAL 32 1HG2 VAL 32 5.237 0.686 -1.969
221 HG23 VAL 32 2HG2 VAL 32 5.585 -0.334 -3.366
222 H CYS 33 H CYS 33 0.819 -1.204 -2.584
223 HA CYS 33 HA CYS 33 0.930 -2.581 -0.103
224 HB2 CYS 33 2HB CYS 33 -0.204 -3.378 -2.781
225 HB3 CYS 33 1HB CYS 33 -0.496 -4.245 -1.264
226 H ALA 34 H ALA 34 2.338 -4.074 0.539
227 HA ALA 34 HA ALA 34 3.909 -5.488 -1.439
228 HB1 ALA 34 1HB ALA 34 5.986 -4.929 -0.257
229 HB2 ALA 34 2HB ALA 34 5.083 -3.874 0.825
230 HB3 ALA 34 3HB ALA 34 5.201 -3.482 -0.889
231 H VAL 35 H VAL 35 4.291 -7.512 -0.796
232 HA VAL 35 HA VAL 35 3.034 -8.368 1.610
233 HB VAL 35 HB VAL 35 3.705 -10.704 0.940
234 HG11 VAL 35 1HG1 VAL 35 2.190 -10.844 -0.985
235 HG12 VAL 35 2HG1 VAL 35 2.272 -9.091 -1.164
236 HG13 VAL 35 3HG1 VAL 35 1.551 -9.796 0.282
237 HG21 VAL 35 3HG2 VAL 35 5.736 -10.160 -0.339
238 HG22 VAL 35 1HG2 VAL 35 4.747 -9.356 -1.556
239 HG23 VAL 35 2HG2 VAL 35 4.598 -11.096 -1.310
Start of MODEL 8
1 H1 CYS 1 1HT CYS 1 -10.457 -2.403 -3.695
2 H2 CYS 1 2HT CYS 1 -10.034 -0.801 -3.870
3 H3 CYS 1 3HT CYS 1 -10.864 -1.292 -2.478
4 HA CYS 1 HA CYS 1 -8.528 -0.938 -2.032
5 HB2 CYS 1 2HB CYS 1 -8.003 -3.219 -1.177
6 HB3 CYS 1 1HB CYS 1 -9.641 -2.719 -0.780
7 H VAL 2 H VAL 2 -6.301 -1.731 -2.442
8 HA VAL 2 HA VAL 2 -6.034 -2.291 -5.290
9 HB VAL 2 HB VAL 2 -3.783 -1.182 -5.153
10 HG11 VAL 2 1HG1 VAL 2 -5.708 -0.001 -6.045
11 HG12 VAL 2 2HG1 VAL 2 -4.673 1.106 -5.144
12 HG13 VAL 2 3HG1 VAL 2 -6.167 0.510 -4.423
13 HG21 VAL 2 3HG2 VAL 2 -4.781 -0.298 -2.445
14 HG22 VAL 2 1HG2 VAL 2 -3.345 0.319 -3.262
15 HG23 VAL 2 2HG2 VAL 2 -3.413 -1.368 -2.748
16 H LEU 3 H LEU 3 -3.976 -3.286 -5.930
17 HA LEU 3 HA LEU 3 -3.650 -5.689 -4.263
18 HB2 LEU 3 2HB LEU 3 -2.989 -5.513 -7.191
19 HB3 LEU 3 1HB LEU 3 -3.309 -6.921 -6.190
20 HG LEU 3 HG LEU 3 -5.378 -4.917 -7.075
21 HD11 LEU 3 1HD1 LEU 3 -4.563 -6.227 -8.937
22 HD12 LEU 3 2HD1 LEU 3 -6.203 -6.719 -8.513
23 HD13 LEU 3 3HD1 LEU 3 -4.829 -7.718 -8.033
24 HD21 LEU 3 3HD2 LEU 3 -5.678 -7.539 -5.616
25 HD22 LEU 3 1HD2 LEU 3 -7.005 -6.556 -6.236
26 HD23 LEU 3 2HD2 LEU 3 -5.970 -5.931 -4.954
27 H ILE 4 H ILE 4 -1.380 -6.817 -5.129
28 HA ILE 4 HA ILE 4 0.641 -5.256 -3.958
29 HB ILE 4 HB ILE 4 2.293 -6.897 -4.772
30 HG12 ILE 4 2HG1 ILE 4 -0.055 -8.215 -6.158
31 HG13 ILE 4 1HG1 ILE 4 1.263 -7.378 -6.967
32 HG21 ILE 4 1HG2 ILE 4 1.122 -7.312 -2.716
33 HG22 ILE 4 2HG2 ILE 4 1.409 -8.828 -3.569
34 HG23 ILE 4 3HG2 ILE 4 -0.194 -8.093 -3.593
35 HD11 ILE 4 3HD1 ILE 4 1.549 -9.792 -7.062
36 HD12 ILE 4 1HD1 ILE 4 1.510 -9.868 -5.301
37 HD13 ILE 4 2HD1 ILE 4 2.837 -9.043 -6.116
38 H GLY 5 H GLY 5 2.279 -4.045 -4.667
39 HA2 GLY 5 2HA GLY 5 3.644 -2.903 -6.155
40 HA3 GLY 5 1HA GLY 5 2.841 -3.698 -7.496
41 H GLN 6 H GLN 6 0.269 -2.744 -6.059
42 HA GLN 6 HA GLN 6 0.076 -0.309 -7.553
43 HB2 GLN 6 2HB GLN 6 -1.896 -1.900 -5.940
44 HB3 GLN 6 1HB GLN 6 -2.302 -0.363 -6.692
45 HG2 GLN 6 2HG GLN 6 -1.804 -1.248 -8.870
46 HG3 GLN 6 1HG GLN 6 -1.281 -2.774 -8.161
47 HE21 GLN 6 1HE2 GLN 6 -2.780 -3.856 -9.404
48 HE22 GLN 6 2HE2 GLN 6 -4.474 -3.825 -9.063
49 H ARG 7 H ARG 7 -0.810 1.565 -6.599
50 HA ARG 7 HA ARG 7 0.826 2.241 -4.331
51 HB2 ARG 7 2HB ARG 7 0.864 3.607 -6.340
52 HB3 ARG 7 1HB ARG 7 -0.858 3.903 -6.188
53 HG2 ARG 7 2HG ARG 7 -0.465 5.092 -4.100
54 HG3 ARG 7 1HG ARG 7 1.269 4.800 -4.263
55 HD2 ARG 7 2HD ARG 7 0.717 7.021 -5.066
56 HD3 ARG 7 1HD ARG 7 1.272 5.994 -6.383
57 HE ARG 7 HE ARG 7 -1.584 6.460 -5.872
58 HH11 ARG 7 1HH1 ARG 7 1.183 6.429 -8.093
59 HH12 ARG 7 2HH1 ARG 7 0.245 6.739 -9.483
60 HH21 ARG 7 1HH2 ARG 7 -2.870 6.923 -7.835
61 HH22 ARG 7 2HH2 ARG 7 -2.064 7.047 -9.322
62 H CYS 8 H CYS 8 0.103 2.606 -2.406
63 HA CYS 8 HA CYS 8 -2.785 2.755 -1.952
64 HB2 CYS 8 2HB CYS 8 -2.382 1.417 0.099
65 HB3 CYS 8 1HB CYS 8 -2.017 0.530 -1.378
66 H ASP 9 H ASP 9 -3.131 3.490 0.382
67 HA ASP 9 HA ASP 9 -1.060 5.192 1.488
68 HB2 ASP 9 2HB ASP 9 -2.507 6.675 0.046
69 HB3 ASP 9 1HB ASP 9 -3.888 6.188 1.019
70 H ASN 10 H ASN 10 -0.996 4.762 3.497
71 HA ASN 10 HA ASN 10 -2.441 2.689 4.675
72 HB2 ASN 10 2HB ASN 10 -0.805 4.797 6.082
73 HB3 ASN 10 1HB ASN 10 -1.346 3.288 6.794
74 HD21 ASN 10 1HD2 ASN 10 -0.394 1.364 6.092
75 HD22 ASN 10 2HD2 ASN 10 1.125 1.341 5.280
76 H ASP 11 H ASP 11 -2.780 6.177 5.122
77 HA ASP 11 HA ASP 11 -4.884 5.578 7.030
78 HB2 ASP 11 2HB ASP 11 -3.236 7.248 7.737
79 HB3 ASP 11 1HB ASP 11 -3.744 8.291 6.406
80 H ARG 12 H ARG 12 -4.536 7.512 4.057
81 HA ARG 12 HA ARG 12 -7.393 8.030 4.219
82 HB2 ARG 12 2HB ARG 12 -5.389 9.015 2.192
83 HB3 ARG 12 1HB ARG 12 -7.088 9.451 2.218
84 HG2 ARG 12 2HG ARG 12 -6.705 10.404 4.513
85 HG3 ARG 12 1HG ARG 12 -4.983 10.137 4.250
86 HD2 ARG 12 2HD ARG 12 -5.574 12.437 3.700
87 HD3 ARG 12 1HD ARG 12 -5.073 11.566 2.251
88 HE ARG 12 HE ARG 12 -7.743 11.256 2.210
89 HH11 ARG 12 1HH1 ARG 12 -5.746 14.170 2.457
90 HH12 ARG 12 2HH1 ARG 12 -6.934 15.203 1.816
91 HH21 ARG 12 1HH2 ARG 12 -9.325 12.628 1.337
92 HH22 ARG 12 2HH2 ARG 12 -9.053 14.296 1.127
93 H GLY 13 H GLY 13 -5.306 5.903 2.554
94 HA2 GLY 13 2HA GLY 13 -6.146 3.993 1.463
95 HA3 GLY 13 1HA GLY 13 -7.651 4.856 1.168
96 HA PRO 14 HA PRO 14 -7.663 3.107 -0.502
97 HB2 PRO 14 2HB PRO 14 -6.734 1.529 -2.463
98 HB3 PRO 14 1HB PRO 14 -7.867 2.850 -2.779
99 HG2 PRO 14 2HG PRO 14 -4.893 2.790 -3.128
100 HG3 PRO 14 1HG PRO 14 -6.129 3.419 -4.230
101 HD2 PRO 14 2HD PRO 14 -4.683 5.009 -2.578
102 HD3 PRO 14 1HD PRO 14 -6.352 5.388 -3.054
103 H ARG 15 H ARG 15 -7.217 0.880 0.046
104 HA ARG 15 HA ARG 15 -4.516 0.477 1.092
105 HB2 ARG 15 2HB ARG 15 -7.210 -0.218 2.229
106 HB3 ARG 15 1HB ARG 15 -5.719 -0.923 2.834
107 HG2 ARG 15 2HG ARG 15 -4.916 1.228 3.511
108 HG3 ARG 15 1HG ARG 15 -6.291 2.040 2.770
109 HD2 ARG 15 2HD ARG 15 -7.787 0.857 4.301
110 HD3 ARG 15 1HD ARG 15 -6.397 0.067 5.044
111 HE ARG 15 HE ARG 15 -5.655 2.451 5.522
112 HH11 ARG 15 1HH1 ARG 15 -9.086 1.522 5.383
113 HH12 ARG 15 2HH1 ARG 15 -9.558 2.609 6.598
114 HH21 ARG 15 1HH2 ARG 15 -6.315 3.923 7.161
115 HH22 ARG 15 2HH2 ARG 15 -7.941 4.018 7.655
116 H CYS 16 H CYS 16 -4.065 -1.817 1.394
117 HA CYS 16 HA CYS 16 -4.314 -3.209 -1.058
118 HB2 CYS 16 2HB CYS 16 -3.342 -4.195 1.607
119 HB3 CYS 16 1HB CYS 16 -2.884 -4.779 0.007
120 H CYS 17 H CYS 17 -5.590 -4.949 -1.558
121 HA CYS 17 HA CYS 17 -7.919 -5.488 -0.009
122 HB2 CYS 17 2HB CYS 17 -6.650 -7.196 -2.163
123 HB3 CYS 17 1HB CYS 17 -8.316 -7.291 -1.607
124 H SER 18 H SER 18 -8.424 -7.450 1.122
125 HA SER 18 HA SER 18 -6.403 -8.299 2.881
126 HB2 SER 18 2HB SER 18 -8.918 -8.074 3.321
127 HB3 SER 18 1HB SER 18 -9.111 -9.585 2.440
128 HG SER 18 HG SER 18 -7.597 -10.491 4.014
129 H GLY 19 H GLY 19 -4.802 -9.487 2.091
130 HA2 GLY 19 2HA GLY 19 -4.249 -11.874 1.631
131 HA3 GLY 19 1HA GLY 19 -5.441 -11.772 0.338
132 H GLN 20 H GLN 20 -4.373 -8.879 0.146
133 HA GLN 20 HA GLN 20 -2.454 -9.475 -1.928
134 HB2 GLN 20 2HB GLN 20 -3.799 -6.946 -1.025
135 HB3 GLN 20 1HB GLN 20 -2.589 -6.925 -2.286
136 HG2 GLN 20 2HG GLN 20 -5.133 -8.504 -2.323
137 HG3 GLN 20 1HG GLN 20 -4.865 -6.971 -3.164
138 HE21 GLN 20 1HE2 GLN 20 -5.581 -9.546 -4.210
139 HE22 GLN 20 2HE2 GLN 20 -4.366 -10.007 -5.337
140 H GLY 21 H GLY 21 -2.568 -7.703 1.136
141 HA2 GLY 21 2HA GLY 21 -0.132 -8.315 2.109
142 HA3 GLY 21 1HA GLY 21 0.230 -7.163 0.862
143 H ASN 22 H ASN 22 1.112 -6.081 2.571
144 HA ASN 22 HA ASN 22 -0.774 -4.449 4.108
145 HB2 ASN 22 2HB ASN 22 2.137 -5.144 4.635
146 HB3 ASN 22 1HB ASN 22 1.206 -3.986 5.574
147 HD21 ASN 22 1HD2 ASN 22 1.720 -7.385 4.874
148 HD22 ASN 22 2HD2 ASN 22 0.799 -7.965 6.202
149 H CYS 23 H CYS 23 -0.407 -2.227 4.008
150 HA CYS 23 HA CYS 23 0.785 -1.354 1.547
151 HB2 CYS 23 2HB CYS 23 -1.377 -0.441 2.292
152 HB3 CYS 23 1HB CYS 23 -0.617 0.185 3.750
153 H VAL 24 H VAL 24 2.945 -1.234 1.562
154 HA VAL 24 HA VAL 24 4.230 -0.109 3.907
155 HB VAL 24 HB VAL 24 5.312 -2.143 3.006
156 HG11 VAL 24 1HG1 VAL 24 4.722 -2.020 0.683
157 HG12 VAL 24 2HG1 VAL 24 6.472 -2.173 0.853
158 HG13 VAL 24 3HG1 VAL 24 5.756 -0.609 0.466
159 HG21 VAL 24 3HG2 VAL 24 7.624 -1.330 2.798
160 HG22 VAL 24 1HG2 VAL 24 6.753 -0.545 4.115
161 HG23 VAL 24 2HG2 VAL 24 7.012 0.312 2.597
162 HA PRO 25 HA PRO 25 3.820 3.690 1.825
163 HB2 PRO 25 2HB PRO 25 4.858 5.312 3.724
164 HB3 PRO 25 1HB PRO 25 3.261 4.569 3.865
165 HG2 PRO 25 2HG PRO 25 5.845 3.751 5.117
166 HG3 PRO 25 1HG PRO 25 4.215 3.757 5.811
167 HD2 PRO 25 2HD PRO 25 5.462 1.514 4.837
168 HD3 PRO 25 1HD PRO 25 3.700 1.717 4.919
169 H LEU 26 H LEU 26 4.948 5.118 0.700
170 HA LEU 26 HA LEU 26 7.867 5.059 0.786
171 HB2 LEU 26 2HB LEU 26 6.095 5.035 -1.671
172 HB3 LEU 26 1HB LEU 26 7.745 5.598 -1.738
173 HG LEU 26 HG LEU 26 8.432 3.280 -0.958
174 HD11 LEU 26 1HD1 LEU 26 6.302 2.526 -0.091
175 HD12 LEU 26 2HD1 LEU 26 6.911 1.458 -1.353
176 HD13 LEU 26 3HD1 LEU 26 5.611 2.594 -1.714
177 HD21 LEU 26 3HD2 LEU 26 8.717 4.004 -3.239
178 HD22 LEU 26 1HD2 LEU 26 7.051 3.557 -3.613
179 HD23 LEU 26 2HD2 LEU 26 8.224 2.312 -3.189
180 HA PRO 27 HA PRO 27 7.656 9.306 1.892
181 HB2 PRO 27 2HB PRO 27 9.682 9.514 -0.302
182 HB3 PRO 27 1HB PRO 27 9.683 10.265 1.299
183 HG2 PRO 27 2HG PRO 27 11.120 8.079 0.875
184 HG3 PRO 27 1HG PRO 27 10.212 8.281 2.381
185 HD2 PRO 27 2HD PRO 27 9.668 6.488 0.087
186 HD3 PRO 27 1HD PRO 27 9.237 6.309 1.800
187 H PHE 28 H PHE 28 8.132 9.073 -1.632
188 HA PHE 28 HA PHE 28 6.390 11.401 -2.008
189 HB2 PHE 28 2HB PHE 28 7.931 9.797 -4.045
190 HB3 PHE 28 1HB PHE 28 7.044 11.270 -4.355
191 HD1 PHE 28 1HD PHE 28 7.892 13.415 -3.380
192 HD2 PHE 28 2HD PHE 28 10.116 9.799 -3.295
193 HE1 PHE 28 1HE PHE 28 9.965 14.695 -3.047
194 HE2 PHE 28 2HE PHE 28 12.182 11.061 -2.952
195 HZ PHE 28 HZ PHE 28 12.116 13.498 -2.838
196 H LEU 29 H LEU 29 6.706 8.054 -2.896
197 HA LEU 29 HA LEU 29 4.563 8.132 -4.782
198 HB2 LEU 29 2HB LEU 29 6.055 5.714 -3.800
199 HB3 LEU 29 1HB LEU 29 5.169 5.884 -5.305
200 HG LEU 29 HG LEU 29 7.742 7.279 -4.572
201 HD11 LEU 29 1HD1 LEU 29 8.083 4.973 -5.130
202 HD12 LEU 29 2HD1 LEU 29 8.738 6.037 -6.369
203 HD13 LEU 29 3HD1 LEU 29 7.216 5.192 -6.654
204 HD21 LEU 29 3HD2 LEU 29 6.397 8.787 -5.902
205 HD22 LEU 29 1HD2 LEU 29 6.136 7.525 -7.114
206 HD23 LEU 29 2HD2 LEU 29 7.755 8.187 -6.838
207 H GLY 30 H GLY 30 4.463 7.936 -1.518
208 HA2 GLY 30 2HA GLY 30 2.521 7.846 -0.295
209 HA3 GLY 30 1HA GLY 30 1.704 7.053 -1.641
210 H GLY 31 H GLY 31 2.688 4.864 -2.113
211 HA2 GLY 31 2HA GLY 31 4.013 3.292 -0.348
212 HA3 GLY 31 1HA GLY 31 2.344 3.301 0.225
213 H VAL 32 H VAL 32 3.571 1.042 -0.657
214 HA VAL 32 HA VAL 32 1.841 0.433 -2.924
215 HB VAL 32 HB VAL 32 3.500 -1.092 -3.944
216 HG11 VAL 32 1HG1 VAL 32 4.968 0.558 -4.993
217 HG12 VAL 32 2HG1 VAL 32 4.473 1.747 -3.785
218 HG13 VAL 32 3HG1 VAL 32 3.289 1.087 -4.915
219 HG21 VAL 32 3HG2 VAL 32 5.892 -0.942 -3.349
220 HG22 VAL 32 1HG2 VAL 32 4.906 -1.578 -2.031
221 HG23 VAL 32 2HG2 VAL 32 5.463 0.093 -1.983
222 H CYS 33 H CYS 33 1.023 -1.585 -2.926
223 HA CYS 33 HA CYS 33 0.962 -2.897 -0.381
224 HB2 CYS 33 2HB CYS 33 -0.350 -3.526 -3.008
225 HB3 CYS 33 1HB CYS 33 -0.606 -4.453 -1.527
226 H ALA 34 H ALA 34 1.995 -4.690 0.256
227 HA ALA 34 HA ALA 34 3.223 -6.441 -1.618
228 HB1 ALA 34 1HB ALA 34 5.483 -6.133 -0.645
229 HB2 ALA 34 2HB ALA 34 4.880 -4.748 0.268
230 HB3 ALA 34 3HB ALA 34 4.926 -4.690 -1.494
231 H VAL 35 H VAL 35 4.346 -8.128 -0.273
232 HA VAL 35 HA VAL 35 2.577 -9.303 1.462
233 HB VAL 35 HB VAL 35 4.186 -10.645 0.318
234 HG11 VAL 35 1HG1 VAL 35 6.029 -9.077 0.182
235 HG12 VAL 35 2HG1 VAL 35 6.572 -10.638 0.786
236 HG13 VAL 35 3HG1 VAL 35 6.357 -9.287 1.903
237 HG21 VAL 35 3HG2 VAL 35 3.416 -11.569 2.407
238 HG22 VAL 35 1HG2 VAL 35 4.721 -10.766 3.281
239 HG23 VAL 35 2HG2 VAL 35 5.091 -12.043 2.120
Start of MODEL 9
1 H1 CYS 1 1HT CYS 1 -10.817 -3.421 -3.962
2 H2 CYS 1 2HT CYS 1 -10.749 -1.748 -3.916
3 H3 CYS 1 3HT CYS 1 -11.394 -2.618 -2.602
4 HA CYS 1 HA CYS 1 -9.141 -1.827 -2.194
5 HB2 CYS 1 2HB CYS 1 -8.222 -4.049 -1.513
6 HB3 CYS 1 1HB CYS 1 -9.894 -3.800 -1.036
7 H VAL 2 H VAL 2 -6.988 -1.775 -2.790
8 HA VAL 2 HA VAL 2 -6.557 -2.349 -5.610
9 HB VAL 2 HB VAL 2 -4.500 -0.903 -5.415
10 HG11 VAL 2 1HG1 VAL 2 -5.714 1.226 -5.259
11 HG12 VAL 2 2HG1 VAL 2 -7.096 0.375 -4.569
12 HG13 VAL 2 3HG1 VAL 2 -6.588 0.034 -6.223
13 HG21 VAL 2 3HG2 VAL 2 -4.078 -1.174 -3.019
14 HG22 VAL 2 1HG2 VAL 2 -5.578 -0.323 -2.653
15 HG23 VAL 2 2HG2 VAL 2 -4.251 0.531 -3.439
16 H LEU 3 H LEU 3 -3.935 -2.775 -5.951
17 HA LEU 3 HA LEU 3 -3.668 -5.301 -4.469
18 HB2 LEU 3 2HB LEU 3 -2.756 -4.916 -7.312
19 HB3 LEU 3 1HB LEU 3 -2.899 -6.386 -6.360
20 HG LEU 3 HG LEU 3 -5.235 -4.746 -7.353
21 HD11 LEU 3 1HD1 LEU 3 -5.627 -6.598 -8.885
22 HD12 LEU 3 2HD1 LEU 3 -4.130 -7.354 -8.341
23 HD13 LEU 3 3HD1 LEU 3 -4.081 -5.804 -9.183
24 HD21 LEU 3 3HD2 LEU 3 -6.591 -6.680 -6.677
25 HD22 LEU 3 1HD2 LEU 3 -5.769 -5.946 -5.300
26 HD23 LEU 3 2HD2 LEU 3 -5.153 -7.444 -6.001
27 H ILE 4 H ILE 4 -1.293 -6.247 -5.147
28 HA ILE 4 HA ILE 4 0.617 -4.885 -3.631
29 HB ILE 4 HB ILE 4 1.149 -6.869 -5.875
30 HG12 ILE 4 2HG1 ILE 4 0.781 -7.394 -2.918
31 HG13 ILE 4 1HG1 ILE 4 -0.393 -7.761 -4.173
32 HG21 ILE 4 1HG2 ILE 4 3.243 -7.387 -4.679
33 HG22 ILE 4 2HG2 ILE 4 2.890 -6.093 -3.532
34 HG23 ILE 4 3HG2 ILE 4 3.179 -5.712 -5.229
35 HD11 ILE 4 3HD1 ILE 4 1.169 -9.367 -5.157
36 HD12 ILE 4 1HD1 ILE 4 0.804 -9.754 -3.475
37 HD13 ILE 4 2HD1 ILE 4 2.340 -8.995 -3.892
38 H GLY 5 H GLY 5 2.123 -3.369 -4.081
39 HA2 GLY 5 2HA GLY 5 3.592 -2.066 -5.330
40 HA3 GLY 5 1HA GLY 5 2.966 -2.804 -6.796
41 H GLN 6 H GLN 6 0.269 -1.960 -5.322
42 HA GLN 6 HA GLN 6 0.196 0.590 -6.700
43 HB2 GLN 6 2HB GLN 6 -2.011 -1.085 -5.515
44 HB3 GLN 6 1HB GLN 6 -2.248 0.423 -6.380
45 HG2 GLN 6 2HG GLN 6 -1.364 -0.497 -8.414
46 HG3 GLN 6 1HG GLN 6 -0.909 -1.983 -7.589
47 HE21 GLN 6 1HE2 GLN 6 -2.112 -3.204 -9.031
48 HE22 GLN 6 2HE2 GLN 6 -3.831 -3.244 -8.997
49 H ARG 7 H ARG 7 -0.686 2.387 -5.702
50 HA ARG 7 HA ARG 7 0.464 2.678 -3.060
51 HB2 ARG 7 2HB ARG 7 0.972 4.195 -5.047
52 HB3 ARG 7 1HB ARG 7 -0.649 4.825 -4.875
53 HG2 ARG 7 2HG ARG 7 1.474 4.999 -2.729
54 HG3 ARG 7 1HG ARG 7 1.164 6.258 -3.916
55 HD2 ARG 7 2HD ARG 7 -0.724 5.238 -1.801
56 HD3 ARG 7 1HD ARG 7 0.067 6.816 -1.849
57 HE ARG 7 HE ARG 7 -1.327 6.554 -4.200
58 HH11 ARG 7 1HH1 ARG 7 -2.146 6.705 -0.762
59 HH12 ARG 7 2HH1 ARG 7 -3.660 7.445 -1.027
60 HH21 ARG 7 1HH2 ARG 7 -3.385 7.524 -4.549
61 HH22 ARG 7 2HH2 ARG 7 -4.385 7.904 -3.234
62 H CYS 8 H CYS 8 -0.627 2.968 -1.291
63 HA CYS 8 HA CYS 8 -3.547 3.201 -1.375
64 HB2 CYS 8 2HB CYS 8 -3.500 1.593 0.530
65 HB3 CYS 8 1HB CYS 8 -2.946 0.895 -0.994
66 H ASP 9 H ASP 9 -4.293 3.691 0.947
67 HA ASP 9 HA ASP 9 -2.423 4.983 2.721
68 HB2 ASP 9 2HB ASP 9 -3.208 6.870 1.174
69 HB3 ASP 9 1HB ASP 9 -4.848 6.489 1.706
70 H ASN 10 H ASN 10 -2.987 4.296 4.632
71 HA ASN 10 HA ASN 10 -5.271 2.596 4.908
72 HB2 ASN 10 2HB ASN 10 -3.310 3.547 7.006
73 HB3 ASN 10 1HB ASN 10 -4.505 2.278 7.237
74 HD21 ASN 10 1HD2 ASN 10 -4.171 0.266 6.253
75 HD22 ASN 10 2HD2 ASN 10 -2.644 -0.175 5.595
76 H ASP 11 H ASP 11 -4.582 5.854 5.591
77 HA ASP 11 HA ASP 11 -6.624 6.208 7.583
78 HB2 ASP 11 2HB ASP 11 -4.980 8.237 6.061
79 HB3 ASP 11 1HB ASP 11 -6.114 8.645 7.333
80 H ARG 12 H ARG 12 -6.209 7.415 4.271
81 HA ARG 12 HA ARG 12 -9.066 8.088 4.236
82 HB2 ARG 12 2HB ARG 12 -6.751 9.180 2.684
83 HB3 ARG 12 1HB ARG 12 -8.426 9.563 2.311
84 HG2 ARG 12 2HG ARG 12 -7.153 10.046 4.985
85 HG3 ARG 12 1HG ARG 12 -7.254 11.264 3.708
86 HD2 ARG 12 2HD ARG 12 -9.591 9.854 4.998
87 HD3 ARG 12 1HD ARG 12 -9.065 11.497 5.342
88 HE ARG 12 HE ARG 12 -9.403 11.696 2.774
89 HH11 ARG 12 1HH1 ARG 12 -11.521 10.043 5.085
90 HH12 ARG 12 2HH1 ARG 12 -12.937 10.346 4.205
91 HH21 ARG 12 1HH2 ARG 12 -11.363 12.115 1.572
92 HH22 ARG 12 2HH2 ARG 12 -12.859 11.559 2.171
93 H GLY 13 H GLY 13 -7.024 5.780 2.982
94 HA2 GLY 13 2HA GLY 13 -7.681 4.046 1.583
95 HA3 GLY 13 1HA GLY 13 -9.041 5.008 1.026
96 HA PRO 14 HA PRO 14 -8.634 3.225 -0.556
97 HB2 PRO 14 2HB PRO 14 -7.517 1.779 -2.509
98 HB3 PRO 14 1HB PRO 14 -8.519 3.186 -2.884
99 HG2 PRO 14 2HG PRO 14 -5.538 2.944 -2.837
100 HG3 PRO 14 1HG PRO 14 -6.574 3.773 -4.012
101 HD2 PRO 14 2HD PRO 14 -5.247 5.039 -1.958
102 HD3 PRO 14 1HD PRO 14 -6.719 5.659 -2.727
103 H ARG 15 H ARG 15 -8.186 0.884 -0.252
104 HA ARG 15 HA ARG 15 -5.582 0.383 0.985
105 HB2 ARG 15 2HB ARG 15 -8.322 -0.464 1.962
106 HB3 ARG 15 1HB ARG 15 -6.830 -1.182 2.552
107 HG2 ARG 15 2HG ARG 15 -6.087 1.038 3.325
108 HG3 ARG 15 1HG ARG 15 -7.622 1.716 2.787
109 HD2 ARG 15 2HD ARG 15 -7.348 -0.478 4.839
110 HD3 ARG 15 1HD ARG 15 -7.505 1.231 5.234
111 HE ARG 15 HE ARG 15 -9.605 0.366 3.548
112 HH11 ARG 15 1HH1 ARG 15 -8.521 0.167 6.922
113 HH12 ARG 15 2HH1 ARG 15 -10.101 0.096 7.557
114 HH21 ARG 15 1HH2 ARG 15 -11.803 0.243 4.481
115 HH22 ARG 15 2HH2 ARG 15 -11.971 0.098 6.159
116 H CYS 16 H CYS 16 -4.872 -1.808 0.843
117 HA CYS 16 HA CYS 16 -5.548 -2.940 -1.735
118 HB2 CYS 16 2HB CYS 16 -3.473 -3.753 0.274
119 HB3 CYS 16 1HB CYS 16 -3.586 -4.262 -1.410
120 H CYS 17 H CYS 17 -5.865 -5.137 -2.019
121 HA CYS 17 HA CYS 17 -7.815 -6.232 -0.279
122 HB2 CYS 17 2HB CYS 17 -6.222 -7.639 -2.443
123 HB3 CYS 17 1HB CYS 17 -7.811 -8.117 -1.830
124 H SER 18 H SER 18 -7.570 -8.289 0.958
125 HA SER 18 HA SER 18 -5.718 -8.082 2.916
126 HB2 SER 18 2HB SER 18 -7.092 -10.608 2.046
127 HB3 SER 18 1HB SER 18 -6.439 -10.271 3.653
128 HG SER 18 HG SER 18 -7.955 -8.239 3.157
129 H GLY 19 H GLY 19 -5.321 -10.269 0.098
130 HA2 GLY 19 2HA GLY 19 -2.704 -11.032 1.156
131 HA3 GLY 19 1HA GLY 19 -3.548 -11.832 -0.160
132 H GLN 20 H GLN 20 -3.368 -8.382 -0.130
133 HA GLN 20 HA GLN 20 -1.547 -8.529 -2.402
134 HB2 GLN 20 2HB GLN 20 -3.636 -6.476 -1.673
135 HB3 GLN 20 1HB GLN 20 -2.523 -6.272 -3.003
136 HG2 GLN 20 2HG GLN 20 -4.451 -8.546 -2.700
137 HG3 GLN 20 1HG GLN 20 -4.712 -7.112 -3.702
138 HE21 GLN 20 1HE2 GLN 20 -4.610 -9.901 -4.397
139 HE22 GLN 20 2HE2 GLN 20 -3.397 -10.082 -5.602
140 H GLY 21 H GLY 21 -0.863 -8.396 0.518
141 HA2 GLY 21 2HA GLY 21 1.200 -7.631 1.317
142 HA3 GLY 21 1HA GLY 21 1.150 -6.344 0.126
143 H ASN 22 H ASN 22 1.915 -5.406 2.270
144 HA ASN 22 HA ASN 22 -0.392 -4.249 3.691
145 HB2 ASN 22 2HB ASN 22 1.001 -5.664 5.189
146 HB3 ASN 22 1HB ASN 22 2.436 -4.792 4.671
147 HD21 ASN 22 1HD2 ASN 22 2.930 -4.190 6.798
148 HD22 ASN 22 2HD2 ASN 22 2.046 -2.985 7.633
149 H CYS 23 H CYS 23 -0.338 -2.015 3.848
150 HA CYS 23 HA CYS 23 1.083 -0.584 1.921
151 HB2 CYS 23 2HB CYS 23 -0.424 0.357 4.372
152 HB3 CYS 23 1HB CYS 23 0.241 1.449 3.169
153 H VAL 24 H VAL 24 3.180 -0.591 1.990
154 HA VAL 24 HA VAL 24 4.525 0.239 4.432
155 HB VAL 24 HB VAL 24 6.580 -0.766 3.487
156 HG11 VAL 24 1HG1 VAL 24 5.954 -3.135 3.689
157 HG12 VAL 24 2HG1 VAL 24 4.254 -2.671 3.611
158 HG13 VAL 24 3HG1 VAL 24 5.256 -2.131 4.960
159 HG21 VAL 24 3HG2 VAL 24 6.490 -2.234 1.514
160 HG22 VAL 24 1HG2 VAL 24 6.092 -0.566 1.096
161 HG23 VAL 24 2HG2 VAL 24 4.810 -1.768 1.248
162 HA PRO 25 HA PRO 25 5.202 4.015 2.336
163 HB2 PRO 25 2HB PRO 25 7.369 4.892 3.727
164 HB3 PRO 25 1HB PRO 25 5.718 4.979 4.350
165 HG2 PRO 25 2HG PRO 25 7.869 2.984 4.925
166 HG3 PRO 25 1HG PRO 25 6.695 3.717 6.032
167 HD2 PRO 25 2HD PRO 25 6.407 1.223 5.057
168 HD3 PRO 25 1HD PRO 25 5.021 2.273 5.414
169 H LEU 26 H LEU 26 6.007 4.092 0.387
170 HA LEU 26 HA LEU 26 8.767 3.277 -0.078
171 HB2 LEU 26 2HB LEU 26 7.100 1.984 -1.285
172 HB3 LEU 26 1HB LEU 26 6.414 3.474 -1.927
173 HG LEU 26 HG LEU 26 8.568 3.876 -3.107
174 HD11 LEU 26 1HD1 LEU 26 10.103 1.999 -3.392
175 HD12 LEU 26 2HD1 LEU 26 9.188 1.074 -2.201
176 HD13 LEU 26 3HD1 LEU 26 10.030 2.549 -1.721
177 HD21 LEU 26 3HD2 LEU 26 8.182 2.250 -4.865
178 HD22 LEU 26 1HD2 LEU 26 6.662 2.909 -4.264
179 HD23 LEU 26 2HD2 LEU 26 7.180 1.293 -3.775
180 HA PRO 27 HA PRO 27 8.773 7.823 -0.272
181 HB2 PRO 27 2HB PRO 27 11.693 7.433 -0.380
182 HB3 PRO 27 1HB PRO 27 10.722 8.296 0.822
183 HG2 PRO 27 2HG PRO 27 11.853 5.960 1.459
184 HG3 PRO 27 1HG PRO 27 10.192 6.340 1.978
185 HD2 PRO 27 2HD PRO 27 11.077 4.708 -0.361
186 HD3 PRO 27 1HD PRO 27 9.938 4.312 0.958
187 H PHE 28 H PHE 28 8.101 6.818 -2.522
188 HA PHE 28 HA PHE 28 9.546 8.315 -4.531
189 HB2 PHE 28 2HB PHE 28 8.941 5.352 -4.848
190 HB3 PHE 28 1HB PHE 28 9.391 6.409 -6.174
191 HD1 PHE 28 2HD PHE 28 11.682 7.244 -6.360
192 HD2 PHE 28 1HD PHE 28 10.566 4.519 -3.287
193 HE1 PHE 28 2HE PHE 28 14.051 6.734 -5.950
194 HE2 PHE 28 1HE PHE 28 12.930 4.008 -2.875
195 HZ PHE 28 HZ PHE 28 14.674 5.112 -4.204
196 H LEU 29 H LEU 29 6.952 5.865 -4.276
197 HA LEU 29 HA LEU 29 5.180 7.703 -5.719
198 HB2 LEU 29 2HB LEU 29 4.907 4.725 -5.267
199 HB3 LEU 29 1HB LEU 29 3.723 5.713 -6.081
200 HG LEU 29 HG LEU 29 4.843 4.575 -7.763
201 HD11 LEU 29 1HD1 LEU 29 5.996 6.245 -9.085
202 HD12 LEU 29 2HD1 LEU 29 6.100 7.286 -7.668
203 HD13 LEU 29 3HD1 LEU 29 4.523 6.861 -8.338
204 HD21 LEU 29 3HD2 LEU 29 6.757 3.729 -6.540
205 HD22 LEU 29 1HD2 LEU 29 7.481 5.338 -6.521
206 HD23 LEU 29 2HD2 LEU 29 7.286 4.476 -8.047
207 H GLY 30 H GLY 30 5.691 6.343 -2.609
208 HA2 GLY 30 2HA GLY 30 4.423 7.482 -0.848
209 HA3 GLY 30 1HA GLY 30 2.981 7.128 -1.801
210 H GLY 31 H GLY 31 2.344 6.015 0.269
211 HA2 GLY 31 2HA GLY 31 3.720 3.599 0.911
212 HA3 GLY 31 1HA GLY 31 2.140 4.036 1.527
213 H VAL 32 H VAL 32 3.546 1.769 0.061
214 HA VAL 32 HA VAL 32 1.344 1.193 -1.819
215 HB VAL 32 HB VAL 32 2.895 0.068 -3.345
216 HG11 VAL 32 1HG1 VAL 32 2.460 2.368 -3.851
217 HG12 VAL 32 2HG1 VAL 32 4.153 2.009 -4.211
218 HG13 VAL 32 3HG1 VAL 32 3.731 2.889 -2.746
219 HG21 VAL 32 3HG2 VAL 32 4.605 -0.648 -1.759
220 HG22 VAL 32 1HG2 VAL 32 5.110 1.026 -1.527
221 HG23 VAL 32 2HG2 VAL 32 5.337 0.244 -3.093
222 H CYS 33 H CYS 33 0.839 -1.030 -1.974
223 HA CYS 33 HA CYS 33 1.537 -2.432 0.442
224 HB2 CYS 33 2HB CYS 33 -0.312 -3.211 -1.782
225 HB3 CYS 33 1HB CYS 33 -0.056 -4.125 -0.304
226 H ALA 34 H ALA 34 3.169 -3.622 0.619
227 HA ALA 34 HA ALA 34 3.903 -5.451 -1.510
228 HB1 ALA 34 1HB ALA 34 5.874 -3.464 -0.361
229 HB2 ALA 34 2HB ALA 34 5.232 -3.440 -2.001
230 HB3 ALA 34 3HB ALA 34 6.260 -4.774 -1.477
231 H VAL 35 H VAL 35 5.650 -6.927 -0.707
232 HA VAL 35 HA VAL 35 5.858 -7.171 2.181
233 HB VAL 35 HB VAL 35 5.254 -9.544 0.372
234 HG11 VAL 35 1HG1 VAL 35 5.437 -9.340 3.363
235 HG12 VAL 35 2HG1 VAL 35 6.596 -10.110 2.280
236 HG13 VAL 35 3HG1 VAL 35 4.976 -10.787 2.467
237 HG21 VAL 35 3HG2 VAL 35 3.354 -8.219 2.313
238 HG22 VAL 35 1HG2 VAL 35 3.053 -9.722 1.440
239 HG23 VAL 35 2HG2 VAL 35 3.220 -8.206 0.555
Start of MODEL 10
1 H1 CYS 1 1HT CYS 1 -10.488 -0.980 -4.279
2 H2 CYS 1 2HT CYS 1 -11.293 -1.860 -3.073
3 H3 CYS 1 3HT CYS 1 -10.686 -2.649 -4.431
4 HA CYS 1 HA CYS 1 -9.048 -1.295 -2.405
5 HB2 CYS 1 2HB CYS 1 -8.350 -3.591 -1.812
6 HB3 CYS 1 1HB CYS 1 -10.071 -3.376 -1.548
7 H VAL 2 H VAL 2 -6.711 -2.023 -2.722
8 HA VAL 2 HA VAL 2 -6.148 -2.213 -5.589
9 HB VAL 2 HB VAL 2 -4.053 -0.946 -5.176
10 HG11 VAL 2 1HG1 VAL 2 -5.122 1.251 -4.888
11 HG12 VAL 2 2HG1 VAL 2 -6.603 0.428 -4.388
12 HG13 VAL 2 3HG1 VAL 2 -5.978 0.202 -6.018
13 HG21 VAL 2 3HG2 VAL 2 -3.815 0.334 -3.099
14 HG22 VAL 2 1HG2 VAL 2 -3.748 -1.405 -2.803
15 HG23 VAL 2 2HG2 VAL 2 -5.217 -0.503 -2.429
16 H LEU 3 H LEU 3 -4.044 -3.114 -6.132
17 HA LEU 3 HA LEU 3 -3.656 -5.497 -4.468
18 HB2 LEU 3 2HB LEU 3 -2.955 -5.157 -7.388
19 HB3 LEU 3 1HB LEU 3 -2.865 -6.604 -6.395
20 HG LEU 3 HG LEU 3 -5.441 -5.227 -7.128
21 HD11 LEU 3 1HD1 LEU 3 -4.357 -6.123 -9.112
22 HD12 LEU 3 2HD1 LEU 3 -5.771 -7.085 -8.684
23 HD13 LEU 3 3HD1 LEU 3 -4.154 -7.682 -8.312
24 HD21 LEU 3 3HD2 LEU 3 -6.455 -7.335 -6.364
25 HD22 LEU 3 1HD2 LEU 3 -5.584 -6.513 -5.070
26 HD23 LEU 3 2HD2 LEU 3 -4.862 -7.908 -5.871
27 H ILE 4 H ILE 4 -1.367 -6.474 -5.142
28 HA ILE 4 HA ILE 4 0.586 -4.975 -3.867
29 HB ILE 4 HB ILE 4 2.232 -6.594 -4.862
30 HG12 ILE 4 2HG1 ILE 4 -0.261 -7.765 -6.143
31 HG13 ILE 4 1HG1 ILE 4 1.072 -7.006 -7.000
32 HG21 ILE 4 1HG2 ILE 4 1.183 -7.023 -2.727
33 HG22 ILE 4 2HG2 ILE 4 1.356 -8.532 -3.625
34 HG23 ILE 4 3HG2 ILE 4 -0.215 -7.737 -3.529
35 HD11 ILE 4 3HD1 ILE 4 1.217 -9.551 -5.396
36 HD12 ILE 4 1HD1 ILE 4 2.556 -8.807 -6.272
37 HD13 ILE 4 2HD1 ILE 4 1.162 -9.431 -7.155
38 H GLY 5 H GLY 5 2.150 -3.620 -4.447
39 HA2 GLY 5 2HA GLY 5 3.646 -2.506 -5.840
40 HA3 GLY 5 1HA GLY 5 2.836 -3.180 -7.242
41 H GLN 6 H GLN 6 0.312 -2.153 -5.718
42 HA GLN 6 HA GLN 6 0.267 0.343 -7.163
43 HB2 GLN 6 2HB GLN 6 -1.851 -1.232 -5.721
44 HB3 GLN 6 1HB GLN 6 -2.154 0.287 -6.564
45 HG2 GLN 6 2HG GLN 6 -1.464 -0.697 -8.653
46 HG3 GLN 6 1HG GLN 6 -1.020 -2.188 -7.828
47 HE21 GLN 6 1HE2 GLN 6 -2.382 -3.372 -9.073
48 HE22 GLN 6 2HE2 GLN 6 -4.103 -3.333 -8.897
49 H ARG 7 H ARG 7 -0.765 2.168 -6.168
50 HA ARG 7 HA ARG 7 0.677 2.905 -3.774
51 HB2 ARG 7 2HB ARG 7 0.693 4.391 -5.677
52 HB3 ARG 7 1HB ARG 7 -1.057 4.376 -5.756
53 HG2 ARG 7 2HG ARG 7 -1.102 5.525 -3.557
54 HG3 ARG 7 1HG ARG 7 0.658 5.653 -3.643
55 HD2 ARG 7 2HD ARG 7 0.526 6.955 -5.656
56 HD3 ARG 7 1HD ARG 7 -1.215 6.692 -5.758
57 HE ARG 7 HE ARG 7 -0.095 8.074 -3.447
58 HH11 ARG 7 1HH1 ARG 7 -2.007 8.232 -6.436
59 HH12 ARG 7 2HH1 ARG 7 -2.762 9.706 -6.050
60 HH21 ARG 7 1HH2 ARG 7 -1.140 10.125 -2.938
61 HH22 ARG 7 2HH2 ARG 7 -2.260 10.827 -4.018
62 H CYS 8 H CYS 8 -0.243 2.863 -1.834
63 HA CYS 8 HA CYS 8 -3.162 3.002 -1.642
64 HB2 CYS 8 2HB CYS 8 -3.107 1.218 0.018
65 HB3 CYS 8 1HB CYS 8 -2.509 0.664 -1.539
66 H ASP 9 H ASP 9 -3.834 3.364 0.616
67 HA ASP 9 HA ASP 9 -1.890 4.499 2.428
68 HB2 ASP 9 2HB ASP 9 -2.674 6.493 1.143
69 HB3 ASP 9 1HB ASP 9 -4.336 6.090 1.584
70 H ASN 10 H ASN 10 -2.385 4.063 4.401
71 HA ASN 10 HA ASN 10 -4.188 1.946 4.849
72 HB2 ASN 10 2HB ASN 10 -2.696 3.587 6.886
73 HB3 ASN 10 1HB ASN 10 -3.477 2.037 7.159
74 HD21 ASN 10 1HD2 ASN 10 -0.740 3.680 5.846
75 HD22 ASN 10 2HD2 ASN 10 0.202 2.279 5.532
76 H ASP 11 H ASP 11 -4.315 5.357 5.658
77 HA ASP 11 HA ASP 11 -6.723 4.867 7.230
78 HB2 ASP 11 2HB ASP 11 -5.021 6.269 8.265
79 HB3 ASP 11 1HB ASP 11 -5.131 7.397 6.920
80 H ARG 12 H ARG 12 -5.680 6.895 4.527
81 HA ARG 12 HA ARG 12 -8.368 7.909 4.206
82 HB2 ARG 12 2HB ARG 12 -5.872 8.455 2.612
83 HB3 ARG 12 1HB ARG 12 -7.408 9.280 2.410
84 HG2 ARG 12 2HG ARG 12 -7.237 10.135 4.695
85 HG3 ARG 12 1HG ARG 12 -5.690 9.311 4.872
86 HD2 ARG 12 2HD ARG 12 -5.336 11.662 4.351
87 HD3 ARG 12 1HD ARG 12 -4.775 10.643 3.029
88 HE ARG 12 HE ARG 12 -7.419 11.390 2.535
89 HH11 ARG 12 1HH1 ARG 12 -4.211 12.906 2.684
90 HH12 ARG 12 2HH1 ARG 12 -4.566 14.127 1.566
91 HH21 ARG 12 1HH2 ARG 12 -7.918 13.075 0.955
92 HH22 ARG 12 2HH2 ARG 12 -6.746 14.221 0.532
93 H GLY 13 H GLY 13 -6.386 5.463 2.825
94 HA2 GLY 13 2HA GLY 13 -7.280 3.780 1.425
95 HA3 GLY 13 1HA GLY 13 -8.493 4.933 0.864
96 HA PRO 14 HA PRO 14 -8.090 3.125 -0.757
97 HB2 PRO 14 2HB PRO 14 -6.940 1.654 -2.690
98 HB3 PRO 14 1HB PRO 14 -7.897 3.090 -3.064
99 HG2 PRO 14 2HG PRO 14 -4.945 2.735 -3.034
100 HG3 PRO 14 1HG PRO 14 -5.947 3.734 -4.097
101 HD2 PRO 14 2HD PRO 14 -4.512 4.654 -1.894
102 HD3 PRO 14 1HD PRO 14 -5.846 5.502 -2.689
103 H ARG 15 H ARG 15 -7.925 0.883 -0.239
104 HA ARG 15 HA ARG 15 -5.498 0.274 1.268
105 HB2 ARG 15 2HB ARG 15 -8.370 -0.528 1.686
106 HB3 ARG 15 1HB ARG 15 -7.034 -1.304 2.525
107 HG2 ARG 15 2HG ARG 15 -6.410 0.850 3.514
108 HG3 ARG 15 1HG ARG 15 -7.752 1.618 2.668
109 HD2 ARG 15 2HD ARG 15 -9.355 0.384 3.903
110 HD3 ARG 15 1HD ARG 15 -8.116 -0.683 4.566
111 HE ARG 15 HE ARG 15 -7.376 1.793 5.390
112 HH11 ARG 15 1HH1 ARG 15 -10.375 -0.044 5.752
113 HH12 ARG 15 2HH1 ARG 15 -10.742 0.588 7.287
114 HH21 ARG 15 1HH2 ARG 15 -7.840 2.606 7.468
115 HH22 ARG 15 2HH2 ARG 15 -9.251 2.142 8.315
116 H CYS 16 H CYS 16 -4.686 -1.779 1.197
117 HA CYS 16 HA CYS 16 -4.652 -3.101 -1.284
118 HB2 CYS 16 2HB CYS 16 -3.823 -4.144 1.433
119 HB3 CYS 16 1HB CYS 16 -3.238 -4.694 -0.133
120 H CYS 17 H CYS 17 -5.706 -4.963 -1.927
121 HA CYS 17 HA CYS 17 -8.175 -5.672 -0.707
122 HB2 CYS 17 2HB CYS 17 -6.450 -7.277 -2.629
123 HB3 CYS 17 1HB CYS 17 -8.170 -7.532 -2.325
124 H SER 18 H SER 18 -8.661 -7.500 0.624
125 HA SER 18 HA SER 18 -6.932 -8.015 2.664
126 HB2 SER 18 2HB SER 18 -8.618 -9.960 3.042
127 HB3 SER 18 1HB SER 18 -9.181 -8.287 3.107
128 HG SER 18 HG SER 18 -9.271 -9.904 0.768
129 H GLY 19 H GLY 19 -4.935 -8.644 1.894
130 HA2 GLY 19 2HA GLY 19 -3.678 -10.797 2.145
131 HA3 GLY 19 1HA GLY 19 -4.743 -11.400 0.878
132 H GLN 20 H GLN 20 -3.624 -8.125 0.775
133 HA GLN 20 HA GLN 20 -1.808 -8.848 -1.387
134 HB2 GLN 20 2HB GLN 20 -3.718 -6.576 -1.110
135 HB3 GLN 20 1HB GLN 20 -2.345 -6.393 -2.181
136 HG2 GLN 20 2HG GLN 20 -4.445 -8.537 -2.311
137 HG3 GLN 20 1HG GLN 20 -4.324 -7.138 -3.378
138 HE21 GLN 20 1HE2 GLN 20 -2.951 -10.214 -2.517
139 HE22 GLN 20 2HE2 GLN 20 -1.970 -10.397 -3.922
140 H GLY 21 H GLY 21 -1.187 -8.666 1.402
141 HA2 GLY 21 2HA GLY 21 0.897 -8.137 2.335
142 HA3 GLY 21 1HA GLY 21 1.124 -6.990 1.036
143 H ASN 22 H ASN 22 1.817 -5.470 2.433
144 HA ASN 22 HA ASN 22 -0.322 -4.115 3.904
145 HB2 ASN 22 2HB ASN 22 1.248 -3.483 5.661
146 HB3 ASN 22 1HB ASN 22 1.268 -5.228 5.510
147 HD21 ASN 22 1HD2 ASN 22 3.218 -3.350 6.604
148 HD22 ASN 22 2HD2 ASN 22 4.692 -3.665 5.781
149 H CYS 23 H CYS 23 0.052 -1.816 4.010
150 HA CYS 23 HA CYS 23 1.271 -0.795 1.631
151 HB2 CYS 23 2HB CYS 23 -0.038 0.572 3.983
152 HB3 CYS 23 1HB CYS 23 0.676 1.452 2.639
153 H VAL 24 H VAL 24 3.403 -1.039 1.648
154 HA VAL 24 HA VAL 24 4.847 -0.091 3.957
155 HB VAL 24 HB VAL 24 5.564 -2.213 2.880
156 HG11 VAL 24 1HG1 VAL 24 6.804 -2.228 0.772
157 HG12 VAL 24 2HG1 VAL 24 6.365 -0.539 0.523
158 HG13 VAL 24 3HG1 VAL 24 5.111 -1.777 0.569
159 HG21 VAL 24 3HG2 VAL 24 7.153 -1.017 4.203
160 HG22 VAL 24 1HG2 VAL 24 7.635 -0.031 2.820
161 HG23 VAL 24 2HG2 VAL 24 7.977 -1.767 2.837
162 HA PRO 25 HA PRO 25 4.900 3.826 1.998
163 HB2 PRO 25 2HB PRO 25 6.272 5.182 3.887
164 HB3 PRO 25 1HB PRO 25 4.584 4.705 4.088
165 HG2 PRO 25 2HG PRO 25 7.055 3.444 5.186
166 HG3 PRO 25 1HG PRO 25 5.474 3.665 5.958
167 HD2 PRO 25 2HD PRO 25 6.347 1.314 4.848
168 HD3 PRO 25 1HD PRO 25 4.637 1.752 5.031
169 H LEU 26 H LEU 26 6.133 4.778 0.596
170 HA LEU 26 HA LEU 26 9.019 4.550 0.712
171 HB2 LEU 26 2HB LEU 26 7.314 3.868 -1.688
172 HB3 LEU 26 1HB LEU 26 9.041 4.148 -1.766
173 HG LEU 26 HG LEU 26 7.737 1.967 -0.169
174 HD11 LEU 26 1HD1 LEU 26 7.451 1.607 -2.575
175 HD12 LEU 26 2HD1 LEU 26 8.618 0.462 -1.912
176 HD13 LEU 26 3HD1 LEU 26 9.178 1.864 -2.825
177 HD21 LEU 26 3HD2 LEU 26 10.631 2.524 -0.814
178 HD22 LEU 26 1HD2 LEU 26 10.032 1.061 -0.029
179 HD23 LEU 26 2HD2 LEU 26 9.862 2.618 0.770
180 HA PRO 27 HA PRO 27 8.435 8.853 0.144
181 HB2 PRO 27 2HB PRO 27 11.028 9.535 -0.272
182 HB3 PRO 27 1HB PRO 27 10.400 9.065 1.318
183 HG2 PRO 27 2HG PRO 27 11.940 7.469 -0.683
184 HG3 PRO 27 1HG PRO 27 12.097 7.511 1.081
185 HD2 PRO 27 2HD PRO 27 10.785 5.538 -0.266
186 HD3 PRO 27 1HD PRO 27 10.368 6.011 1.385
187 H PHE 28 H PHE 28 7.617 7.699 -2.090
188 HA PHE 28 HA PHE 28 8.624 9.493 -4.186
189 HB2 PHE 28 2HB PHE 28 8.120 6.538 -4.710
190 HB3 PHE 28 1HB PHE 28 8.627 7.733 -5.893
191 HD1 PHE 28 1HD PHE 28 10.924 8.725 -5.707
192 HD2 PHE 28 2HD PHE 28 9.653 5.414 -3.360
193 HE1 PHE 28 1HE PHE 28 13.268 8.188 -5.194
194 HE2 PHE 28 2HE PHE 28 11.988 4.873 -2.842
195 HZ PHE 28 HZ PHE 28 13.794 6.259 -3.753
196 H LEU 29 H LEU 29 6.361 6.792 -3.887
197 HA LEU 29 HA LEU 29 4.283 8.566 -4.895
198 HB2 LEU 29 2HB LEU 29 3.091 6.654 -5.768
199 HB3 LEU 29 1HB LEU 29 4.713 6.706 -6.398
200 HG LEU 29 HG LEU 29 3.726 4.796 -4.257
201 HD11 LEU 29 1HD1 LEU 29 4.281 4.359 -7.182
202 HD12 LEU 29 2HD1 LEU 29 2.696 4.379 -6.413
203 HD13 LEU 29 3HD1 LEU 29 3.853 3.107 -6.018
204 HD21 LEU 29 3HD2 LEU 29 5.841 3.555 -4.750
205 HD22 LEU 29 1HD2 LEU 29 6.146 5.133 -4.030
206 HD23 LEU 29 2HD2 LEU 29 6.366 4.900 -5.756
207 H GLY 30 H GLY 30 5.268 7.444 -2.019
208 HA2 GLY 30 2HA GLY 30 3.920 8.080 -0.131
209 HA3 GLY 30 1HA GLY 30 2.515 7.491 -1.012
210 H GLY 31 H GLY 31 2.213 5.250 -1.232
211 HA2 GLY 31 2HA GLY 31 4.047 3.486 0.153
212 HA3 GLY 31 1HA GLY 31 2.445 3.636 0.876
213 H VAL 32 H VAL 32 3.738 1.328 -0.336
214 HA VAL 32 HA VAL 32 1.724 0.801 -2.412
215 HB VAL 32 HB VAL 32 3.334 -0.647 -3.622
216 HG11 VAL 32 1HG1 VAL 32 4.660 1.133 -4.656
217 HG12 VAL 32 2HG1 VAL 32 4.209 2.213 -3.335
218 HG13 VAL 32 3HG1 VAL 32 2.972 1.587 -4.427
219 HG21 VAL 32 3HG2 VAL 32 5.400 0.535 -1.762
220 HG22 VAL 32 1HG2 VAL 32 5.747 -0.445 -3.188
221 HG23 VAL 32 2HG2 VAL 32 4.890 -1.152 -1.819
222 H CYS 33 H CYS 33 0.827 -1.178 -2.443
223 HA CYS 33 HA CYS 33 0.881 -2.774 -0.083
224 HB2 CYS 33 2HB CYS 33 -0.258 -3.381 -2.823
225 HB3 CYS 33 1HB CYS 33 -0.590 -4.305 -1.361
226 H ALA 34 H ALA 34 2.363 -4.279 0.411
227 HA ALA 34 HA ALA 34 3.642 -5.792 -1.734
228 HB1 ALA 34 1HB ALA 34 5.144 -3.920 -1.250
229 HB2 ALA 34 2HB ALA 34 5.840 -5.457 -0.733
230 HB3 ALA 34 3HB ALA 34 5.140 -4.362 0.457
231 H VAL 35 H VAL 35 3.945 -7.900 -1.182
232 HA VAL 35 HA VAL 35 3.072 -8.703 1.453
233 HB VAL 35 HB VAL 35 3.890 -10.412 -0.931
234 HG11 VAL 35 1HG1 VAL 35 2.774 -12.243 0.274
235 HG12 VAL 35 2HG1 VAL 35 2.533 -11.162 1.650
236 HG13 VAL 35 3HG1 VAL 35 4.164 -11.601 1.149
237 HG21 VAL 35 3HG2 VAL 35 1.487 -10.828 -1.233
238 HG22 VAL 35 1HG2 VAL 35 1.879 -9.118 -1.427
239 HG23 VAL 35 2HG2 VAL 35 1.133 -9.688 0.065
Start of MODEL 11
1 H1 CYS 1 1HT CYS 1 -10.893 -1.268 -2.431
2 H2 CYS 1 2HT CYS 1 -10.478 -2.132 -3.830
3 H3 CYS 1 3HT CYS 1 -10.095 -0.505 -3.709
4 HA CYS 1 HA CYS 1 -8.545 -0.931 -1.998
5 HB2 CYS 1 2HB CYS 1 -8.048 -3.280 -1.371
6 HB3 CYS 1 1HB CYS 1 -9.688 -2.821 -0.939
7 H VAL 2 H VAL 2 -6.349 -1.665 -2.508
8 HA VAL 2 HA VAL 2 -6.054 -2.048 -5.387
9 HB VAL 2 HB VAL 2 -3.815 -0.977 -5.162
10 HG11 VAL 2 1HG1 VAL 2 -5.705 0.324 -5.928
11 HG12 VAL 2 2HG1 VAL 2 -4.636 1.320 -4.940
12 HG13 VAL 2 3HG1 VAL 2 -6.143 0.700 -4.265
13 HG21 VAL 2 3HG2 VAL 2 -3.416 -1.393 -2.797
14 HG22 VAL 2 1HG2 VAL 2 -4.755 -0.326 -2.372
15 HG23 VAL 2 2HG2 VAL 2 -3.316 0.332 -3.151
16 H LEU 3 H LEU 3 -4.028 -3.061 -6.039
17 HA LEU 3 HA LEU 3 -3.714 -5.507 -4.464
18 HB2 LEU 3 2HB LEU 3 -3.099 -5.113 -7.390
19 HB3 LEU 3 1HB LEU 3 -3.172 -6.596 -6.454
20 HG LEU 3 HG LEU 3 -5.569 -4.886 -7.098
21 HD11 LEU 3 1HD1 LEU 3 -4.638 -5.884 -9.106
22 HD12 LEU 3 2HD1 LEU 3 -6.155 -6.667 -8.663
23 HD13 LEU 3 3HD1 LEU 3 -4.621 -7.466 -8.328
24 HD21 LEU 3 3HD2 LEU 3 -5.835 -6.181 -5.044
25 HD22 LEU 3 1HD2 LEU 3 -5.337 -7.647 -5.894
26 HD23 LEU 3 2HD2 LEU 3 -6.839 -6.838 -6.334
27 H ILE 4 H ILE 4 -1.483 -6.578 -5.399
28 HA ILE 4 HA ILE 4 0.571 -5.245 -4.073
29 HB ILE 4 HB ILE 4 2.123 -6.885 -5.137
30 HG12 ILE 4 2HG1 ILE 4 -0.392 -7.903 -6.498
31 HG13 ILE 4 1HG1 ILE 4 0.940 -7.093 -7.310
32 HG21 ILE 4 1HG2 ILE 4 -0.403 -7.988 -3.929
33 HG22 ILE 4 2HG2 ILE 4 1.015 -7.405 -3.057
34 HG23 ILE 4 3HG2 ILE 4 1.126 -8.855 -4.058
35 HD11 ILE 4 3HD1 ILE 4 2.421 -8.938 -6.701
36 HD12 ILE 4 1HD1 ILE 4 1.030 -9.499 -7.629
37 HD13 ILE 4 2HD1 ILE 4 1.081 -9.738 -5.882
38 H GLY 5 H GLY 5 1.988 -3.770 -4.558
39 HA2 GLY 5 2HA GLY 5 3.551 -2.617 -5.873
40 HA3 GLY 5 1HA GLY 5 2.805 -3.272 -7.318
41 H GLN 6 H GLN 6 0.211 -2.364 -5.850
42 HA GLN 6 HA GLN 6 0.190 0.202 -7.179
43 HB2 GLN 6 2HB GLN 6 -2.012 -1.375 -5.860
44 HB3 GLN 6 1HB GLN 6 -2.255 0.110 -6.782
45 HG2 GLN 6 2HG GLN 6 -1.347 -1.066 -8.777
46 HG3 GLN 6 1HG GLN 6 -1.261 -2.542 -7.819
47 HE21 GLN 6 1HE2 GLN 6 -2.766 -2.046 -10.212
48 HE22 GLN 6 2HE2 GLN 6 -4.415 -2.370 -9.801
49 H ARG 7 H ARG 7 -0.847 1.983 -6.050
50 HA ARG 7 HA ARG 7 0.561 2.378 -3.566
51 HB2 ARG 7 2HB ARG 7 0.737 4.015 -5.367
52 HB3 ARG 7 1HB ARG 7 -1.001 4.261 -5.332
53 HG2 ARG 7 2HG ARG 7 -0.808 5.107 -3.045
54 HG3 ARG 7 1HG ARG 7 0.940 4.908 -3.136
55 HD2 ARG 7 2HD ARG 7 1.014 6.467 -5.025
56 HD3 ARG 7 1HD ARG 7 -0.734 6.684 -4.907
57 HE ARG 7 HE ARG 7 0.106 7.244 -2.439
58 HH11 ARG 7 1HH1 ARG 7 0.994 8.509 -5.596
59 HH12 ARG 7 2HH1 ARG 7 1.534 10.017 -4.994
60 HH21 ARG 7 1HH2 ARG 7 0.836 9.336 -1.622
61 HH22 ARG 7 2HH2 ARG 7 1.478 10.473 -2.698
62 H CYS 8 H CYS 8 -0.354 2.511 -1.646
63 HA CYS 8 HA CYS 8 -3.272 2.628 -1.458
64 HB2 CYS 8 2HB CYS 8 -3.013 1.160 0.549
65 HB3 CYS 8 1HB CYS 8 -2.687 0.376 -0.990
66 H ASP 9 H ASP 9 -4.052 3.511 0.460
67 HA ASP 9 HA ASP 9 -2.188 5.016 2.181
68 HB2 ASP 9 2HB ASP 9 -3.276 6.592 0.444
69 HB3 ASP 9 1HB ASP 9 -4.820 6.168 1.203
70 H ASN 10 H ASN 10 -2.695 4.603 4.247
71 HA ASN 10 HA ASN 10 -4.973 2.906 4.721
72 HB2 ASN 10 2HB ASN 10 -2.771 3.827 6.552
73 HB3 ASN 10 1HB ASN 10 -4.183 2.980 7.155
74 HD21 ASN 10 1HD2 ASN 10 -1.186 2.666 5.468
75 HD22 ASN 10 2HD2 ASN 10 -1.245 0.949 5.309
76 H ASP 11 H ASP 11 -4.171 6.199 5.192
77 HA ASP 11 HA ASP 11 -6.114 6.664 7.234
78 HB2 ASP 11 2HB ASP 11 -4.658 8.623 5.462
79 HB3 ASP 11 1HB ASP 11 -5.682 9.079 6.817
80 H ARG 12 H ARG 12 -5.980 7.497 3.806
81 HA ARG 12 HA ARG 12 -8.857 8.014 3.982
82 HB2 ARG 12 2HB ARG 12 -6.864 9.079 2.012
83 HB3 ARG 12 1HB ARG 12 -8.595 9.323 1.884
84 HG2 ARG 12 2HG ARG 12 -6.898 10.255 4.189
85 HG3 ARG 12 1HG ARG 12 -7.370 11.262 2.821
86 HD2 ARG 12 2HD ARG 12 -8.882 11.775 4.591
87 HD3 ARG 12 1HD ARG 12 -9.764 10.772 3.448
88 HE ARG 12 HE ARG 12 -8.585 9.253 5.564
89 HH11 ARG 12 1HH1 ARG 12 -11.409 11.234 4.758
90 HH12 ARG 12 2HH1 ARG 12 -12.403 10.552 5.949
91 HH21 ARG 12 1HH2 ARG 12 -9.923 8.336 7.197
92 HH22 ARG 12 2HH2 ARG 12 -11.544 8.823 7.365
93 H GLY 13 H GLY 13 -6.640 5.849 2.621
94 HA2 GLY 13 2HA GLY 13 -7.281 3.889 1.537
95 HA3 GLY 13 1HA GLY 13 -8.840 4.627 1.174
96 HA PRO 14 HA PRO 14 -8.531 2.738 -0.357
97 HB2 PRO 14 2HB PRO 14 -7.537 1.275 -2.358
98 HB3 PRO 14 1HB PRO 14 -8.779 2.496 -2.659
99 HG2 PRO 14 2HG PRO 14 -5.814 2.691 -3.033
100 HG3 PRO 14 1HG PRO 14 -7.102 3.187 -4.142
101 HD2 PRO 14 2HD PRO 14 -5.808 4.930 -2.515
102 HD3 PRO 14 1HD PRO 14 -7.503 5.141 -2.996
103 H ARG 15 H ARG 15 -7.796 0.662 0.353
104 HA ARG 15 HA ARG 15 -4.969 0.609 1.097
105 HB2 ARG 15 2HB ARG 15 -7.383 -0.613 2.428
106 HB3 ARG 15 1HB ARG 15 -5.737 -0.981 2.900
107 HG2 ARG 15 2HG ARG 15 -5.375 1.345 3.488
108 HG3 ARG 15 1HG ARG 15 -7.020 1.741 2.981
109 HD2 ARG 15 2HD ARG 15 -6.249 -0.158 5.192
110 HD3 ARG 15 1HD ARG 15 -6.896 1.470 5.404
111 HE ARG 15 HE ARG 15 -8.744 0.282 3.866
112 HH11 ARG 15 1HH1 ARG 15 -7.282 -0.665 6.950
113 HH12 ARG 15 2HH1 ARG 15 -8.665 -1.490 7.492
114 HH21 ARG 15 1HH2 ARG 15 -10.606 -0.870 4.603
115 HH22 ARG 15 2HH2 ARG 15 -10.598 -1.606 6.126
116 H CYS 16 H CYS 16 -4.378 -1.863 1.507
117 HA CYS 16 HA CYS 16 -4.452 -3.076 -1.056
118 HB2 CYS 16 2HB CYS 16 -3.651 -4.259 1.598
119 HB3 CYS 16 1HB CYS 16 -3.178 -4.835 0.005
120 H CYS 17 H CYS 17 -5.641 -4.844 -1.767
121 HA CYS 17 HA CYS 17 -8.061 -5.527 -0.426
122 HB2 CYS 17 2HB CYS 17 -6.542 -7.026 -2.588
123 HB3 CYS 17 1HB CYS 17 -8.214 -7.317 -2.127
124 H SER 18 H SER 18 -8.506 -7.429 0.758
125 HA SER 18 HA SER 18 -6.696 -8.149 2.702
126 HB2 SER 18 2HB SER 18 -9.164 -8.410 2.846
127 HB3 SER 18 1HB SER 18 -9.065 -9.764 1.728
128 HG SER 18 HG SER 18 -9.127 -10.135 4.090
129 H GLY 19 H GLY 19 -4.725 -8.870 2.108
130 HA2 GLY 19 2HA GLY 19 -3.586 -11.061 2.044
131 HA3 GLY 19 1HA GLY 19 -4.636 -11.458 0.690
132 H GLN 20 H GLN 20 -4.114 -8.396 0.071
133 HA GLN 20 HA GLN 20 -2.050 -9.036 -1.825
134 HB2 GLN 20 2HB GLN 20 -4.009 -6.819 -1.603
135 HB3 GLN 20 1HB GLN 20 -2.613 -6.635 -2.653
136 HG2 GLN 20 2HG GLN 20 -4.645 -8.848 -2.788
137 HG3 GLN 20 1HG GLN 20 -4.556 -7.454 -3.869
138 HE21 GLN 20 1HE2 GLN 20 -3.146 -10.498 -3.018
139 HE22 GLN 20 2HE2 GLN 20 -2.060 -10.608 -4.349
140 H GLY 21 H GLY 21 -1.384 -8.519 1.031
141 HA2 GLY 21 2HA GLY 21 0.896 -8.030 1.534
142 HA3 GLY 21 1HA GLY 21 0.863 -6.824 0.267
143 H ASN 22 H ASN 22 1.951 -5.887 2.191
144 HA ASN 22 HA ASN 22 0.076 -4.407 3.905
145 HB2 ASN 22 2HB ASN 22 3.010 -5.108 4.244
146 HB3 ASN 22 1HB ASN 22 2.119 -4.042 5.318
147 HD21 ASN 22 1HD2 ASN 22 2.552 -7.377 4.255
148 HD22 ASN 22 2HD2 ASN 22 1.778 -8.087 5.600
149 H CYS 23 H CYS 23 0.476 -2.130 3.994
150 HA CYS 23 HA CYS 23 1.528 -1.043 1.583
151 HB2 CYS 23 2HB CYS 23 0.485 0.265 4.097
152 HB3 CYS 23 1HB CYS 23 1.044 1.162 2.695
153 H VAL 24 H VAL 24 3.666 -1.348 1.411
154 HA VAL 24 HA VAL 24 5.425 -0.587 3.565
155 HB VAL 24 HB VAL 24 6.122 -1.193 0.688
156 HG11 VAL 24 1HG1 VAL 24 8.383 -1.686 1.540
157 HG12 VAL 24 2HG1 VAL 24 7.864 -1.194 3.152
158 HG13 VAL 24 3HG1 VAL 24 7.904 -0.015 1.841
159 HG21 VAL 24 3HG2 VAL 24 6.702 -3.478 1.467
160 HG22 VAL 24 1HG2 VAL 24 4.985 -3.110 1.651
161 HG23 VAL 24 2HG2 VAL 24 6.052 -3.066 3.052
162 HA PRO 25 HA PRO 25 5.032 3.533 2.028
163 HB2 PRO 25 2HB PRO 25 6.231 4.806 4.063
164 HB3 PRO 25 1HB PRO 25 4.641 4.054 4.220
165 HG2 PRO 25 2HG PRO 25 7.264 3.151 5.252
166 HG3 PRO 25 1HG PRO 25 5.641 2.843 5.887
167 HD2 PRO 25 2HD PRO 25 7.224 1.079 4.268
168 HD3 PRO 25 1HD PRO 25 5.541 0.863 4.782
169 H LEU 26 H LEU 26 6.154 4.391 0.482
170 HA LEU 26 HA LEU 26 9.052 4.623 0.762
171 HB2 LEU 26 2HB LEU 26 7.489 4.114 -1.793
172 HB3 LEU 26 1HB LEU 26 9.165 4.613 -1.760
173 HG LEU 26 HG LEU 26 9.206 2.346 -2.220
174 HD11 LEU 26 1HD1 LEU 26 10.336 1.298 -0.363
175 HD12 LEU 26 2HD1 LEU 26 9.755 2.567 0.710
176 HD13 LEU 26 3HD1 LEU 26 10.857 2.967 -0.609
177 HD21 LEU 26 3HD2 LEU 26 7.303 1.862 0.063
178 HD22 LEU 26 1HD2 LEU 26 8.062 0.609 -0.923
179 HD23 LEU 26 2HD2 LEU 26 6.935 1.751 -1.659
180 HA PRO 27 HA PRO 27 8.941 8.976 0.781
181 HB2 PRO 27 2HB PRO 27 10.541 8.813 -1.746
182 HB3 PRO 27 1HB PRO 27 10.793 9.837 -0.326
183 HG2 PRO 27 2HG PRO 27 12.216 7.632 -0.657
184 HG3 PRO 27 1HG PRO 27 11.618 8.086 0.949
185 HD2 PRO 27 2HD PRO 27 10.725 5.919 -0.863
186 HD3 PRO 27 1HD PRO 27 10.658 6.019 0.907
187 H PHE 28 H PHE 28 8.971 8.351 -2.720
188 HA PHE 28 HA PHE 28 6.994 10.478 -2.986
189 HB2 PHE 28 2HB PHE 28 7.574 10.337 -5.451
190 HB3 PHE 28 1HB PHE 28 8.824 10.914 -4.344
191 HD1 PHE 28 1HD PHE 28 7.777 8.160 -6.545
192 HD2 PHE 28 2HD PHE 28 10.836 9.672 -4.000
193 HE1 PHE 28 1HE PHE 28 9.348 6.489 -7.431
194 HE2 PHE 28 2HE PHE 28 12.403 8.006 -4.883
195 HZ PHE 28 HZ PHE 28 11.667 6.413 -6.591
196 H LEU 29 H LEU 29 7.167 7.191 -3.173
197 HA LEU 29 HA LEU 29 4.812 6.901 -4.862
198 HB2 LEU 29 2HB LEU 29 6.401 4.841 -3.349
199 HB3 LEU 29 1HB LEU 29 5.018 4.465 -4.351
200 HG LEU 29 HG LEU 29 7.578 5.715 -5.362
201 HD11 LEU 29 1HD1 LEU 29 7.950 3.445 -4.588
202 HD12 LEU 29 2HD1 LEU 29 8.006 3.521 -6.350
203 HD13 LEU 29 3HD1 LEU 29 6.576 2.881 -5.537
204 HD21 LEU 29 3HD2 LEU 29 6.671 5.156 -7.574
205 HD22 LEU 29 1HD2 LEU 29 5.631 6.294 -6.720
206 HD23 LEU 29 2HD2 LEU 29 5.181 4.593 -6.819
207 H GLY 30 H GLY 30 5.404 7.412 -1.576
208 HA2 GLY 30 2HA GLY 30 3.818 7.804 0.073
209 HA3 GLY 30 1HA GLY 30 2.579 7.162 -1.000
210 H GLY 31 H GLY 31 2.513 4.878 -1.308
211 HA2 GLY 31 2HA GLY 31 3.923 3.102 0.378
212 HA3 GLY 31 1HA GLY 31 2.285 3.367 0.972
213 H VAL 32 H VAL 32 3.768 1.143 -0.386
214 HA VAL 32 HA VAL 32 1.691 0.622 -2.414
215 HB VAL 32 HB VAL 32 3.283 -0.645 -3.802
216 HG11 VAL 32 1HG1 VAL 32 4.172 2.188 -3.313
217 HG12 VAL 32 2HG1 VAL 32 2.873 1.655 -4.381
218 HG13 VAL 32 3HG1 VAL 32 4.542 1.221 -4.744
219 HG21 VAL 32 3HG2 VAL 32 4.909 -1.318 -2.136
220 HG22 VAL 32 1HG2 VAL 32 5.395 0.360 -1.893
221 HG23 VAL 32 2HG2 VAL 32 5.719 -0.437 -3.433
222 H CYS 33 H CYS 33 0.869 -1.368 -2.511
223 HA CYS 33 HA CYS 33 1.021 -2.995 -0.184
224 HB2 CYS 33 2HB CYS 33 -0.262 -3.520 -2.866
225 HB3 CYS 33 1HB CYS 33 -0.512 -4.491 -1.417
226 H ALA 34 H ALA 34 2.671 -4.292 0.263
227 HA ALA 34 HA ALA 34 3.586 -6.188 -1.747
228 HB1 ALA 34 1HB ALA 34 5.482 -4.407 -0.215
229 HB2 ALA 34 2HB ALA 34 5.132 -4.271 -1.932
230 HB3 ALA 34 3HB ALA 34 5.939 -5.713 -1.308
231 H VAL 35 H VAL 35 4.707 -7.992 -0.760
232 HA VAL 35 HA VAL 35 4.982 -9.608 0.726
233 HB VAL 35 HB VAL 35 4.908 -7.471 2.904
234 HG11 VAL 35 1HG1 VAL 35 6.104 -10.244 2.930
235 HG12 VAL 35 2HG1 VAL 35 4.654 -9.729 3.788
236 HG13 VAL 35 3HG1 VAL 35 6.226 -9.062 4.233
237 HG21 VAL 35 3HG2 VAL 35 7.292 -8.566 1.398
238 HG22 VAL 35 1HG2 VAL 35 7.366 -7.454 2.764
239 HG23 VAL 35 2HG2 VAL 35 6.629 -6.940 1.246
Start of MODEL 12
1 H1 CYS 1 1HT CYS 1 -10.714 -1.246 -2.438
2 H2 CYS 1 2HT CYS 1 -10.373 -2.210 -3.788
3 H3 CYS 1 3HT CYS 1 -9.906 -0.597 -3.777
4 HA CYS 1 HA CYS 1 -8.364 -1.014 -2.012
5 HB2 CYS 1 2HB CYS 1 -7.925 -3.357 -1.379
6 HB3 CYS 1 1HB CYS 1 -9.556 -2.872 -0.946
7 H VAL 2 H VAL 2 -6.202 -1.798 -2.502
8 HA VAL 2 HA VAL 2 -5.904 -2.253 -5.379
9 HB VAL 2 HB VAL 2 -3.721 -1.163 -5.255
10 HG11 VAL 2 1HG1 VAL 2 -5.614 0.209 -5.814
11 HG12 VAL 2 2HG1 VAL 2 -4.458 1.140 -4.861
12 HG13 VAL 2 3HG1 VAL 2 -5.929 0.520 -4.109
13 HG21 VAL 2 3HG2 VAL 2 -4.393 -0.598 -2.371
14 HG22 VAL 2 1HG2 VAL 2 -3.007 0.040 -3.257
15 HG23 VAL 2 2HG2 VAL 2 -3.135 -1.694 -2.948
16 H LEU 3 H LEU 3 -3.858 -3.332 -5.969
17 HA LEU 3 HA LEU 3 -3.554 -5.700 -4.270
18 HB2 LEU 3 2HB LEU 3 -2.720 -5.394 -7.156
19 HB3 LEU 3 1HB LEU 3 -2.842 -6.856 -6.193
20 HG LEU 3 HG LEU 3 -5.190 -5.187 -7.079
21 HD11 LEU 3 1HD1 LEU 3 -4.164 -7.806 -8.144
22 HD12 LEU 3 2HD1 LEU 3 -4.128 -6.249 -8.971
23 HD13 LEU 3 3HD1 LEU 3 -5.672 -7.023 -8.614
24 HD21 LEU 3 3HD2 LEU 3 -6.522 -7.134 -6.349
25 HD22 LEU 3 1HD2 LEU 3 -5.652 -6.374 -5.015
26 HD23 LEU 3 2HD2 LEU 3 -5.054 -7.876 -5.718
27 H ILE 4 H ILE 4 -1.226 -6.733 -4.821
28 HA ILE 4 HA ILE 4 0.668 -5.089 -3.605
29 HB ILE 4 HB ILE 4 2.378 -6.770 -4.332
30 HG12 ILE 4 2HG1 ILE 4 -0.001 -8.184 -5.568
31 HG13 ILE 4 1HG1 ILE 4 1.317 -7.438 -6.462
32 HG21 ILE 4 1HG2 ILE 4 1.256 -7.005 -2.223
33 HG22 ILE 4 2HG2 ILE 4 1.488 -8.595 -2.954
34 HG23 ILE 4 3HG2 ILE 4 -0.096 -7.825 -3.000
35 HD11 ILE 4 3HD1 ILE 4 1.562 -9.765 -4.574
36 HD12 ILE 4 1HD1 ILE 4 2.881 -9.038 -5.490
37 HD13 ILE 4 2HD1 ILE 4 1.565 -9.857 -6.334
38 H GLY 5 H GLY 5 2.154 -3.732 -4.260
39 HA2 GLY 5 2HA GLY 5 3.679 -2.714 -5.697
40 HA3 GLY 5 1HA GLY 5 2.955 -3.543 -7.057
41 H GLN 6 H GLN 6 0.350 -2.428 -5.602
42 HA GLN 6 HA GLN 6 0.331 -0.051 -7.275
43 HB2 GLN 6 2HB GLN 6 -1.894 -1.504 -5.869
44 HB3 GLN 6 1HB GLN 6 -2.118 -0.136 -6.965
45 HG2 GLN 6 2HG GLN 6 -1.099 -1.511 -8.769
46 HG3 GLN 6 1HG GLN 6 -1.037 -2.866 -7.648
47 HE21 GLN 6 1HE2 GLN 6 -2.434 -2.642 -10.151
48 HE22 GLN 6 2HE2 GLN 6 -4.102 -2.924 -9.798
49 H ARG 7 H ARG 7 -0.693 1.881 -6.431
50 HA ARG 7 HA ARG 7 0.551 2.541 -3.908
51 HB2 ARG 7 2HB ARG 7 0.746 3.883 -6.064
52 HB3 ARG 7 1HB ARG 7 -0.922 4.349 -5.832
53 HG2 ARG 7 2HG ARG 7 1.276 4.961 -3.856
54 HG3 ARG 7 1HG ARG 7 0.802 6.047 -5.152
55 HD2 ARG 7 2HD ARG 7 -0.961 5.096 -2.891
56 HD3 ARG 7 1HD ARG 7 -0.179 6.671 -2.999
57 HE ARG 7 HE ARG 7 -1.828 6.124 -5.259
58 HH11 ARG 7 1HH1 ARG 7 -1.893 7.301 -1.910
59 HH12 ARG 7 2HH1 ARG 7 -3.345 8.157 -2.105
60 HH21 ARG 7 1HH2 ARG 7 -3.845 7.360 -5.509
61 HH22 ARG 7 2HH2 ARG 7 -4.461 8.179 -4.155
62 H CYS 8 H CYS 8 -0.477 2.648 -2.083
63 HA CYS 8 HA CYS 8 -3.394 2.969 -2.016
64 HB2 CYS 8 2HB CYS 8 -3.209 1.694 0.123
65 HB3 CYS 8 1HB CYS 8 -2.890 0.732 -1.321
66 H ASP 9 H ASP 9 -4.115 3.908 0.090
67 HA ASP 9 HA ASP 9 -2.112 5.699 1.299
68 HB2 ASP 9 2HB ASP 9 -3.776 6.971 -0.157
69 HB3 ASP 9 1HB ASP 9 -5.044 6.396 0.929
70 H ASN 10 H ASN 10 -1.991 5.459 3.410
71 HA ASN 10 HA ASN 10 -3.367 3.235 4.538
72 HB2 ASN 10 2HB ASN 10 -1.401 5.132 5.823
73 HB3 ASN 10 1HB ASN 10 -2.042 3.686 6.578
74 HD21 ASN 10 1HD2 ASN 10 -0.099 2.752 6.798
75 HD22 ASN 10 2HD2 ASN 10 0.853 2.140 5.494
76 H ASP 11 H ASP 11 -3.687 6.673 4.832
77 HA ASP 11 HA ASP 11 -5.347 6.346 7.213
78 HB2 ASP 11 2HB ASP 11 -4.262 8.809 5.871
79 HB3 ASP 11 1HB ASP 11 -5.501 8.901 7.107
80 H ARG 12 H ARG 12 -5.610 7.670 3.957
81 HA ARG 12 HA ARG 12 -8.460 7.974 4.469
82 HB2 ARG 12 2HB ARG 12 -6.670 9.274 2.456
83 HB3 ARG 12 1HB ARG 12 -8.416 9.484 2.501
84 HG2 ARG 12 2HG ARG 12 -8.288 10.480 4.691
85 HG3 ARG 12 1HG ARG 12 -6.555 10.157 4.770
86 HD2 ARG 12 2HD ARG 12 -7.077 12.492 4.178
87 HD3 ARG 12 1HD ARG 12 -6.155 11.655 2.930
88 HE ARG 12 HE ARG 12 -9.063 11.823 2.738
89 HH11 ARG 12 1HH1 ARG 12 -5.873 12.623 1.423
90 HH12 ARG 12 2HH1 ARG 12 -6.494 13.209 -0.052
91 HH21 ARG 12 1HH2 ARG 12 -9.886 12.603 0.665
92 HH22 ARG 12 2HH2 ARG 12 -8.767 13.198 -0.482
93 H GLY 13 H GLY 13 -6.410 5.874 2.899
94 HA2 GLY 13 2HA GLY 13 -7.086 3.957 1.782
95 HA3 GLY 13 1HA GLY 13 -8.695 4.647 1.620
96 HA PRO 14 HA PRO 14 -8.529 2.746 0.121
97 HB2 PRO 14 2HB PRO 14 -7.860 1.282 -2.014
98 HB3 PRO 14 1HB PRO 14 -9.159 2.479 -2.115
99 HG2 PRO 14 2HG PRO 14 -6.318 2.674 -3.030
100 HG3 PRO 14 1HG PRO 14 -7.796 3.204 -3.852
101 HD2 PRO 14 2HD PRO 14 -6.144 4.875 -2.448
102 HD3 PRO 14 1HD PRO 14 -7.876 5.171 -2.695
103 H ARG 15 H ARG 15 -7.617 0.573 0.521
104 HA ARG 15 HA ARG 15 -4.705 0.606 0.647
105 HB2 ARG 15 2HB ARG 15 -6.551 -0.507 2.768
106 HB3 ARG 15 1HB ARG 15 -4.811 -0.751 2.745
107 HG2 ARG 15 2HG ARG 15 -4.574 1.752 2.800
108 HG3 ARG 15 1HG ARG 15 -6.305 1.827 3.106
109 HD2 ARG 15 2HD ARG 15 -4.275 0.387 4.799
110 HD3 ARG 15 1HD ARG 15 -4.980 1.956 5.171
111 HE ARG 15 HE ARG 15 -7.013 0.030 4.839
112 HH11 ARG 15 1HH1 ARG 15 -4.440 0.912 7.101
113 HH12 ARG 15 2HH1 ARG 15 -5.235 0.333 8.481
114 HH21 ARG 15 1HH2 ARG 15 -8.112 -0.819 6.730
115 HH22 ARG 15 2HH2 ARG 15 -7.374 -0.710 8.262
116 H CYS 16 H CYS 16 -4.139 -1.897 1.405
117 HA CYS 16 HA CYS 16 -4.216 -3.346 -0.956
118 HB2 CYS 16 2HB CYS 16 -3.841 -4.392 1.837
119 HB3 CYS 16 1HB CYS 16 -3.197 -5.073 0.345
120 H CYS 17 H CYS 17 -5.516 -4.980 -1.715
121 HA CYS 17 HA CYS 17 -8.022 -5.593 -0.488
122 HB2 CYS 17 2HB CYS 17 -6.472 -7.097 -2.625
123 HB3 CYS 17 1HB CYS 17 -8.146 -7.401 -2.197
124 H SER 18 H SER 18 -8.548 -7.932 0.136
125 HA SER 18 HA SER 18 -6.834 -8.685 2.247
126 HB2 SER 18 2HB SER 18 -9.329 -8.987 2.207
127 HB3 SER 18 1HB SER 18 -9.105 -10.268 1.020
128 HG SER 18 HG SER 18 -8.870 -11.508 2.659
129 H GLY 19 H GLY 19 -4.917 -9.575 1.898
130 HA2 GLY 19 2HA GLY 19 -3.641 -11.525 1.404
131 HA3 GLY 19 1HA GLY 19 -4.737 -11.867 0.070
132 H GLN 20 H GLN 20 -3.546 -8.653 0.610
133 HA GLN 20 HA GLN 20 -1.730 -8.969 -1.674
134 HB2 GLN 20 2HB GLN 20 -3.638 -6.689 -1.160
135 HB3 GLN 20 1HB GLN 20 -2.389 -6.669 -2.397
136 HG2 GLN 20 2HG GLN 20 -4.675 -8.614 -2.232
137 HG3 GLN 20 1HG GLN 20 -4.573 -7.221 -3.309
138 HE21 GLN 20 1HE2 GLN 20 -4.797 -10.073 -3.832
139 HE22 GLN 20 2HE2 GLN 20 -3.500 -10.493 -4.869
140 H GLY 21 H GLY 21 -1.033 -9.085 1.069
141 HA2 GLY 21 2HA GLY 21 0.783 -8.320 2.323
142 HA3 GLY 21 1HA GLY 21 1.106 -7.218 1.008
143 H ASN 22 H ASN 22 1.664 -5.765 2.674
144 HA ASN 22 HA ASN 22 -0.690 -4.279 3.636
145 HB2 ASN 22 2HB ASN 22 1.971 -4.667 5.040
146 HB3 ASN 22 1HB ASN 22 0.780 -3.478 5.523
147 HD21 ASN 22 1HD2 ASN 22 1.897 -5.682 7.015
148 HD22 ASN 22 2HD2 ASN 22 0.582 -6.688 7.492
149 H CYS 23 H CYS 23 -0.268 -1.981 3.744
150 HA CYS 23 HA CYS 23 1.134 -1.045 1.496
151 HB2 CYS 23 2HB CYS 23 -0.152 0.383 3.819
152 HB3 CYS 23 1HB CYS 23 0.607 1.221 2.474
153 H VAL 24 H VAL 24 3.236 -1.224 1.456
154 HA VAL 24 HA VAL 24 4.847 -0.505 3.747
155 HB VAL 24 HB VAL 24 5.679 -1.362 0.987
156 HG11 VAL 24 1HG1 VAL 24 7.301 -1.236 3.525
157 HG12 VAL 24 2HG1 VAL 24 7.429 -0.149 2.146
158 HG13 VAL 24 3HG1 VAL 24 7.873 -1.847 1.971
159 HG21 VAL 24 3HG2 VAL 24 6.139 -3.593 1.967
160 HG22 VAL 24 1HG2 VAL 24 4.430 -3.162 2.035
161 HG23 VAL 24 2HG2 VAL 24 5.427 -3.041 3.482
162 HA PRO 25 HA PRO 25 4.803 3.609 1.989
163 HB2 PRO 25 2HB PRO 25 6.865 4.223 3.963
164 HB3 PRO 25 1HB PRO 25 5.233 4.877 3.824
165 HG2 PRO 25 2HG PRO 25 5.979 3.187 5.808
166 HG3 PRO 25 1HG PRO 25 4.330 3.250 5.163
167 HD2 PRO 25 2HD PRO 25 6.495 1.246 4.589
168 HD3 PRO 25 1HD PRO 25 4.738 1.033 4.772
169 H LEU 26 H LEU 26 5.960 4.477 0.445
170 HA LEU 26 HA LEU 26 8.828 3.996 0.312
171 HB2 LEU 26 2HB LEU 26 7.470 2.539 -1.299
172 HB3 LEU 26 1HB LEU 26 6.957 4.022 -2.072
173 HG LEU 26 HG LEU 26 9.355 4.507 -2.583
174 HD11 LEU 26 1HD1 LEU 26 10.970 2.687 -2.451
175 HD12 LEU 26 2HD1 LEU 26 9.784 1.693 -1.609
176 HD13 LEU 26 3HD1 LEU 26 10.400 3.159 -0.852
177 HD21 LEU 26 3HD2 LEU 26 8.243 1.918 -3.659
178 HD22 LEU 26 1HD2 LEU 26 9.510 2.884 -4.415
179 HD23 LEU 26 2HD2 LEU 26 7.879 3.536 -4.259
180 HA PRO 27 HA PRO 27 8.308 8.412 0.747
181 HB2 PRO 27 2HB PRO 27 10.909 9.132 0.342
182 HB3 PRO 27 1HB PRO 27 10.301 8.423 1.844
183 HG2 PRO 27 2HG PRO 27 11.689 7.099 -0.457
184 HG3 PRO 27 1HG PRO 27 11.977 6.899 1.282
185 HD2 PRO 27 2HD PRO 27 10.575 5.110 -0.103
186 HD3 PRO 27 1HD PRO 27 10.113 5.542 1.557
187 H PHE 28 H PHE 28 7.403 7.784 -1.698
188 HA PHE 28 HA PHE 28 8.245 10.105 -3.272
189 HB2 PHE 28 2HB PHE 28 7.881 7.372 -4.559
190 HB3 PHE 28 1HB PHE 28 8.222 8.873 -5.399
191 HD1 PHE 28 2HD PHE 28 10.475 9.963 -5.044
192 HD2 PHE 28 1HD PHE 28 9.554 6.045 -3.712
193 HE1 PHE 28 2HE PHE 28 12.879 9.471 -4.850
194 HE2 PHE 28 1HE PHE 28 11.953 5.536 -3.504
195 HZ PHE 28 HZ PHE 28 13.614 7.246 -4.073
196 H LEU 29 H LEU 29 6.142 7.287 -3.481
197 HA LEU 29 HA LEU 29 3.965 9.031 -4.379
198 HB2 LEU 29 2HB LEU 29 2.981 7.160 -5.485
199 HB3 LEU 29 1HB LEU 29 4.659 7.267 -5.943
200 HG LEU 29 HG LEU 29 3.480 5.241 -4.017
201 HD11 LEU 29 1HD1 LEU 29 2.759 4.863 -6.287
202 HD12 LEU 29 2HD1 LEU 29 3.898 3.616 -5.781
203 HD13 LEU 29 3HD1 LEU 29 4.429 4.914 -6.850
204 HD21 LEU 29 3HD2 LEU 29 5.667 4.070 -4.258
205 HD22 LEU 29 1HD2 LEU 29 5.813 5.621 -3.434
206 HD23 LEU 29 2HD2 LEU 29 6.294 5.474 -5.118
207 H GLY 30 H GLY 30 4.893 7.613 -1.572
208 HA2 GLY 30 2HA GLY 30 3.384 7.877 0.304
209 HA3 GLY 30 1HA GLY 30 2.097 7.277 -0.739
210 H GLY 31 H GLY 31 1.709 5.134 -0.815
211 HA2 GLY 31 2HA GLY 31 3.764 3.357 0.232
212 HA3 GLY 31 1HA GLY 31 2.156 3.332 0.955
213 H VAL 32 H VAL 32 3.553 1.226 -0.397
214 HA VAL 32 HA VAL 32 1.540 0.649 -2.437
215 HB VAL 32 HB VAL 32 3.248 -0.646 -3.742
216 HG11 VAL 32 1HG1 VAL 32 2.609 1.545 -4.518
217 HG12 VAL 32 2HG1 VAL 32 4.316 1.253 -4.841
218 HG13 VAL 32 3HG1 VAL 32 3.839 2.295 -3.497
219 HG21 VAL 32 3HG2 VAL 32 5.261 0.757 -1.975
220 HG22 VAL 32 1HG2 VAL 32 5.640 -0.190 -3.416
221 HG23 VAL 32 2HG2 VAL 32 4.929 -0.976 -2.007
222 H CYS 33 H CYS 33 0.739 -1.366 -2.347
223 HA CYS 33 HA CYS 33 1.094 -2.831 0.051
224 HB2 CYS 33 2HB CYS 33 -0.352 -3.522 -2.499
225 HB3 CYS 33 1HB CYS 33 -0.431 -4.484 -1.023
226 H ALA 34 H ALA 34 2.435 -4.443 0.564
227 HA ALA 34 HA ALA 34 3.530 -6.246 -1.347
228 HB1 ALA 34 1HB ALA 34 5.375 -4.223 -0.061
229 HB2 ALA 34 2HB ALA 34 4.985 -4.309 -1.777
230 HB3 ALA 34 3HB ALA 34 5.881 -5.623 -1.007
231 H VAL 35 H VAL 35 4.784 -7.857 -0.306
232 HA VAL 35 HA VAL 35 5.219 -9.391 1.223
233 HB VAL 35 HB VAL 35 5.632 -7.042 3.108
234 HG11 VAL 35 1HG1 VAL 35 6.699 -9.865 3.257
235 HG12 VAL 35 2HG1 VAL 35 5.486 -9.153 4.321
236 HG13 VAL 35 3HG1 VAL 35 7.141 -8.544 4.339
237 HG21 VAL 35 3HG2 VAL 35 8.003 -7.204 2.476
238 HG22 VAL 35 1HG2 VAL 35 6.979 -6.817 1.092
239 HG23 VAL 35 2HG2 VAL 35 7.596 -8.455 1.303
Start of MODEL 13
1 H1 CYS 1 1HT CYS 1 -11.184 -2.093 -2.317
2 H2 CYS 1 2HT CYS 1 -10.666 -2.968 -3.673
3 H3 CYS 1 3HT CYS 1 -10.443 -1.299 -3.604
4 HA CYS 1 HA CYS 1 -8.890 -1.479 -1.856
5 HB2 CYS 1 2HB CYS 1 -8.160 -3.728 -1.114
6 HB3 CYS 1 1HB CYS 1 -9.862 -3.451 -0.768
7 H VAL 2 H VAL 2 -6.609 -1.905 -2.376
8 HA VAL 2 HA VAL 2 -6.306 -2.467 -5.225
9 HB VAL 2 HB VAL 2 -4.119 -1.207 -5.076
10 HG11 VAL 2 1HG1 VAL 2 -6.659 0.293 -4.471
11 HG12 VAL 2 2HG1 VAL 2 -6.089 -0.210 -6.062
12 HG13 VAL 2 3HG1 VAL 2 -5.194 1.002 -5.145
13 HG21 VAL 2 3HG2 VAL 2 -3.802 -1.298 -2.657
14 HG22 VAL 2 1HG2 VAL 2 -5.259 -0.333 -2.420
15 HG23 VAL 2 2HG2 VAL 2 -3.854 0.374 -3.217
16 H LEU 3 H LEU 3 -4.106 -3.242 -5.849
17 HA LEU 3 HA LEU 3 -3.660 -5.667 -4.258
18 HB2 LEU 3 2HB LEU 3 -2.957 -5.279 -7.148
19 HB3 LEU 3 1HB LEU 3 -3.131 -6.752 -6.201
20 HG LEU 3 HG LEU 3 -5.425 -4.974 -7.013
21 HD11 LEU 3 1HD1 LEU 3 -4.458 -7.560 -8.210
22 HD12 LEU 3 2HD1 LEU 3 -4.417 -5.970 -8.971
23 HD13 LEU 3 3HD1 LEU 3 -5.963 -6.746 -8.628
24 HD21 LEU 3 3HD2 LEU 3 -5.898 -6.259 -5.008
25 HD22 LEU 3 1HD2 LEU 3 -5.356 -7.738 -5.803
26 HD23 LEU 3 2HD2 LEU 3 -6.803 -6.910 -6.374
27 H ILE 4 H ILE 4 -1.339 -6.595 -4.939
28 HA ILE 4 HA ILE 4 0.579 -4.917 -3.812
29 HB ILE 4 HB ILE 4 2.303 -6.520 -4.615
30 HG12 ILE 4 2HG1 ILE 4 -0.025 -7.984 -5.875
31 HG13 ILE 4 1HG1 ILE 4 1.192 -7.092 -6.776
32 HG21 ILE 4 1HG2 ILE 4 1.152 -6.911 -2.516
33 HG22 ILE 4 2HG2 ILE 4 1.505 -8.437 -3.328
34 HG23 ILE 4 3HG2 ILE 4 -0.129 -7.777 -3.366
35 HD11 ILE 4 3HD1 ILE 4 1.682 -9.514 -5.055
36 HD12 ILE 4 1HD1 ILE 4 2.910 -8.632 -5.959
37 HD13 ILE 4 2HD1 ILE 4 1.627 -9.484 -6.819
38 H GLY 5 H GLY 5 2.095 -3.594 -4.512
39 HA2 GLY 5 2HA GLY 5 3.517 -2.555 -6.024
40 HA3 GLY 5 1HA GLY 5 2.636 -3.267 -7.360
41 H GLN 6 H GLN 6 0.108 -2.328 -5.967
42 HA GLN 6 HA GLN 6 0.034 0.195 -7.361
43 HB2 GLN 6 2HB GLN 6 -2.124 -1.337 -5.892
44 HB3 GLN 6 1HB GLN 6 -2.398 0.080 -6.906
45 HG2 GLN 6 2HG GLN 6 -1.547 -1.152 -8.848
46 HG3 GLN 6 1HG GLN 6 -1.273 -2.560 -7.833
47 HE21 GLN 6 1HE2 GLN 6 -2.880 -2.320 -10.183
48 HE22 GLN 6 2HE2 GLN 6 -4.481 -2.772 -9.764
49 H ARG 7 H ARG 7 -0.878 2.104 -6.306
50 HA ARG 7 HA ARG 7 0.580 2.520 -3.833
51 HB2 ARG 7 2HB ARG 7 0.755 4.058 -5.834
52 HB3 ARG 7 1HB ARG 7 -0.916 4.500 -5.581
53 HG2 ARG 7 2HG ARG 7 1.297 5.018 -3.589
54 HG3 ARG 7 1HG ARG 7 0.762 6.181 -4.796
55 HD2 ARG 7 2HD ARG 7 -0.806 5.059 -2.473
56 HD3 ARG 7 1HD ARG 7 -0.235 6.713 -2.676
57 HE ARG 7 HE ARG 7 -1.973 5.855 -4.778
58 HH11 ARG 7 1HH1 ARG 7 -1.915 7.243 -1.513
59 HH12 ARG 7 2HH1 ARG 7 -3.486 7.893 -1.634
60 HH21 ARG 7 1HH2 ARG 7 -4.144 6.733 -4.891
61 HH22 ARG 7 2HH2 ARG 7 -4.747 7.624 -3.561
62 H CYS 8 H CYS 8 -0.346 2.650 -1.945
63 HA CYS 8 HA CYS 8 -3.266 2.770 -1.818
64 HB2 CYS 8 2HB CYS 8 -3.036 1.263 0.139
65 HB3 CYS 8 1HB CYS 8 -2.521 0.526 -1.375
66 H ASP 9 H ASP 9 -3.921 3.327 0.486
67 HA ASP 9 HA ASP 9 -2.120 4.956 2.063
68 HB2 ASP 9 2HB ASP 9 -3.223 6.492 0.308
69 HB3 ASP 9 1HB ASP 9 -4.755 6.084 1.070
70 H ASN 10 H ASN 10 -2.613 4.409 4.095
71 HA ASN 10 HA ASN 10 -4.696 2.514 4.537
72 HB2 ASN 10 2HB ASN 10 -2.759 3.806 6.432
73 HB3 ASN 10 1HB ASN 10 -3.949 2.616 6.935
74 HD21 ASN 10 1HD2 ASN 10 -1.018 2.580 6.950
75 HD22 ASN 10 2HD2 ASN 10 -0.547 1.177 6.087
76 H ASP 11 H ASP 11 -4.301 5.904 5.284
77 HA ASP 11 HA ASP 11 -6.607 5.776 7.013
78 HB2 ASP 11 2HB ASP 11 -4.810 7.190 7.792
79 HB3 ASP 11 1HB ASP 11 -4.880 8.138 6.307
80 H ARG 12 H ARG 12 -5.786 7.330 3.952
81 HA ARG 12 HA ARG 12 -8.567 8.198 3.803
82 HB2 ARG 12 2HB ARG 12 -6.249 8.817 1.991
83 HB3 ARG 12 1HB ARG 12 -7.884 9.399 1.755
84 HG2 ARG 12 2HG ARG 12 -6.125 10.035 4.115
85 HG3 ARG 12 1HG ARG 12 -6.408 11.086 2.729
86 HD2 ARG 12 2HD ARG 12 -7.876 11.926 4.345
87 HD3 ARG 12 1HD ARG 12 -8.893 10.881 3.357
88 HE ARG 12 HE ARG 12 -7.717 9.864 5.844
89 HH11 ARG 12 1HH1 ARG 12 -10.657 10.745 4.031
90 HH12 ARG 12 2HH1 ARG 12 -11.705 10.069 5.178
91 HH21 ARG 12 1HH2 ARG 12 -9.169 8.971 7.390
92 HH22 ARG 12 2HH2 ARG 12 -10.857 9.022 7.128
93 H GLY 13 H GLY 13 -6.449 5.859 2.405
94 HA2 GLY 13 2HA GLY 13 -7.317 3.951 1.300
95 HA3 GLY 13 1HA GLY 13 -8.678 4.921 0.747
96 HA PRO 14 HA PRO 14 -8.273 2.955 -0.720
97 HB2 PRO 14 2HB PRO 14 -7.205 1.398 -2.604
98 HB3 PRO 14 1HB PRO 14 -8.244 2.768 -3.022
99 HG2 PRO 14 2HG PRO 14 -5.267 2.550 -3.131
100 HG3 PRO 14 1HG PRO 14 -6.375 3.328 -4.272
101 HD2 PRO 14 2HD PRO 14 -4.921 4.644 -2.317
102 HD3 PRO 14 1HD PRO 14 -6.384 5.275 -3.093
103 H ARG 15 H ARG 15 -7.919 0.821 0.104
104 HA ARG 15 HA ARG 15 -5.255 0.457 1.263
105 HB2 ARG 15 2HB ARG 15 -7.981 -0.445 2.183
106 HB3 ARG 15 1HB ARG 15 -6.489 -1.063 2.870
107 HG2 ARG 15 2HG ARG 15 -5.875 1.144 3.625
108 HG3 ARG 15 1HG ARG 15 -7.290 1.837 2.837
109 HD2 ARG 15 2HD ARG 15 -7.403 -0.239 5.019
110 HD3 ARG 15 1HD ARG 15 -7.589 1.498 5.279
111 HE ARG 15 HE ARG 15 -9.432 1.229 3.536
112 HH11 ARG 15 1HH1 ARG 15 -8.735 -1.212 5.997
113 HH12 ARG 15 2HH1 ARG 15 -10.347 -1.732 6.118
114 HH21 ARG 15 1HH2 ARG 15 -11.602 0.504 3.683
115 HH22 ARG 15 2HH2 ARG 15 -12.029 -0.745 4.757
116 H CYS 16 H CYS 16 -4.505 -1.689 1.439
117 HA CYS 16 HA CYS 16 -4.554 -3.131 -0.986
118 HB2 CYS 16 2HB CYS 16 -3.548 -4.004 1.718
119 HB3 CYS 16 1HB CYS 16 -3.027 -4.597 0.143
120 H CYS 17 H CYS 17 -5.594 -5.028 -1.506
121 HA CYS 17 HA CYS 17 -7.833 -5.891 0.016
122 HB2 CYS 17 2HB CYS 17 -6.282 -7.424 -2.092
123 HB3 CYS 17 1HB CYS 17 -7.939 -7.726 -1.595
124 H SER 18 H SER 18 -7.999 -8.023 1.044
125 HA SER 18 HA SER 18 -6.267 -8.172 3.146
126 HB2 SER 18 2HB SER 18 -7.595 -10.386 3.511
127 HB3 SER 18 1HB SER 18 -8.400 -8.815 3.592
128 HG SER 18 HG SER 18 -8.892 -10.850 1.968
129 H GLY 19 H GLY 19 -5.939 -9.845 0.132
130 HA2 GLY 19 2HA GLY 19 -3.755 -11.437 1.324
131 HA3 GLY 19 1HA GLY 19 -4.675 -11.928 -0.096
132 H GLN 20 H GLN 20 -3.820 -8.617 0.259
133 HA GLN 20 HA GLN 20 -1.823 -8.920 -1.876
134 HB2 GLN 20 2HB GLN 20 -3.759 -6.675 -1.341
135 HB3 GLN 20 1HB GLN 20 -2.504 -6.613 -2.569
136 HG2 GLN 20 2HG GLN 20 -4.694 -8.655 -2.444
137 HG3 GLN 20 1HG GLN 20 -4.725 -7.215 -3.466
138 HE21 GLN 20 1HE2 GLN 20 -4.830 -9.996 -4.140
139 HE22 GLN 20 2HE2 GLN 20 -3.515 -10.340 -5.193
140 H GLY 21 H GLY 21 -1.648 -8.820 1.118
141 HA2 GLY 21 2HA GLY 21 0.237 -8.219 2.407
142 HA3 GLY 21 1HA GLY 21 0.715 -7.204 1.077
143 H ASN 22 H ASN 22 1.257 -5.637 2.440
144 HA ASN 22 HA ASN 22 -0.942 -3.965 3.375
145 HB2 ASN 22 2HB ASN 22 1.484 -4.819 4.948
146 HB3 ASN 22 1HB ASN 22 0.661 -3.315 5.311
147 HD21 ASN 22 1HD2 ASN 22 0.540 -6.756 5.486
148 HD22 ASN 22 2HD2 ASN 22 -0.869 -6.896 6.460
149 H CYS 23 H CYS 23 -0.048 -1.746 3.804
150 HA CYS 23 HA CYS 23 1.341 -0.929 1.462
151 HB2 CYS 23 2HB CYS 23 0.407 0.639 3.867
152 HB3 CYS 23 1HB CYS 23 1.109 1.347 2.417
153 H VAL 24 H VAL 24 3.405 -0.785 1.220
154 HA VAL 24 HA VAL 24 5.118 -0.432 3.558
155 HB VAL 24 HB VAL 24 5.947 -1.049 0.745
156 HG11 VAL 24 1HG1 VAL 24 8.040 -1.836 1.788
157 HG12 VAL 24 2HG1 VAL 24 7.399 -1.338 3.356
158 HG13 VAL 24 3HG1 VAL 24 7.706 -0.130 2.107
159 HG21 VAL 24 3HG2 VAL 24 5.488 -3.042 2.964
160 HG22 VAL 24 1HG2 VAL 24 6.218 -3.415 1.403
161 HG23 VAL 24 2HG2 VAL 24 4.534 -2.886 1.490
162 HA PRO 25 HA PRO 25 5.047 3.669 1.879
163 HB2 PRO 25 2HB PRO 25 6.246 4.912 3.978
164 HB3 PRO 25 1HB PRO 25 4.562 4.383 4.004
165 HG2 PRO 25 2HG PRO 25 6.939 3.189 5.306
166 HG3 PRO 25 1HG PRO 25 5.242 3.137 5.804
167 HD2 PRO 25 2HD PRO 25 6.681 1.081 4.457
168 HD3 PRO 25 1HD PRO 25 4.933 1.139 4.718
169 H LEU 26 H LEU 26 6.371 4.469 0.408
170 HA LEU 26 HA LEU 26 9.219 4.308 0.900
171 HB2 LEU 26 2HB LEU 26 9.517 4.126 -1.601
172 HB3 LEU 26 1HB LEU 26 8.773 2.737 -0.849
173 HG LEU 26 HG LEU 26 6.579 3.848 -1.577
174 HD11 LEU 26 1HD1 LEU 26 6.687 5.112 -3.657
175 HD12 LEU 26 2HD1 LEU 26 8.441 5.136 -3.539
176 HD13 LEU 26 3HD1 LEU 26 7.466 5.967 -2.322
177 HD21 LEU 26 3HD2 LEU 26 6.678 2.683 -3.752
178 HD22 LEU 26 1HD2 LEU 26 7.325 1.724 -2.421
179 HD23 LEU 26 2HD2 LEU 26 8.423 2.520 -3.547
180 HA PRO 27 HA PRO 27 9.222 8.616 0.678
181 HB2 PRO 27 2HB PRO 27 11.874 8.948 -0.234
182 HB3 PRO 27 1HB PRO 27 11.340 8.760 1.435
183 HG2 PRO 27 2HG PRO 27 12.879 6.916 -0.026
184 HG3 PRO 27 1HG PRO 27 12.058 6.607 1.509
185 HD2 PRO 27 2HD PRO 27 11.179 5.913 -1.272
186 HD3 PRO 27 1HD PRO 27 10.913 5.041 0.240
187 H PHE 28 H PHE 28 7.977 7.902 -1.618
188 HA PHE 28 HA PHE 28 8.840 10.033 -3.403
189 HB2 PHE 28 2HB PHE 28 8.339 7.220 -4.413
190 HB3 PHE 28 1HB PHE 28 8.445 8.626 -5.459
191 HD1 PHE 28 2HD PHE 28 10.640 9.879 -5.533
192 HD2 PHE 28 1HD PHE 28 10.246 6.060 -3.704
193 HE1 PHE 28 2HE PHE 28 13.072 9.565 -5.669
194 HE2 PHE 28 1HE PHE 28 12.675 5.745 -3.836
195 HZ PHE 28 HZ PHE 28 14.087 7.491 -4.816
196 H LEU 29 H LEU 29 6.417 7.470 -3.791
197 HA LEU 29 HA LEU 29 4.460 9.607 -3.952
198 HB2 LEU 29 2HB LEU 29 3.007 8.023 -5.315
199 HB3 LEU 29 1HB LEU 29 4.413 8.691 -6.089
200 HG LEU 29 HG LEU 29 3.939 6.366 -6.739
201 HD11 LEU 29 1HD1 LEU 29 6.174 7.119 -6.982
202 HD12 LEU 29 2HD1 LEU 29 6.161 5.424 -6.493
203 HD13 LEU 29 3HD1 LEU 29 6.554 6.674 -5.321
204 HD21 LEU 29 3HD2 LEU 29 3.010 5.467 -4.703
205 HD22 LEU 29 1HD2 LEU 29 4.555 5.664 -3.872
206 HD23 LEU 29 2HD2 LEU 29 4.404 4.504 -5.193
207 H GLY 30 H GLY 30 5.353 7.529 -1.732
208 HA2 GLY 30 2HA GLY 30 3.973 7.624 0.279
209 HA3 GLY 30 1HA GLY 30 2.594 7.254 -0.752
210 H GLY 31 H GLY 31 1.963 5.309 0.016
211 HA2 GLY 31 2HA GLY 31 4.050 3.274 0.220
212 HA3 GLY 31 1HA GLY 31 2.542 3.252 1.130
213 H VAL 32 H VAL 32 3.754 1.302 -0.571
214 HA VAL 32 HA VAL 32 1.519 0.937 -2.463
215 HB VAL 32 HB VAL 32 3.004 -0.399 -3.934
216 HG11 VAL 32 1HG1 VAL 32 4.305 1.427 -4.911
217 HG12 VAL 32 2HG1 VAL 32 3.998 2.404 -3.472
218 HG13 VAL 32 3HG1 VAL 32 2.658 1.908 -4.510
219 HG21 VAL 32 3HG2 VAL 32 4.671 -1.121 -2.314
220 HG22 VAL 32 1HG2 VAL 32 5.249 0.538 -2.138
221 HG23 VAL 32 2HG2 VAL 32 5.446 -0.312 -3.675
222 H CYS 33 H CYS 33 0.667 -1.114 -2.595
223 HA CYS 33 HA CYS 33 0.814 -2.671 -0.215
224 HB2 CYS 33 2HB CYS 33 -0.487 -3.272 -2.869
225 HB3 CYS 33 1HB CYS 33 -0.729 -4.200 -1.393
226 H ALA 34 H ALA 34 1.894 -4.542 0.218
227 HA ALA 34 HA ALA 34 3.035 -6.157 -1.832
228 HB1 ALA 34 1HB ALA 34 4.854 -4.644 0.058
229 HB2 ALA 34 2HB ALA 34 4.760 -4.405 -1.685
230 HB3 ALA 34 3HB ALA 34 5.357 -5.932 -1.036
231 H VAL 35 H VAL 35 3.589 -8.171 -0.960
232 HA VAL 35 HA VAL 35 2.365 -8.674 1.619
233 HB VAL 35 HB VAL 35 3.515 -10.666 -0.368
234 HG11 VAL 35 1HG1 VAL 35 2.192 -12.336 0.843
235 HG12 VAL 35 2HG1 VAL 35 1.679 -11.096 1.985
236 HG13 VAL 35 3HG1 VAL 35 3.377 -11.559 1.893
237 HG21 VAL 35 3HG2 VAL 35 1.662 -9.448 -1.377
238 HG22 VAL 35 1HG2 VAL 35 0.645 -9.810 0.016
239 HG23 VAL 35 2HG2 VAL 35 1.193 -11.114 -1.037
Start of MODEL 14
1 H1 CYS 1 1HT CYS 1 -9.888 -0.514 -3.977
2 H2 CYS 1 2HT CYS 1 -10.748 -1.135 -2.647
3 H3 CYS 1 3HT CYS 1 -10.370 -2.121 -3.966
4 HA CYS 1 HA CYS 1 -8.371 -0.946 -2.200
5 HB2 CYS 1 2HB CYS 1 -8.065 -3.279 -1.445
6 HB3 CYS 1 1HB CYS 1 -9.671 -2.689 -1.054
7 H VAL 2 H VAL 2 -6.259 -1.629 -2.716
8 HA VAL 2 HA VAL 2 -6.012 -2.266 -5.551
9 HB VAL 2 HB VAL 2 -3.751 -1.303 -5.435
10 HG11 VAL 2 1HG1 VAL 2 -4.394 1.034 -5.163
11 HG12 VAL 2 2HG1 VAL 2 -5.897 0.523 -4.393
12 HG13 VAL 2 3HG1 VAL 2 -5.590 0.123 -6.083
13 HG21 VAL 2 3HG2 VAL 2 -4.474 -0.580 -2.605
14 HG22 VAL 2 1HG2 VAL 2 -3.040 -0.046 -3.483
15 HG23 VAL 2 2HG2 VAL 2 -3.254 -1.758 -3.098
16 H LEU 3 H LEU 3 -3.879 -3.343 -6.065
17 HA LEU 3 HA LEU 3 -3.811 -5.761 -4.406
18 HB2 LEU 3 2HB LEU 3 -3.017 -5.585 -7.303
19 HB3 LEU 3 1HB LEU 3 -3.358 -6.996 -6.313
20 HG LEU 3 HG LEU 3 -5.433 -5.000 -7.210
21 HD11 LEU 3 1HD1 LEU 3 -6.196 -6.770 -8.696
22 HD12 LEU 3 2HD1 LEU 3 -4.818 -7.760 -8.215
23 HD13 LEU 3 3HD1 LEU 3 -4.558 -6.244 -9.079
24 HD21 LEU 3 3HD2 LEU 3 -5.706 -7.666 -5.823
25 HD22 LEU 3 1HD2 LEU 3 -7.034 -6.678 -6.431
26 HD23 LEU 3 2HD2 LEU 3 -6.027 -6.080 -5.117
27 H ILE 4 H ILE 4 -1.597 -7.005 -5.149
28 HA ILE 4 HA ILE 4 0.526 -5.716 -3.866
29 HB ILE 4 HB ILE 4 0.757 -7.918 -5.948
30 HG12 ILE 4 2HG1 ILE 4 0.445 -8.163 -2.945
31 HG13 ILE 4 1HG1 ILE 4 -0.818 -8.493 -4.121
32 HG21 ILE 4 1HG2 ILE 4 2.845 -8.517 -4.795
33 HG22 ILE 4 2HG2 ILE 4 2.618 -7.169 -3.683
34 HG23 ILE 4 3HG2 ILE 4 2.907 -6.855 -5.392
35 HD11 ILE 4 3HD1 ILE 4 0.509 -10.336 -5.022
36 HD12 ILE 4 1HD1 ILE 4 0.193 -10.539 -3.299
37 HD13 ILE 4 2HD1 ILE 4 1.778 -9.992 -3.846
38 H GLY 5 H GLY 5 2.064 -4.355 -4.460
39 HA2 GLY 5 2HA GLY 5 3.593 -3.277 -5.819
40 HA3 GLY 5 1HA GLY 5 2.844 -3.988 -7.237
41 H GLN 6 H GLN 6 0.272 -2.927 -5.839
42 HA GLN 6 HA GLN 6 0.296 -0.448 -7.356
43 HB2 GLN 6 2HB GLN 6 -1.877 -1.991 -5.990
44 HB3 GLN 6 1HB GLN 6 -2.145 -0.446 -6.788
45 HG2 GLN 6 2HG GLN 6 -1.489 -1.372 -8.906
46 HG3 GLN 6 1HG GLN 6 -1.051 -2.898 -8.139
47 HE21 GLN 6 1HE2 GLN 6 -2.499 -4.005 -9.457
48 HE22 GLN 6 2HE2 GLN 6 -4.200 -3.908 -9.197
49 H ARG 7 H ARG 7 -0.678 1.469 -6.426
50 HA ARG 7 HA ARG 7 0.586 1.913 -3.884
51 HB2 ARG 7 2HB ARG 7 -0.586 3.845 -5.854
52 HB3 ARG 7 1HB ARG 7 0.104 4.311 -4.310
53 HG2 ARG 7 2HG ARG 7 2.224 3.312 -4.963
54 HG3 ARG 7 1HG ARG 7 1.547 2.925 -6.549
55 HD2 ARG 7 2HD ARG 7 1.833 5.676 -5.352
56 HD3 ARG 7 1HD ARG 7 2.849 5.004 -6.620
57 HE ARG 7 HE ARG 7 0.222 4.847 -7.466
58 HH11 ARG 7 1HH1 ARG 7 2.554 7.379 -6.648
59 HH12 ARG 7 2HH1 ARG 7 1.966 8.501 -7.788
60 HH21 ARG 7 1HH2 ARG 7 -0.644 6.422 -8.999
61 HH22 ARG 7 2HH2 ARG 7 0.091 7.937 -9.135
62 H CYS 8 H CYS 8 -0.265 2.415 -2.116
63 HA CYS 8 HA CYS 8 -3.158 2.767 -1.862
64 HB2 CYS 8 2HB CYS 8 -3.103 1.187 0.029
65 HB3 CYS 8 1HB CYS 8 -2.754 0.400 -1.508
66 H ASP 9 H ASP 9 -3.632 3.405 0.428
67 HA ASP 9 HA ASP 9 -1.393 4.502 1.931
68 HB2 ASP 9 2HB ASP 9 -2.294 6.385 0.503
69 HB3 ASP 9 1HB ASP 9 -3.853 6.154 1.298
70 H ASN 10 H ASN 10 -1.648 3.968 3.946
71 HA ASN 10 HA ASN 10 -3.797 2.371 4.816
72 HB2 ASN 10 2HB ASN 10 -1.493 3.583 6.320
73 HB3 ASN 10 1HB ASN 10 -2.749 2.678 7.138
74 HD21 ASN 10 1HD2 ASN 10 -3.054 0.742 4.984
75 HD22 ASN 10 2HD2 ASN 10 -1.659 -0.260 5.038
76 H ASP 11 H ASP 11 -3.220 5.784 5.103
77 HA ASP 11 HA ASP 11 -5.128 5.940 7.281
78 HB2 ASP 11 2HB ASP 11 -3.104 7.200 7.609
79 HB3 ASP 11 1HB ASP 11 -3.343 8.049 6.084
80 H ARG 12 H ARG 12 -4.661 7.377 4.099
81 HA ARG 12 HA ARG 12 -7.377 8.441 4.263
82 HB2 ARG 12 2HB ARG 12 -5.196 8.908 2.247
83 HB3 ARG 12 1HB ARG 12 -6.803 9.610 2.131
84 HG2 ARG 12 2HG ARG 12 -6.472 10.836 4.177
85 HG3 ARG 12 1HG ARG 12 -4.920 10.039 4.443
86 HD2 ARG 12 2HD ARG 12 -4.615 12.291 3.536
87 HD3 ARG 12 1HD ARG 12 -4.041 11.056 2.425
88 HE ARG 12 HE ARG 12 -6.691 12.256 2.121
89 HH11 ARG 12 1HH1 ARG 12 -3.489 11.484 0.755
90 HH12 ARG 12 2HH1 ARG 12 -3.871 12.045 -0.802
91 HH21 ARG 12 1HH2 ARG 12 -7.178 13.046 -0.054
92 HH22 ARG 12 2HH2 ARG 12 -5.985 12.943 -1.272
93 H GLY 13 H GLY 13 -5.664 5.922 2.697
94 HA2 GLY 13 2HA GLY 13 -6.616 4.090 1.667
95 HA3 GLY 13 1HA GLY 13 -8.141 4.943 1.524
96 HA PRO 14 HA PRO 14 -8.275 3.099 -0.135
97 HB2 PRO 14 2HB PRO 14 -7.592 1.561 -2.213
98 HB3 PRO 14 1HB PRO 14 -8.682 2.937 -2.445
99 HG2 PRO 14 2HG PRO 14 -5.719 2.793 -2.906
100 HG3 PRO 14 1HG PRO 14 -6.971 3.386 -4.007
101 HD2 PRO 14 2HD PRO 14 -5.522 5.061 -2.501
102 HD3 PRO 14 1HD PRO 14 -7.237 5.370 -2.844
103 H ARG 15 H ARG 15 -7.617 0.787 0.226
104 HA ARG 15 HA ARG 15 -4.788 0.677 0.934
105 HB2 ARG 15 2HB ARG 15 -7.062 -0.681 2.426
106 HB3 ARG 15 1HB ARG 15 -5.361 -0.840 2.796
107 HG2 ARG 15 2HG ARG 15 -6.237 0.619 4.399
108 HG3 ARG 15 1HG ARG 15 -5.401 1.676 3.259
109 HD2 ARG 15 2HD ARG 15 -7.571 2.198 2.234
110 HD3 ARG 15 1HD ARG 15 -8.361 1.114 3.377
111 HE ARG 15 HE ARG 15 -6.856 2.996 4.797
112 HH11 ARG 15 1HH1 ARG 15 -9.832 2.788 2.902
113 HH12 ARG 15 2HH1 ARG 15 -10.590 4.111 3.660
114 HH21 ARG 15 1HH2 ARG 15 -7.896 4.851 5.845
115 HH22 ARG 15 2HH2 ARG 15 -9.431 5.335 5.352
116 H CYS 16 H CYS 16 -4.312 -1.851 1.355
117 HA CYS 16 HA CYS 16 -4.449 -3.125 -1.170
118 HB2 CYS 16 2HB CYS 16 -3.806 -4.263 1.544
119 HB3 CYS 16 1HB CYS 16 -3.330 -4.925 -0.018
120 H CYS 17 H CYS 17 -5.753 -4.892 -1.786
121 HA CYS 17 HA CYS 17 -8.157 -5.394 -0.309
122 HB2 CYS 17 2HB CYS 17 -6.805 -7.160 -2.382
123 HB3 CYS 17 1HB CYS 17 -8.486 -7.247 -1.873
124 H SER 18 H SER 18 -8.557 -7.167 1.121
125 HA SER 18 HA SER 18 -6.397 -7.805 2.776
126 HB2 SER 18 2HB SER 18 -9.121 -9.106 2.630
127 HB3 SER 18 1HB SER 18 -8.027 -9.105 4.018
128 HG SER 18 HG SER 18 -8.225 -6.632 3.465
129 H GLY 19 H GLY 19 -4.782 -8.935 1.961
130 HA2 GLY 19 2HA GLY 19 -4.089 -11.348 1.772
131 HA3 GLY 19 1HA GLY 19 -5.302 -11.446 0.498
132 H GLN 20 H GLN 20 -4.237 -8.450 0.117
133 HA GLN 20 HA GLN 20 -2.338 -9.188 -1.974
134 HB2 GLN 20 2HB GLN 20 -3.968 -6.726 -1.454
135 HB3 GLN 20 1HB GLN 20 -2.781 -6.790 -2.736
136 HG2 GLN 20 2HG GLN 20 -5.142 -8.635 -2.464
137 HG3 GLN 20 1HG GLN 20 -5.088 -7.202 -3.488
138 HE21 GLN 20 1HE2 GLN 20 -5.521 -9.937 -4.225
139 HE22 GLN 20 2HE2 GLN 20 -4.297 -10.370 -5.345
140 H GLY 21 H GLY 21 -1.870 -8.503 1.133
141 HA2 GLY 21 2HA GLY 21 0.373 -8.240 1.861
142 HA3 GLY 21 1HA GLY 21 0.668 -7.186 0.484
143 H ASN 22 H ASN 22 1.627 -6.005 2.339
144 HA ASN 22 HA ASN 22 -0.391 -4.318 3.667
145 HB2 ASN 22 2HB ASN 22 2.406 -5.025 4.612
146 HB3 ASN 22 1HB ASN 22 1.340 -3.876 5.401
147 HD21 ASN 22 1HD2 ASN 22 2.066 -7.193 4.867
148 HD22 ASN 22 2HD2 ASN 22 0.928 -7.845 5.983
149 H CYS 23 H CYS 23 -0.006 -2.145 3.669
150 HA CYS 23 HA CYS 23 1.369 -1.087 1.430
151 HB2 CYS 23 2HB CYS 23 0.023 0.269 3.764
152 HB3 CYS 23 1HB CYS 23 0.687 1.117 2.377
153 H VAL 24 H VAL 24 3.542 -1.267 1.531
154 HA VAL 24 HA VAL 24 4.886 -0.143 3.834
155 HB VAL 24 HB VAL 24 5.978 -2.116 2.822
156 HG11 VAL 24 1HG1 VAL 24 6.225 -0.514 0.291
157 HG12 VAL 24 2HG1 VAL 24 5.219 -1.939 0.541
158 HG13 VAL 24 3HG1 VAL 24 6.976 -2.082 0.590
159 HG21 VAL 24 3HG2 VAL 24 8.253 -1.243 2.465
160 HG22 VAL 24 1HG2 VAL 24 7.459 -0.509 3.860
161 HG23 VAL 24 2HG2 VAL 24 7.588 0.387 2.347
162 HA PRO 25 HA PRO 25 4.331 3.683 1.797
163 HB2 PRO 25 2HB PRO 25 5.124 5.354 3.729
164 HB3 PRO 25 1HB PRO 25 3.646 4.395 3.866
165 HG2 PRO 25 2HG PRO 25 6.312 3.948 5.125
166 HG3 PRO 25 1HG PRO 25 4.697 3.660 5.790
167 HD2 PRO 25 2HD PRO 25 6.364 1.713 4.673
168 HD3 PRO 25 1HD PRO 25 4.616 1.556 4.939
169 H LEU 26 H LEU 26 5.382 5.061 0.580
170 HA LEU 26 HA LEU 26 8.287 5.300 0.780
171 HB2 LEU 26 2HB LEU 26 6.581 5.168 -1.722
172 HB3 LEU 26 1HB LEU 26 8.270 5.618 -1.728
173 HG LEU 26 HG LEU 26 8.696 3.248 -0.792
174 HD11 LEU 26 1HD1 LEU 26 6.422 2.685 -0.195
175 HD12 LEU 26 2HD1 LEU 26 7.070 1.560 -1.389
176 HD13 LEU 26 3HD1 LEU 26 5.933 2.815 -1.885
177 HD21 LEU 26 3HD2 LEU 26 9.319 3.926 -3.029
178 HD22 LEU 26 1HD2 LEU 26 7.680 3.613 -3.598
179 HD23 LEU 26 2HD2 LEU 26 8.685 2.281 -3.032
180 HA PRO 27 HA PRO 27 7.379 9.490 1.917
181 HB2 PRO 27 2HB PRO 27 9.691 9.859 0.044
182 HB3 PRO 27 1HB PRO 27 9.359 10.675 1.583
183 HG2 PRO 27 2HG PRO 27 11.030 8.651 1.567
184 HG3 PRO 27 1HG PRO 27 9.800 8.772 2.837
185 HD2 PRO 27 2HD PRO 27 9.923 6.925 0.513
186 HD3 PRO 27 1HD PRO 27 9.218 6.676 2.122
187 H PHE 28 H PHE 28 8.303 9.277 -1.540
188 HA PHE 28 HA PHE 28 6.149 11.191 -1.993
189 HB2 PHE 28 2HB PHE 28 7.383 11.866 -4.088
190 HB3 PHE 28 1HB PHE 28 8.047 12.343 -2.519
191 HD1 PHE 28 1HD PHE 28 8.504 10.226 -5.477
192 HD2 PHE 28 2HD PHE 28 10.178 11.537 -1.800
193 HE1 PHE 28 1HE PHE 28 10.686 9.312 -6.143
194 HE2 PHE 28 2HE PHE 28 12.358 10.622 -2.459
195 HZ PHE 28 HZ PHE 28 12.616 9.510 -4.624
196 H LEU 29 H LEU 29 7.144 8.175 -2.748
197 HA LEU 29 HA LEU 29 5.420 7.961 -5.074
198 HB2 LEU 29 2HB LEU 29 6.965 5.881 -3.593
199 HB3 LEU 29 1HB LEU 29 5.645 5.368 -4.617
200 HG LEU 29 HG LEU 29 7.639 5.112 -5.837
201 HD11 LEU 29 1HD1 LEU 29 7.325 6.524 -7.758
202 HD12 LEU 29 2HD1 LEU 29 6.323 7.618 -6.822
203 HD13 LEU 29 3HD1 LEU 29 5.781 5.962 -7.119
204 HD21 LEU 29 3HD2 LEU 29 9.208 6.944 -6.286
205 HD22 LEU 29 1HD2 LEU 29 9.116 6.530 -4.575
206 HD23 LEU 29 2HD2 LEU 29 8.295 7.969 -5.177
207 H GLY 30 H GLY 30 5.007 7.448 -1.682
208 HA2 GLY 30 2HA GLY 30 2.733 7.763 -0.905
209 HA3 GLY 30 1HA GLY 30 2.224 6.744 -2.253
210 H GLY 31 H GLY 31 2.245 4.596 -2.034
211 HA2 GLY 31 2HA GLY 31 3.862 3.203 -0.194
212 HA3 GLY 31 1HA GLY 31 2.202 3.354 0.403
213 H VAL 32 H VAL 32 3.636 0.977 -0.532
214 HA VAL 32 HA VAL 32 1.696 0.284 -2.624
215 HB VAL 32 HB VAL 32 3.339 -1.185 -3.771
216 HG11 VAL 32 1HG1 VAL 32 4.136 1.716 -3.695
217 HG12 VAL 32 2HG1 VAL 32 2.894 0.982 -4.712
218 HG13 VAL 32 3HG1 VAL 32 4.586 0.556 -4.948
219 HG21 VAL 32 3HG2 VAL 32 5.387 0.165 -2.014
220 HG22 VAL 32 1HG2 VAL 32 5.748 -0.881 -3.390
221 HG23 VAL 32 2HG2 VAL 32 4.931 -1.539 -1.971
222 H CYS 33 H CYS 33 0.894 -1.716 -2.631
223 HA CYS 33 HA CYS 33 0.941 -3.170 -0.170
224 HB2 CYS 33 2HB CYS 33 -0.291 -3.808 -2.848
225 HB3 CYS 33 1HB CYS 33 -0.574 -4.716 -1.364
226 H ALA 34 H ALA 34 2.502 -4.543 0.351
227 HA ALA 34 HA ALA 34 3.519 -6.300 -1.727
228 HB1 ALA 34 1HB ALA 34 5.275 -4.671 0.112
229 HB2 ALA 34 2HB ALA 34 5.098 -4.440 -1.627
230 HB3 ALA 34 3HB ALA 34 5.831 -5.918 -1.005
231 H VAL 35 H VAL 35 4.246 -8.251 -0.941
232 HA VAL 35 HA VAL 35 4.248 -8.683 1.880
233 HB VAL 35 HB VAL 35 1.957 -9.236 1.401
234 HG11 VAL 35 1HG1 VAL 35 1.998 -9.545 -0.977
235 HG12 VAL 35 2HG1 VAL 35 1.259 -10.954 -0.215
236 HG13 VAL 35 3HG1 VAL 35 2.918 -11.037 -0.803
237 HG21 VAL 35 3HG2 VAL 35 3.579 -11.758 1.686
238 HG22 VAL 35 1HG2 VAL 35 1.851 -11.626 2.024
239 HG23 VAL 35 2HG2 VAL 35 3.008 -10.706 2.981
Start of MODEL 15
1 H1 CYS 1 1HT CYS 1 -10.953 -1.024 -2.487
2 H2 CYS 1 2HT CYS 1 -10.581 -2.116 -3.718
3 H3 CYS 1 3HT CYS 1 -10.151 -0.497 -3.884
4 HA CYS 1 HA CYS 1 -8.588 -0.704 -2.091
5 HB2 CYS 1 2HB CYS 1 -8.139 -2.954 -1.164
6 HB3 CYS 1 1HB CYS 1 -9.783 -2.437 -0.818
7 H VAL 2 H VAL 2 -6.386 -1.667 -2.497
8 HA VAL 2 HA VAL 2 -6.157 -2.283 -5.355
9 HB VAL 2 HB VAL 2 -3.836 -1.301 -5.216
10 HG11 VAL 2 1HG1 VAL 2 -6.135 0.534 -4.570
11 HG12 VAL 2 2HG1 VAL 2 -5.719 -0.081 -6.166
12 HG13 VAL 2 3HG1 VAL 2 -4.615 1.012 -5.326
13 HG21 VAL 2 3HG2 VAL 2 -4.850 -0.287 -2.559
14 HG22 VAL 2 1HG2 VAL 2 -3.364 0.228 -3.357
15 HG23 VAL 2 2HG2 VAL 2 -3.534 -1.436 -2.797
16 H LEU 3 H LEU 3 -4.210 -3.450 -6.014
17 HA LEU 3 HA LEU 3 -3.877 -5.746 -4.207
18 HB2 LEU 3 2HB LEU 3 -3.428 -5.757 -7.186
19 HB3 LEU 3 1HB LEU 3 -3.573 -7.098 -6.060
20 HG LEU 3 HG LEU 3 -5.848 -5.280 -6.850
21 HD11 LEU 3 1HD1 LEU 3 -5.203 -8.083 -7.733
22 HD12 LEU 3 2HD1 LEU 3 -5.122 -6.628 -8.728
23 HD13 LEU 3 3HD1 LEU 3 -6.676 -7.197 -8.117
24 HD21 LEU 3 3HD2 LEU 3 -7.242 -7.007 -5.782
25 HD22 LEU 3 1HD2 LEU 3 -6.152 -6.223 -4.639
26 HD23 LEU 3 2HD2 LEU 3 -5.778 -7.832 -5.252
27 H ILE 4 H ILE 4 -1.745 -7.038 -5.032
28 HA ILE 4 HA ILE 4 0.403 -5.480 -4.149
29 HB ILE 4 HB ILE 4 1.892 -7.371 -4.866
30 HG12 ILE 4 2HG1 ILE 4 -0.732 -8.678 -5.649
31 HG13 ILE 4 1HG1 ILE 4 0.539 -8.194 -6.764
32 HG21 ILE 4 1HG2 ILE 4 1.056 -8.925 -3.164
33 HG22 ILE 4 2HG2 ILE 4 -0.464 -8.032 -3.124
34 HG23 ILE 4 3HG2 ILE 4 1.032 -7.244 -2.630
35 HD11 ILE 4 3HD1 ILE 4 0.754 -10.314 -4.633
36 HD12 ILE 4 1HD1 ILE 4 2.043 -9.833 -5.735
37 HD13 ILE 4 2HD1 ILE 4 0.579 -10.589 -6.366
38 H GLY 5 H GLY 5 1.858 -4.287 -5.007
39 HA2 GLY 5 2HA GLY 5 3.307 -3.465 -6.624
40 HA3 GLY 5 1HA GLY 5 2.425 -4.310 -7.877
41 H GLN 6 H GLN 6 0.095 -2.986 -6.103
42 HA GLN 6 HA GLN 6 -0.020 -0.557 -7.714
43 HB2 GLN 6 2HB GLN 6 -2.126 -2.036 -6.137
44 HB3 GLN 6 1HB GLN 6 -2.418 -0.555 -7.043
45 HG2 GLN 6 2HG GLN 6 -1.889 -1.681 -9.116
46 HG3 GLN 6 1HG GLN 6 -1.474 -3.150 -8.239
47 HE21 GLN 6 1HE2 GLN 6 -2.996 -4.350 -9.311
48 HE22 GLN 6 2HE2 GLN 6 -4.691 -4.175 -9.061
49 H ARG 7 H ARG 7 -0.772 1.357 -6.614
50 HA ARG 7 HA ARG 7 0.727 1.629 -4.176
51 HB2 ARG 7 2HB ARG 7 -0.464 3.695 -6.004
52 HB3 ARG 7 1HB ARG 7 0.360 4.083 -4.498
53 HG2 ARG 7 2HG ARG 7 2.367 2.945 -5.340
54 HG3 ARG 7 1HG ARG 7 1.534 2.666 -6.868
55 HD2 ARG 7 2HD ARG 7 2.080 5.377 -5.661
56 HD3 ARG 7 1HD ARG 7 3.043 4.591 -6.911
57 HE ARG 7 HE ARG 7 0.253 4.911 -7.552
58 HH11 ARG 7 1HH1 ARG 7 3.505 6.309 -7.796
59 HH12 ARG 7 2HH1 ARG 7 3.104 7.289 -9.136
60 HH21 ARG 7 1HH2 ARG 7 -0.243 6.247 -9.376
61 HH22 ARG 7 2HH2 ARG 7 0.962 7.247 -10.056
62 H CYS 8 H CYS 8 0.087 2.383 -2.367
63 HA CYS 8 HA CYS 8 -2.768 2.485 -1.760
64 HB2 CYS 8 2HB CYS 8 -2.362 0.345 -1.174
65 HB3 CYS 8 1HB CYS 8 -0.658 0.597 -0.750
66 H ASP 9 H ASP 9 -2.989 3.231 0.422
67 HA ASP 9 HA ASP 9 -0.871 4.542 1.824
68 HB2 ASP 9 2HB ASP 9 -1.480 6.357 0.161
69 HB3 ASP 9 1HB ASP 9 -3.098 6.355 0.874
70 H ASN 10 H ASN 10 -1.271 4.104 3.767
71 HA ASN 10 HA ASN 10 -3.527 2.755 4.663
72 HB2 ASN 10 2HB ASN 10 -1.333 4.094 6.206
73 HB3 ASN 10 1HB ASN 10 -2.606 3.164 6.981
74 HD21 ASN 10 1HD2 ASN 10 -2.593 0.962 6.778
75 HD22 ASN 10 2HD2 ASN 10 -1.238 0.080 6.175
76 H ASP 11 H ASP 11 -2.792 6.200 4.983
77 HA ASP 11 HA ASP 11 -5.134 6.477 6.692
78 HB2 ASP 11 2HB ASP 11 -3.141 7.702 7.409
79 HB3 ASP 11 1HB ASP 11 -3.127 8.589 5.890
80 H ARG 12 H ARG 12 -4.004 7.719 3.578
81 HA ARG 12 HA ARG 12 -6.495 9.151 3.179
82 HB2 ARG 12 2HB ARG 12 -4.185 8.657 1.304
83 HB3 ARG 12 1HB ARG 12 -5.579 9.644 0.915
84 HG2 ARG 12 2HG ARG 12 -3.640 10.187 3.148
85 HG3 ARG 12 1HG ARG 12 -3.603 10.949 1.557
86 HD2 ARG 12 2HD ARG 12 -5.859 11.847 1.973
87 HD3 ARG 12 1HD ARG 12 -5.824 11.123 3.579
88 HE ARG 12 HE ARG 12 -3.720 12.984 2.838
89 HH11 ARG 12 1HH1 ARG 12 -6.624 12.342 4.766
90 HH12 ARG 12 2HH1 ARG 12 -6.374 13.667 5.811
91 HH21 ARG 12 1HH2 ARG 12 -3.407 14.804 4.287
92 HH22 ARG 12 2HH2 ARG 12 -4.537 15.068 5.554
93 H GLY 13 H GLY 13 -4.999 6.256 1.983
94 HA2 GLY 13 2HA GLY 13 -6.257 4.413 1.171
95 HA3 GLY 13 1HA GLY 13 -7.507 5.546 0.645
96 HA PRO 14 HA PRO 14 -7.558 3.445 -0.764
97 HB2 PRO 14 2HB PRO 14 -6.784 1.618 -2.552
98 HB3 PRO 14 1HB PRO 14 -7.643 3.078 -3.060
99 HG2 PRO 14 2HG PRO 14 -4.702 2.506 -3.121
100 HG3 PRO 14 1HG PRO 14 -5.715 3.211 -4.388
101 HD2 PRO 14 2HD PRO 14 -4.173 4.698 -2.723
102 HD3 PRO 14 1HD PRO 14 -5.695 5.291 -3.418
103 H ARG 15 H ARG 15 -7.391 1.213 -0.010
104 HA ARG 15 HA ARG 15 -4.817 0.659 1.279
105 HB2 ARG 15 2HB ARG 15 -7.638 -0.130 2.029
106 HB3 ARG 15 1HB ARG 15 -6.200 -0.737 2.831
107 HG2 ARG 15 2HG ARG 15 -5.630 1.572 3.501
108 HG3 ARG 15 1HG ARG 15 -7.117 2.131 2.739
109 HD2 ARG 15 2HD ARG 15 -7.366 1.849 5.173
110 HD3 ARG 15 1HD ARG 15 -8.446 0.794 4.262
111 HE ARG 15 HE ARG 15 -6.244 -0.738 4.713
112 HH11 ARG 15 1HH1 ARG 15 -8.393 1.066 6.887
113 HH12 ARG 15 2HH1 ARG 15 -8.273 -0.052 8.156
114 HH21 ARG 15 1HH2 ARG 15 -6.036 -2.242 6.495
115 HH22 ARG 15 2HH2 ARG 15 -6.910 -1.980 7.931
116 H CYS 16 H CYS 16 -4.115 -1.523 1.317
117 HA CYS 16 HA CYS 16 -4.441 -2.993 -1.074
118 HB2 CYS 16 2HB CYS 16 -3.345 -3.912 1.585
119 HB3 CYS 16 1HB CYS 16 -3.002 -4.603 0.006
120 H CYS 17 H CYS 17 -5.725 -4.742 -1.502
121 HA CYS 17 HA CYS 17 -8.032 -5.247 0.087
122 HB2 CYS 17 2HB CYS 17 -6.801 -7.023 -2.033
123 HB3 CYS 17 1HB CYS 17 -8.467 -7.047 -1.480
124 H SER 18 H SER 18 -8.562 -7.304 1.133
125 HA SER 18 HA SER 18 -6.676 -8.122 3.004
126 HB2 SER 18 2HB SER 18 -9.131 -8.221 3.312
127 HB3 SER 18 1HB SER 18 -9.223 -9.504 2.109
128 HG SER 18 HG SER 18 -7.560 -9.753 4.355
129 H GLY 19 H GLY 19 -4.850 -9.076 2.389
130 HA2 GLY 19 2HA GLY 19 -3.802 -11.217 1.969
131 HA3 GLY 19 1HA GLY 19 -5.027 -11.514 0.739
132 H GLN 20 H GLN 20 -3.792 -8.336 0.846
133 HA GLN 20 HA GLN 20 -2.180 -8.952 -1.510
134 HB2 GLN 20 2HB GLN 20 -3.768 -6.500 -0.820
135 HB3 GLN 20 1HB GLN 20 -2.611 -6.517 -2.140
136 HG2 GLN 20 2HG GLN 20 -5.020 -8.288 -1.860
137 HG3 GLN 20 1HG GLN 20 -4.888 -6.891 -2.927
138 HE21 GLN 20 1HE2 GLN 20 -5.441 -9.623 -3.638
139 HE22 GLN 20 2HE2 GLN 20 -4.175 -10.106 -4.714
140 H GLY 21 H GLY 21 -0.868 -9.413 0.671
141 HA2 GLY 21 2HA GLY 21 1.266 -8.935 1.510
142 HA3 GLY 21 1HA GLY 21 1.265 -7.559 0.447
143 H ASN 22 H ASN 22 2.100 -6.209 1.854
144 HA ASN 22 HA ASN 22 0.275 -5.229 3.931
145 HB2 ASN 22 2HB ASN 22 3.317 -5.357 4.058
146 HB3 ASN 22 1HB ASN 22 2.311 -4.481 5.197
147 HD21 ASN 22 1HD2 ASN 22 3.422 -7.610 4.172
148 HD22 ASN 22 2HD2 ASN 22 2.832 -8.482 5.522
149 H CYS 23 H CYS 23 0.179 -2.972 3.974
150 HA CYS 23 HA CYS 23 1.002 -1.708 1.519
151 HB2 CYS 23 2HB CYS 23 -1.233 -1.275 2.536
152 HB3 CYS 23 1HB CYS 23 -0.439 -0.597 3.948
153 H VAL 24 H VAL 24 3.152 -1.467 1.549
154 HA VAL 24 HA VAL 24 4.385 -0.313 3.900
155 HB VAL 24 HB VAL 24 5.539 -2.290 3.060
156 HG11 VAL 24 1HG1 VAL 24 4.872 -2.278 0.741
157 HG12 VAL 24 2HG1 VAL 24 6.628 -2.388 0.872
158 HG13 VAL 24 3HG1 VAL 24 5.869 -0.856 0.438
159 HG21 VAL 24 3HG2 VAL 24 6.931 -0.570 4.045
160 HG22 VAL 24 1HG2 VAL 24 7.137 0.195 2.470
161 HG23 VAL 24 2HG2 VAL 24 7.805 -1.413 2.767
162 HA PRO 25 HA PRO 25 3.958 3.536 1.799
163 HB2 PRO 25 2HB PRO 25 4.800 5.121 3.786
164 HB3 PRO 25 1HB PRO 25 3.227 4.324 3.826
165 HG2 PRO 25 2HG PRO 25 5.769 3.555 5.188
166 HG3 PRO 25 1HG PRO 25 4.112 3.532 5.811
167 HD2 PRO 25 2HD PRO 25 5.412 1.315 4.888
168 HD3 PRO 25 1HD PRO 25 3.647 1.504 4.853
169 H LEU 26 H LEU 26 5.224 4.763 0.581
170 HA LEU 26 HA LEU 26 8.061 4.868 1.200
171 HB2 LEU 26 2HB LEU 26 6.679 5.113 -1.500
172 HB3 LEU 26 1HB LEU 26 8.374 5.436 -1.225
173 HG LEU 26 HG LEU 26 8.543 2.987 -0.491
174 HD11 LEU 26 1HD1 LEU 26 6.199 2.487 -0.239
175 HD12 LEU 26 2HD1 LEU 26 6.928 1.454 -1.469
176 HD13 LEU 26 3HD1 LEU 26 5.922 2.820 -1.949
177 HD21 LEU 26 3HD2 LEU 26 7.944 3.668 -3.355
178 HD22 LEU 26 1HD2 LEU 26 8.793 2.229 -2.795
179 HD23 LEU 26 2HD2 LEU 26 9.502 3.823 -2.539
180 HA PRO 27 HA PRO 27 7.192 9.116 1.971
181 HB2 PRO 27 2HB PRO 27 9.681 10.142 1.726
182 HB3 PRO 27 1HB PRO 27 9.214 9.116 3.101
183 HG2 PRO 27 2HG PRO 27 10.724 8.444 0.611
184 HG3 PRO 27 1HG PRO 27 11.038 7.936 2.280
185 HD2 PRO 27 2HD PRO 27 9.813 6.349 0.453
186 HD3 PRO 27 1HD PRO 27 9.477 6.257 2.192
187 H PHE 28 H PHE 28 6.332 8.626 -0.518
188 HA PHE 28 HA PHE 28 7.172 11.066 -1.875
189 HB2 PHE 28 2HB PHE 28 6.847 8.460 -3.422
190 HB3 PHE 28 1HB PHE 28 7.235 10.044 -4.083
191 HD1 PHE 28 2HD PHE 28 9.430 11.011 -3.778
192 HD2 PHE 28 1HD PHE 28 8.485 7.124 -2.369
193 HE1 PHE 28 2HE PHE 28 11.818 10.529 -3.515
194 HE2 PHE 28 1HE PHE 28 10.869 6.627 -2.098
195 HZ PHE 28 HZ PHE 28 12.539 8.334 -2.664
196 H LEU 29 H LEU 29 5.053 8.546 -3.107
197 HA LEU 29 HA LEU 29 2.912 10.552 -3.067
198 HB2 LEU 29 2HB LEU 29 3.130 8.075 -4.792
199 HB3 LEU 29 1HB LEU 29 1.813 9.219 -4.833
200 HG LEU 29 HG LEU 29 3.572 10.950 -5.548
201 HD11 LEU 29 1HD1 LEU 29 5.549 9.665 -4.983
202 HD12 LEU 29 2HD1 LEU 29 5.532 10.095 -6.691
203 HD13 LEU 29 3HD1 LEU 29 5.127 8.452 -6.187
204 HD21 LEU 29 3HD2 LEU 29 2.850 8.665 -7.357
205 HD22 LEU 29 1HD2 LEU 29 3.410 10.253 -7.877
206 HD23 LEU 29 2HD2 LEU 29 1.877 10.099 -7.021
207 H GLY 30 H GLY 30 3.811 7.403 -2.036
208 HA2 GLY 30 2HA GLY 30 2.065 7.214 0.022
209 HA3 GLY 30 1HA GLY 30 1.221 6.510 -1.356
210 H GLY 31 H GLY 31 1.300 4.465 -0.460
211 HA2 GLY 31 2HA GLY 31 3.981 3.296 -0.346
212 HA3 GLY 31 1HA GLY 31 2.595 2.742 0.599
213 H VAL 32 H VAL 32 3.476 0.782 -0.503
214 HA VAL 32 HA VAL 32 1.726 0.333 -2.796
215 HB VAL 32 HB VAL 32 4.053 0.705 -3.584
216 HG11 VAL 32 1HG1 VAL 32 5.691 -1.135 -3.384
217 HG12 VAL 32 2HG1 VAL 32 4.636 -1.896 -2.204
218 HG13 VAL 32 3HG1 VAL 32 5.375 -0.323 -1.842
219 HG21 VAL 32 3HG2 VAL 32 2.918 -2.011 -4.174
220 HG22 VAL 32 1HG2 VAL 32 4.158 -1.211 -5.138
221 HG23 VAL 32 2HG2 VAL 32 2.550 -0.499 -5.004
222 H CYS 33 H CYS 33 1.108 -1.718 -3.000
223 HA CYS 33 HA CYS 33 1.036 -3.251 -0.514
224 HB2 CYS 33 2HB CYS 33 -0.372 -3.742 -3.148
225 HB3 CYS 33 1HB CYS 33 -0.690 -4.583 -1.632
226 H ALA 34 H ALA 34 2.473 -4.843 -0.193
227 HA ALA 34 HA ALA 34 3.465 -6.349 -2.456
228 HB1 ALA 34 1HB ALA 34 5.034 -4.473 -2.298
229 HB2 ALA 34 2HB ALA 34 5.814 -5.974 -1.802
230 HB3 ALA 34 3HB ALA 34 5.282 -4.815 -0.586
231 H VAL 35 H VAL 35 3.996 -8.388 -1.844
232 HA VAL 35 HA VAL 35 3.153 -9.122 0.784
233 HB VAL 35 HB VAL 35 2.484 -10.550 -1.112
234 HG11 VAL 35 1HG1 VAL 35 4.363 -10.349 -2.584
235 HG12 VAL 35 2HG1 VAL 35 4.089 -12.053 -2.216
236 HG13 VAL 35 3HG1 VAL 35 5.403 -11.182 -1.430
237 HG21 VAL 35 3HG2 VAL 35 2.583 -11.571 1.074
238 HG22 VAL 35 1HG2 VAL 35 4.287 -11.961 0.844
239 HG23 VAL 35 2HG2 VAL 35 3.059 -12.740 -0.155
Start of MODEL 16
1 H1 CYS 1 1HT CYS 1 -10.352 -1.077 -4.352
2 H2 CYS 1 2HT CYS 1 -11.230 -1.962 -3.190
3 H3 CYS 1 3HT CYS 1 -10.549 -2.732 -4.524
4 HA CYS 1 HA CYS 1 -8.963 -1.345 -2.485
5 HB2 CYS 1 2HB CYS 1 -8.346 -3.600 -1.696
6 HB3 CYS 1 1HB CYS 1 -10.071 -3.321 -1.510
7 H VAL 2 H VAL 2 -6.679 -1.848 -2.693
8 HA VAL 2 HA VAL 2 -6.045 -2.120 -5.527
9 HB VAL 2 HB VAL 2 -3.977 -0.892 -5.088
10 HG11 VAL 2 1HG1 VAL 2 -5.858 0.415 -5.741
11 HG12 VAL 2 2HG1 VAL 2 -4.932 1.315 -4.539
12 HG13 VAL 2 3HG1 VAL 2 -6.430 0.506 -4.077
13 HG21 VAL 2 3HG2 VAL 2 -3.564 0.195 -2.948
14 HG22 VAL 2 1HG2 VAL 2 -3.562 -1.561 -2.787
15 HG23 VAL 2 2HG2 VAL 2 -4.963 -0.629 -2.253
16 H LEU 3 H LEU 3 -4.158 -3.266 -6.189
17 HA LEU 3 HA LEU 3 -3.720 -5.581 -4.483
18 HB2 LEU 3 2HB LEU 3 -2.923 -5.171 -7.365
19 HB3 LEU 3 1HB LEU 3 -2.928 -6.653 -6.432
20 HG LEU 3 HG LEU 3 -5.413 -5.148 -7.235
21 HD11 LEU 3 1HD1 LEU 3 -4.285 -6.035 -9.181
22 HD12 LEU 3 2HD1 LEU 3 -5.753 -6.952 -8.841
23 HD13 LEU 3 3HD1 LEU 3 -4.178 -7.622 -8.418
24 HD21 LEU 3 3HD2 LEU 3 -6.557 -7.235 -6.587
25 HD22 LEU 3 1HD2 LEU 3 -5.738 -6.465 -5.227
26 HD23 LEU 3 2HD2 LEU 3 -5.020 -7.874 -6.007
27 H ILE 4 H ILE 4 -1.291 -6.472 -5.230
28 HA ILE 4 HA ILE 4 0.494 -4.844 -3.827
29 HB ILE 4 HB ILE 4 2.309 -6.302 -4.624
30 HG12 ILE 4 2HG1 ILE 4 0.202 -7.654 -6.323
31 HG13 ILE 4 1HG1 ILE 4 1.479 -6.617 -6.948
32 HG21 ILE 4 1HG2 ILE 4 -0.181 -7.765 -3.804
33 HG22 ILE 4 2HG2 ILE 4 1.012 -7.023 -2.737
34 HG23 ILE 4 3HG2 ILE 4 1.454 -8.416 -3.729
35 HD11 ILE 4 3HD1 ILE 4 1.878 -9.222 -5.492
36 HD12 ILE 4 1HD1 ILE 4 3.156 -8.192 -6.138
37 HD13 ILE 4 2HD1 ILE 4 2.013 -8.973 -7.233
38 H GLY 5 H GLY 5 2.076 -3.461 -4.386
39 HA2 GLY 5 2HA GLY 5 3.491 -2.233 -5.800
40 HA3 GLY 5 1HA GLY 5 2.629 -2.882 -7.189
41 H GLN 6 H GLN 6 0.069 -2.167 -5.871
42 HA GLN 6 HA GLN 6 -0.124 0.436 -7.049
43 HB2 GLN 6 2HB GLN 6 -2.124 -1.265 -5.607
44 HB3 GLN 6 1HB GLN 6 -2.518 0.173 -6.551
45 HG2 GLN 6 2HG GLN 6 -1.693 -0.930 -8.565
46 HG3 GLN 6 1HG GLN 6 -1.256 -2.345 -7.620
47 HE21 GLN 6 1HE2 GLN 6 -4.215 -0.495 -7.178
48 HE22 GLN 6 2HE2 GLN 6 -5.249 -1.767 -7.724
49 H ARG 7 H ARG 7 -0.965 2.227 -5.929
50 HA ARG 7 HA ARG 7 0.289 2.453 -3.324
51 HB2 ARG 7 2HB ARG 7 -0.795 4.544 -5.203
52 HB3 ARG 7 1HB ARG 7 -0.291 4.924 -3.570
53 HG2 ARG 7 2HG ARG 7 1.498 5.503 -5.070
54 HG3 ARG 7 1HG ARG 7 1.960 4.096 -4.116
55 HD2 ARG 7 2HD ARG 7 1.673 2.625 -5.957
56 HD3 ARG 7 1HD ARG 7 0.785 3.843 -6.860
57 HE ARG 7 HE ARG 7 3.075 5.056 -6.696
58 HH11 ARG 7 1HH1 ARG 7 2.756 1.502 -7.235
59 HH12 ARG 7 2HH1 ARG 7 3.994 1.474 -8.384
60 HH21 ARG 7 1HH2 ARG 7 4.792 4.887 -8.340
61 HH22 ARG 7 2HH2 ARG 7 5.150 3.369 -9.016
62 H CYS 8 H CYS 8 -0.674 2.898 -1.507
63 HA CYS 8 HA CYS 8 -3.619 2.924 -1.481
64 HB2 CYS 8 2HB CYS 8 -3.450 1.416 0.521
65 HB3 CYS 8 1HB CYS 8 -3.005 0.663 -1.011
66 H ASP 9 H ASP 9 -4.458 3.549 0.723
67 HA ASP 9 HA ASP 9 -2.632 5.352 2.176
68 HB2 ASP 9 2HB ASP 9 -4.221 6.641 0.642
69 HB3 ASP 9 1HB ASP 9 -5.535 5.960 1.605
70 H ASN 10 H ASN 10 -2.636 4.868 4.271
71 HA ASN 10 HA ASN 10 -4.229 2.702 5.243
72 HB2 ASN 10 2HB ASN 10 -2.268 4.512 6.668
73 HB3 ASN 10 1HB ASN 10 -3.066 3.143 7.416
74 HD21 ASN 10 1HD2 ASN 10 -2.403 1.077 6.909
75 HD22 ASN 10 2HD2 ASN 10 -0.947 0.761 6.062
76 H ASP 11 H ASP 11 -4.499 6.124 5.357
77 HA ASP 11 HA ASP 11 -6.153 6.159 7.739
78 HB2 ASP 11 2HB ASP 11 -5.486 8.379 5.799
79 HB3 ASP 11 1HB ASP 11 -6.384 8.578 7.290
80 H ARG 12 H ARG 12 -6.549 7.019 4.351
81 HA ARG 12 HA ARG 12 -9.460 7.232 4.751
82 HB2 ARG 12 2HB ARG 12 -7.691 8.284 2.572
83 HB3 ARG 12 1HB ARG 12 -9.407 8.613 2.765
84 HG2 ARG 12 2HG ARG 12 -9.067 9.975 4.611
85 HG3 ARG 12 1HG ARG 12 -7.481 9.278 4.950
86 HD2 ARG 12 2HD ARG 12 -8.159 10.968 2.552
87 HD3 ARG 12 1HD ARG 12 -7.339 11.547 4.003
88 HE ARG 12 HE ARG 12 -5.886 9.375 3.127
89 HH11 ARG 12 1HH1 ARG 12 -6.763 12.522 1.735
90 HH12 ARG 12 2HH1 ARG 12 -5.330 12.667 0.832
91 HH21 ARG 12 1HH2 ARG 12 -3.934 9.595 1.858
92 HH22 ARG 12 2HH2 ARG 12 -3.708 10.978 0.879
93 H GLY 13 H GLY 13 -7.070 5.405 3.071
94 HA2 GLY 13 2HA GLY 13 -7.493 3.471 1.816
95 HA3 GLY 13 1HA GLY 13 -9.162 4.010 1.604
96 HA PRO 14 HA PRO 14 -8.923 2.503 -0.347
97 HB2 PRO 14 2HB PRO 14 -7.650 1.402 -2.448
98 HB3 PRO 14 1HB PRO 14 -9.030 2.488 -2.656
99 HG2 PRO 14 2HG PRO 14 -6.100 3.114 -2.833
100 HG3 PRO 14 1HG PRO 14 -7.390 3.567 -3.960
101 HD2 PRO 14 2HD PRO 14 -6.467 5.283 -2.123
102 HD3 PRO 14 1HD PRO 14 -8.186 5.243 -2.567
103 H ARG 15 H ARG 15 -8.043 0.399 0.096
104 HA ARG 15 HA ARG 15 -5.238 0.480 0.844
105 HB2 ARG 15 2HB ARG 15 -7.495 -0.789 2.391
106 HB3 ARG 15 1HB ARG 15 -5.802 -1.100 2.721
107 HG2 ARG 15 2HG ARG 15 -5.509 1.351 3.124
108 HG3 ARG 15 1HG ARG 15 -7.257 1.522 2.965
109 HD2 ARG 15 2HD ARG 15 -5.859 -0.239 4.960
110 HD3 ARG 15 1HD ARG 15 -6.500 1.361 5.314
111 HE ARG 15 HE ARG 15 -8.692 0.302 4.526
112 HH11 ARG 15 1HH1 ARG 15 -6.165 -1.425 6.305
113 HH12 ARG 15 2HH1 ARG 15 -7.229 -2.481 7.104
114 HH21 ARG 15 1HH2 ARG 15 -10.177 -1.168 5.631
115 HH22 ARG 15 2HH2 ARG 15 -9.556 -2.313 6.726
116 H CYS 16 H CYS 16 -4.545 -1.919 1.315
117 HA CYS 16 HA CYS 16 -4.493 -3.179 -1.208
118 HB2 CYS 16 2HB CYS 16 -3.795 -4.370 1.467
119 HB3 CYS 16 1HB CYS 16 -3.129 -4.787 -0.107
120 H CYS 17 H CYS 17 -5.642 -4.967 -1.913
121 HA CYS 17 HA CYS 17 -7.996 -5.808 -0.527
122 HB2 CYS 17 2HB CYS 17 -6.418 -7.381 -2.602
123 HB3 CYS 17 1HB CYS 17 -8.114 -7.575 -2.189
124 H SER 18 H SER 18 -8.238 -7.735 0.792
125 HA SER 18 HA SER 18 -6.164 -8.241 2.542
126 HB2 SER 18 2HB SER 18 -7.649 -10.192 3.255
127 HB3 SER 18 1HB SER 18 -8.382 -8.589 3.284
128 HG SER 18 HG SER 18 -8.786 -10.730 1.529
129 H GLY 19 H GLY 19 -4.291 -9.124 2.078
130 HA2 GLY 19 2HA GLY 19 -3.131 -11.253 1.742
131 HA3 GLY 19 1HA GLY 19 -4.248 -11.563 0.416
132 H GLN 20 H GLN 20 -3.829 -8.483 0.001
133 HA GLN 20 HA GLN 20 -1.727 -8.862 -1.973
134 HB2 GLN 20 2HB GLN 20 -3.722 -6.654 -1.540
135 HB3 GLN 20 1HB GLN 20 -2.521 -6.615 -2.817
136 HG2 GLN 20 2HG GLN 20 -4.629 -8.737 -2.474
137 HG3 GLN 20 1HG GLN 20 -4.713 -7.365 -3.582
138 HE21 GLN 20 1HE2 GLN 20 -4.702 -10.272 -4.038
139 HE22 GLN 20 2HE2 GLN 20 -3.431 -10.543 -5.168
140 H GLY 21 H GLY 21 -1.199 -8.576 0.919
141 HA2 GLY 21 2HA GLY 21 0.785 -7.862 1.851
142 HA3 GLY 21 1HA GLY 21 0.964 -6.717 0.535
143 H ASN 22 H ASN 22 1.634 -5.435 2.352
144 HA ASN 22 HA ASN 22 -0.657 -4.016 3.510
145 HB2 ASN 22 2HB ASN 22 1.958 -4.651 4.914
146 HB3 ASN 22 1HB ASN 22 0.681 -3.646 5.579
147 HD21 ASN 22 1HD2 ASN 22 1.808 -6.829 5.033
148 HD22 ASN 22 2HD2 ASN 22 0.551 -7.671 5.852
149 H CYS 23 H CYS 23 -0.240 -1.802 3.896
150 HA CYS 23 HA CYS 23 1.117 -0.563 1.750
151 HB2 CYS 23 2HB CYS 23 -0.157 0.607 4.219
152 HB3 CYS 23 1HB CYS 23 0.434 1.545 2.855
153 H VAL 24 H VAL 24 3.262 -0.622 1.699
154 HA VAL 24 HA VAL 24 4.678 0.259 4.069
155 HB VAL 24 HB VAL 24 5.543 -1.847 3.164
156 HG11 VAL 24 1HG1 VAL 24 6.650 -2.008 0.989
157 HG12 VAL 24 2HG1 VAL 24 6.116 -0.371 0.609
158 HG13 VAL 24 3HG1 VAL 24 4.928 -1.652 0.839
159 HG21 VAL 24 3HG2 VAL 24 7.914 -1.278 2.934
160 HG22 VAL 24 1HG2 VAL 24 7.133 -0.386 4.240
161 HG23 VAL 24 2HG2 VAL 24 7.476 0.417 2.706
162 HA PRO 25 HA PRO 25 4.872 4.149 1.867
163 HB2 PRO 25 2HB PRO 25 6.221 5.300 4.134
164 HB3 PRO 25 1HB PRO 25 4.553 5.542 3.622
165 HG2 PRO 25 2HG PRO 25 5.292 4.219 5.920
166 HG3 PRO 25 1HG PRO 25 3.754 3.981 5.079
167 HD2 PRO 25 2HD PRO 25 6.215 2.294 5.050
168 HD3 PRO 25 1HD PRO 25 4.494 1.839 5.018
169 H LEU 26 H LEU 26 6.369 4.491 0.357
170 HA LEU 26 HA LEU 26 9.118 4.662 1.266
171 HB2 LEU 26 2HB LEU 26 8.724 2.607 -0.028
172 HB3 LEU 26 1HB LEU 26 8.210 3.604 -1.391
173 HG LEU 26 HG LEU 26 10.466 4.571 -1.508
174 HD11 LEU 26 1HD1 LEU 26 11.148 4.343 0.802
175 HD12 LEU 26 2HD1 LEU 26 12.308 3.535 -0.251
176 HD13 LEU 26 3HD1 LEU 26 11.131 2.586 0.655
177 HD21 LEU 26 3HD2 LEU 26 10.418 1.559 -1.605
178 HD22 LEU 26 1HD2 LEU 26 11.633 2.584 -2.367
179 HD23 LEU 26 2HD2 LEU 26 9.960 2.654 -2.910
180 HA PRO 27 HA PRO 27 8.037 8.829 -0.038
181 HB2 PRO 27 2HB PRO 27 10.882 9.324 0.610
182 HB3 PRO 27 1HB PRO 27 9.428 10.093 1.256
183 HG2 PRO 27 2HG PRO 27 10.738 8.355 2.769
184 HG3 PRO 27 1HG PRO 27 8.961 8.280 2.673
185 HD2 PRO 27 2HD PRO 27 10.980 6.626 1.236
186 HD3 PRO 27 1HD PRO 27 9.562 6.153 2.216
187 H PHE 28 H PHE 28 8.541 7.332 -2.230
188 HA PHE 28 HA PHE 28 9.828 9.332 -3.962
189 HB2 PHE 28 2HB PHE 28 10.147 6.336 -4.384
190 HB3 PHE 28 1HB PHE 28 10.765 7.595 -5.435
191 HD1 PHE 28 1HD PHE 28 12.444 9.273 -4.265
192 HD2 PHE 28 2HD PHE 28 11.531 5.364 -2.883
193 HE1 PHE 28 1HE PHE 28 14.570 9.218 -3.025
194 HE2 PHE 28 2HE PHE 28 13.642 5.301 -1.629
195 HZ PHE 28 HZ PHE 28 15.162 7.220 -1.698
196 H LEU 29 H LEU 29 7.999 6.348 -3.845
197 HA LEU 29 HA LEU 29 6.263 7.335 -5.973
198 HB2 LEU 29 2HB LEU 29 5.692 5.061 -6.513
199 HB3 LEU 29 1HB LEU 29 7.424 5.252 -6.521
200 HG LEU 29 HG LEU 29 5.826 3.873 -4.341
201 HD11 LEU 29 1HD1 LEU 29 7.531 2.735 -6.542
202 HD12 LEU 29 2HD1 LEU 29 5.772 2.641 -6.423
203 HD13 LEU 29 3HD1 LEU 29 6.784 1.820 -5.232
204 HD21 LEU 29 3HD2 LEU 29 8.027 2.996 -3.621
205 HD22 LEU 29 1HD2 LEU 29 7.906 4.742 -3.417
206 HD23 LEU 29 2HD2 LEU 29 8.815 4.078 -4.769
207 H GLY 30 H GLY 30 6.302 6.545 -2.628
208 HA2 GLY 30 2HA GLY 30 4.446 7.508 -1.389
209 HA3 GLY 30 1HA GLY 30 3.376 6.794 -2.596
210 H GLY 31 H GLY 31 2.289 5.649 -0.919
211 HA2 GLY 31 2HA GLY 31 3.899 3.510 0.260
212 HA3 GLY 31 1HA GLY 31 2.342 3.994 0.902
213 H VAL 32 H VAL 32 3.723 1.610 -0.386
214 HA VAL 32 HA VAL 32 1.577 0.984 -2.316
215 HB VAL 32 HB VAL 32 3.158 -0.417 -3.589
216 HG11 VAL 32 1HG1 VAL 32 2.766 1.857 -4.309
217 HG12 VAL 32 2HG1 VAL 32 4.437 1.391 -4.630
218 HG13 VAL 32 3HG1 VAL 32 4.058 2.435 -3.258
219 HG21 VAL 32 3HG2 VAL 32 5.576 -0.234 -3.208
220 HG22 VAL 32 1HG2 VAL 32 4.758 -0.945 -1.816
221 HG23 VAL 32 2HG2 VAL 32 5.276 0.740 -1.767
222 H CYS 33 H CYS 33 0.811 -1.063 -2.396
223 HA CYS 33 HA CYS 33 0.929 -2.591 0.004
224 HB2 CYS 33 2HB CYS 33 -0.325 -3.157 -2.680
225 HB3 CYS 33 1HB CYS 33 -0.538 -4.164 -1.250
226 H ALA 34 H ALA 34 2.534 -3.905 0.503
227 HA ALA 34 HA ALA 34 3.721 -5.515 -1.624
228 HB1 ALA 34 1HB ALA 34 5.192 -4.180 0.651
229 HB2 ALA 34 2HB ALA 34 5.305 -3.743 -1.054
230 HB3 ALA 34 3HB ALA 34 5.902 -5.307 -0.502
231 H VAL 35 H VAL 35 3.959 -7.619 -1.093
232 HA VAL 35 HA VAL 35 2.568 -8.548 1.219
233 HB VAL 35 HB VAL 35 4.208 -10.164 -0.766
234 HG11 VAL 35 1HG1 VAL 35 2.107 -11.054 1.218
235 HG12 VAL 35 2HG1 VAL 35 3.839 -11.356 1.340
236 HG13 VAL 35 3HG1 VAL 35 2.907 -12.089 0.035
237 HG21 VAL 35 3HG2 VAL 35 2.052 -10.711 -1.809
238 HG22 VAL 35 1HG2 VAL 35 2.397 -8.982 -1.872
239 HG23 VAL 35 2HG2 VAL 35 1.244 -9.609 -0.694
Start of MODEL 17
1 H1 CYS 1 1HT CYS 1 -10.806 -1.549 -2.543
2 H2 CYS 1 2HT CYS 1 -10.386 -2.467 -3.908
3 H3 CYS 1 3HT CYS 1 -9.909 -0.861 -3.808
4 HA CYS 1 HA CYS 1 -8.443 -1.356 -2.018
5 HB2 CYS 1 2HB CYS 1 -8.076 -3.711 -1.399
6 HB3 CYS 1 1HB CYS 1 -9.741 -3.245 -1.075
7 H VAL 2 H VAL 2 -6.253 -2.042 -2.606
8 HA VAL 2 HA VAL 2 -6.122 -2.533 -5.487
9 HB VAL 2 HB VAL 2 -3.992 -1.359 -5.548
10 HG11 VAL 2 1HG1 VAL 2 -6.067 0.243 -4.076
11 HG12 VAL 2 2HG1 VAL 2 -6.001 -0.032 -5.813
12 HG13 VAL 2 3HG1 VAL 2 -4.731 0.905 -5.019
13 HG21 VAL 2 3HG2 VAL 2 -3.073 -0.224 -3.632
14 HG22 VAL 2 1HG2 VAL 2 -3.174 -1.955 -3.325
15 HG23 VAL 2 2HG2 VAL 2 -4.360 -0.863 -2.601
16 H LEU 3 H LEU 3 -4.070 -3.608 -6.192
17 HA LEU 3 HA LEU 3 -3.715 -5.932 -4.435
18 HB2 LEU 3 2HB LEU 3 -3.010 -5.792 -7.370
19 HB3 LEU 3 1HB LEU 3 -3.158 -7.188 -6.309
20 HG LEU 3 HG LEU 3 -5.490 -5.491 -7.181
21 HD11 LEU 3 1HD1 LEU 3 -6.059 -7.356 -8.651
22 HD12 LEU 3 2HD1 LEU 3 -4.561 -8.167 -8.203
23 HD13 LEU 3 3HD1 LEU 3 -4.508 -6.639 -9.082
24 HD21 LEU 3 3HD2 LEU 3 -6.828 -7.356 -6.324
25 HD22 LEU 3 1HD2 LEU 3 -5.844 -6.634 -5.053
26 HD23 LEU 3 2HD2 LEU 3 -5.358 -8.166 -5.785
27 H ILE 4 H ILE 4 -1.399 -7.020 -5.115
28 HA ILE 4 HA ILE 4 0.484 -5.285 -3.947
29 HB ILE 4 HB ILE 4 2.206 -6.990 -4.481
30 HG12 ILE 4 2HG1 ILE 4 -0.090 -8.508 -5.751
31 HG13 ILE 4 1HG1 ILE 4 1.264 -7.796 -6.622
32 HG21 ILE 4 1HG2 ILE 4 -0.328 -8.011 -3.222
33 HG22 ILE 4 2HG2 ILE 4 0.977 -7.134 -2.419
34 HG23 ILE 4 3HG2 ILE 4 1.262 -8.754 -3.060
35 HD11 ILE 4 3HD1 ILE 4 1.418 -10.021 -4.601
36 HD12 ILE 4 1HD1 ILE 4 2.789 -9.289 -5.430
37 HD13 ILE 4 2HD1 ILE 4 1.581 -10.178 -6.351
38 H GLY 5 H GLY 5 2.054 -4.038 -4.673
39 HA2 GLY 5 2HA GLY 5 3.546 -3.099 -6.163
40 HA3 GLY 5 1HA GLY 5 2.819 -3.978 -7.490
41 H GLN 6 H GLN 6 0.213 -2.881 -6.093
42 HA GLN 6 HA GLN 6 0.094 -0.484 -7.720
43 HB2 GLN 6 2HB GLN 6 -2.013 -2.006 -6.200
44 HB3 GLN 6 1HB GLN 6 -2.320 -0.586 -7.189
45 HG2 GLN 6 2HG GLN 6 -1.587 -1.765 -9.170
46 HG3 GLN 6 1HG GLN 6 -1.184 -3.179 -8.197
47 HE21 GLN 6 1HE2 GLN 6 -2.589 -4.476 -9.335
48 HE22 GLN 6 2HE2 GLN 6 -4.304 -4.346 -9.190
49 H ARG 7 H ARG 7 -0.792 1.420 -6.802
50 HA ARG 7 HA ARG 7 0.519 1.951 -4.291
51 HB2 ARG 7 2HB ARG 7 -0.745 3.749 -6.337
52 HB3 ARG 7 1HB ARG 7 0.028 4.310 -4.860
53 HG2 ARG 7 2HG ARG 7 2.118 3.527 -5.532
54 HG3 ARG 7 1HG ARG 7 1.431 2.618 -6.885
55 HD2 ARG 7 2HD ARG 7 1.406 5.621 -6.590
56 HD3 ARG 7 1HD ARG 7 2.497 4.713 -7.643
57 HE ARG 7 HE ARG 7 0.039 3.881 -8.380
58 HH11 ARG 7 1HH1 ARG 7 1.524 7.082 -8.149
59 HH12 ARG 7 2HH1 ARG 7 0.580 7.772 -9.387
60 HH21 ARG 7 1HH2 ARG 7 -1.255 4.812 -10.078
61 HH22 ARG 7 2HH2 ARG 7 -1.074 6.463 -10.470
62 H CYS 8 H CYS 8 -0.391 2.779 -2.576
63 HA CYS 8 HA CYS 8 -3.284 3.005 -2.384
64 HB2 CYS 8 2HB CYS 8 -3.275 1.576 -0.405
65 HB3 CYS 8 1HB CYS 8 -2.840 0.665 -1.848
66 H ASP 9 H ASP 9 -3.691 3.687 0.057
67 HA ASP 9 HA ASP 9 -1.479 5.438 0.888
68 HB2 ASP 9 2HB ASP 9 -3.346 6.659 -0.350
69 HB3 ASP 9 1HB ASP 9 -4.389 6.209 0.997
70 H ASN 10 H ASN 10 -0.972 5.094 2.943
71 HA ASN 10 HA ASN 10 -2.365 3.158 4.515
72 HB2 ASN 10 2HB ASN 10 -0.016 4.941 5.117
73 HB3 ASN 10 1HB ASN 10 -0.757 3.966 6.371
74 HD21 ASN 10 1HD2 ASN 10 1.185 3.951 3.502
75 HD22 ASN 10 2HD2 ASN 10 1.702 2.310 3.628
76 H ASP 11 H ASP 11 -2.555 6.595 4.342
77 HA ASP 11 HA ASP 11 -3.783 6.757 6.980
78 HB2 ASP 11 2HB ASP 11 -2.127 8.483 6.396
79 HB3 ASP 11 1HB ASP 11 -3.118 8.966 5.026
80 H ARG 12 H ARG 12 -4.553 7.724 3.660
81 HA ARG 12 HA ARG 12 -7.323 8.202 4.511
82 HB2 ARG 12 2HB ARG 12 -5.997 8.867 1.894
83 HB3 ARG 12 1HB ARG 12 -7.610 9.342 2.386
84 HG2 ARG 12 2HG ARG 12 -6.648 10.701 4.186
85 HG3 ARG 12 1HG ARG 12 -5.032 10.221 3.663
86 HD2 ARG 12 2HD ARG 12 -5.476 11.183 1.453
87 HD3 ARG 12 1HD ARG 12 -7.061 11.711 2.011
88 HE ARG 12 HE ARG 12 -5.309 12.778 3.780
89 HH11 ARG 12 1HH1 ARG 12 -5.769 12.963 0.274
90 HH12 ARG 12 2HH1 ARG 12 -5.061 14.500 0.099
91 HH21 ARG 12 1HH2 ARG 12 -4.275 14.918 3.541
92 HH22 ARG 12 2HH2 ARG 12 -4.173 15.623 2.001
93 H GLY 13 H GLY 13 -5.505 5.866 2.810
94 HA2 GLY 13 2HA GLY 13 -6.316 3.874 1.908
95 HA3 GLY 13 1HA GLY 13 -7.950 4.531 1.982
96 HA PRO 14 HA PRO 14 -8.239 2.753 0.333
97 HB2 PRO 14 2HB PRO 14 -7.725 1.274 -1.854
98 HB3 PRO 14 1HB PRO 14 -9.007 2.498 -1.859
99 HG2 PRO 14 2HG PRO 14 -6.204 2.673 -2.904
100 HG3 PRO 14 1HG PRO 14 -7.713 3.186 -3.681
101 HD2 PRO 14 2HD PRO 14 -6.073 4.920 -2.410
102 HD3 PRO 14 1HD PRO 14 -7.835 5.129 -2.447
103 H ARG 15 H ARG 15 -7.366 0.459 0.466
104 HA ARG 15 HA ARG 15 -4.454 0.417 0.552
105 HB2 ARG 15 2HB ARG 15 -6.317 -0.682 2.656
106 HB3 ARG 15 1HB ARG 15 -4.602 -1.045 2.584
107 HG2 ARG 15 2HG ARG 15 -4.127 1.367 2.890
108 HG3 ARG 15 1HG ARG 15 -5.862 1.655 3.045
109 HD2 ARG 15 2HD ARG 15 -4.173 -0.095 4.835
110 HD3 ARG 15 1HD ARG 15 -4.823 1.491 5.244
111 HE ARG 15 HE ARG 15 -7.025 0.177 4.604
112 HH11 ARG 15 1HH1 ARG 15 -4.374 -0.776 6.753
113 HH12 ARG 15 2HH1 ARG 15 -5.338 -1.768 7.742
114 HH21 ARG 15 1HH2 ARG 15 -8.345 -1.208 5.943
115 HH22 ARG 15 2HH2 ARG 15 -7.648 -1.997 7.286
116 H CYS 16 H CYS 16 -3.967 -2.106 1.167
117 HA CYS 16 HA CYS 16 -4.314 -3.504 -1.220
118 HB2 CYS 16 2HB CYS 16 -3.614 -4.608 1.484
119 HB3 CYS 16 1HB CYS 16 -3.130 -5.219 -0.096
120 H CYS 17 H CYS 17 -5.653 -5.188 -1.769
121 HA CYS 17 HA CYS 17 -8.075 -5.716 -0.366
122 HB2 CYS 17 2HB CYS 17 -6.578 -7.467 -2.353
123 HB3 CYS 17 1HB CYS 17 -8.280 -7.618 -1.924
124 H SER 18 H SER 18 -8.570 -7.595 0.965
125 HA SER 18 HA SER 18 -6.576 -8.269 2.812
126 HB2 SER 18 2HB SER 18 -9.034 -8.250 3.293
127 HB3 SER 18 1HB SER 18 -9.205 -9.689 2.293
128 HG SER 18 HG SER 18 -7.967 -9.354 4.777
129 H GLY 19 H GLY 19 -4.829 -9.284 2.117
130 HA2 GLY 19 2HA GLY 19 -3.971 -11.601 1.881
131 HA3 GLY 19 1HA GLY 19 -5.156 -11.792 0.590
132 H GLN 20 H GLN 20 -4.116 -8.701 0.400
133 HA GLN 20 HA GLN 20 -2.083 -9.391 -1.578
134 HB2 GLN 20 2HB GLN 20 -4.077 -7.166 -1.462
135 HB3 GLN 20 1HB GLN 20 -2.638 -7.049 -2.466
136 HG2 GLN 20 2HG GLN 20 -4.711 -9.215 -2.635
137 HG3 GLN 20 1HG GLN 20 -4.576 -7.831 -3.722
138 HE21 GLN 20 1HE2 GLN 20 -3.225 -10.892 -2.815
139 HE22 GLN 20 2HE2 GLN 20 -2.128 -11.011 -4.138
140 H GLY 21 H GLY 21 -1.363 -9.237 1.078
141 HA2 GLY 21 2HA GLY 21 0.510 -8.406 2.162
142 HA3 GLY 21 1HA GLY 21 0.732 -7.347 0.795
143 H ASN 22 H ASN 22 1.321 -5.861 2.337
144 HA ASN 22 HA ASN 22 -0.961 -4.364 3.374
145 HB2 ASN 22 2HB ASN 22 1.384 -5.381 4.854
146 HB3 ASN 22 1HB ASN 22 0.939 -3.709 5.165
147 HD21 ASN 22 1HD2 ASN 22 -0.955 -3.274 6.147
148 HD22 ASN 22 2HD2 ASN 22 -1.922 -4.441 6.959
149 H CYS 23 H CYS 23 -0.713 -2.189 3.304
150 HA CYS 23 HA CYS 23 0.910 -1.122 1.316
151 HB2 CYS 23 2HB CYS 23 -0.675 0.166 3.524
152 HB3 CYS 23 1HB CYS 23 0.200 1.089 2.312
153 H VAL 24 H VAL 24 2.980 -0.988 1.428
154 HA VAL 24 HA VAL 24 4.209 -0.176 3.925
155 HB VAL 24 HB VAL 24 5.280 -2.107 2.808
156 HG11 VAL 24 1HG1 VAL 24 6.442 -1.911 0.673
157 HG12 VAL 24 2HG1 VAL 24 5.754 -0.298 0.464
158 HG13 VAL 24 3HG1 VAL 24 4.696 -1.708 0.522
159 HG21 VAL 24 3HG2 VAL 24 6.706 -0.661 4.097
160 HG22 VAL 24 1HG2 VAL 24 6.999 0.358 2.687
161 HG23 VAL 24 2HG2 VAL 24 7.589 -1.307 2.713
162 HA PRO 25 HA PRO 25 3.972 3.822 2.179
163 HB2 PRO 25 2HB PRO 25 5.083 5.239 4.187
164 HB3 PRO 25 1HB PRO 25 3.475 4.517 4.322
165 HG2 PRO 25 2HG PRO 25 6.079 3.558 5.424
166 HG3 PRO 25 1HG PRO 25 4.468 3.519 6.161
167 HD2 PRO 25 2HD PRO 25 5.681 1.364 4.925
168 HD3 PRO 25 1HD PRO 25 3.930 1.548 5.147
169 H LEU 26 H LEU 26 5.216 5.207 1.095
170 HA LEU 26 HA LEU 26 8.130 4.982 1.236
171 HB2 LEU 26 2HB LEU 26 6.373 4.943 -1.194
172 HB3 LEU 26 1HB LEU 26 8.034 5.490 -1.308
173 HG LEU 26 HG LEU 26 7.991 3.299 -2.111
174 HD11 LEU 26 1HD1 LEU 26 9.383 2.022 -0.621
175 HD12 LEU 26 2HD1 LEU 26 8.988 3.119 0.697
176 HD13 LEU 26 3HD1 LEU 26 9.873 3.714 -0.711
177 HD21 LEU 26 3HD2 LEU 26 6.483 2.451 0.348
178 HD22 LEU 26 1HD2 LEU 26 7.069 1.376 -0.921
179 HD23 LEU 26 2HD2 LEU 26 5.831 2.584 -1.284
180 HA PRO 27 HA PRO 27 8.371 9.314 1.918
181 HB2 PRO 27 2HB PRO 27 10.087 9.292 -0.544
182 HB3 PRO 27 1HB PRO 27 10.354 10.131 0.990
183 HG2 PRO 27 2HG PRO 27 11.610 7.876 0.537
184 HG3 PRO 27 1HG PRO 27 10.872 8.159 2.123
185 HD2 PRO 27 2HD PRO 27 9.955 6.386 -0.093
186 HD3 PRO 27 1HD PRO 27 9.798 6.167 1.655
187 H PHE 28 H PHE 28 8.525 9.118 -1.642
188 HA PHE 28 HA PHE 28 6.461 11.192 -1.652
189 HB2 PHE 28 2HB PHE 28 7.283 11.725 -3.975
190 HB3 PHE 28 1HB PHE 28 8.397 12.076 -2.661
191 HD1 PHE 28 1HD PHE 28 7.708 9.860 -5.522
192 HD2 PHE 28 2HD PHE 28 10.494 10.938 -2.496
193 HE1 PHE 28 1HE PHE 28 9.459 8.584 -6.681
194 HE2 PHE 28 2HE PHE 28 12.246 9.658 -3.651
195 HZ PHE 28 HZ PHE 28 11.734 8.485 -5.738
196 H LEU 29 H LEU 29 7.184 8.060 -2.724
197 HA LEU 29 HA LEU 29 5.208 7.810 -4.722
198 HB2 LEU 29 2HB LEU 29 7.109 6.281 -4.505
199 HB3 LEU 29 1HB LEU 29 6.534 5.723 -2.965
200 HG LEU 29 HG LEU 29 6.291 4.103 -4.853
201 HD11 LEU 29 1HD1 LEU 29 3.695 4.879 -3.572
202 HD12 LEU 29 2HD1 LEU 29 4.914 3.788 -2.913
203 HD13 LEU 29 3HD1 LEU 29 4.040 3.349 -4.380
204 HD21 LEU 29 3HD2 LEU 29 4.223 6.041 -5.849
205 HD22 LEU 29 1HD2 LEU 29 4.519 4.424 -6.489
206 HD23 LEU 29 2HD2 LEU 29 5.769 5.665 -6.611
207 H GLY 30 H GLY 30 5.127 7.554 -1.232
208 HA2 GLY 30 2HA GLY 30 3.152 8.075 -0.062
209 HA3 GLY 30 1HA GLY 30 2.213 7.458 -1.421
210 H GLY 31 H GLY 31 2.016 5.225 -1.699
211 HA2 GLY 31 2HA GLY 31 3.216 3.474 0.228
212 HA3 GLY 31 1HA GLY 31 1.481 3.700 0.441
213 H VAL 32 H VAL 32 3.050 1.364 -0.349
214 HA VAL 32 HA VAL 32 1.428 0.737 -2.700
215 HB VAL 32 HB VAL 32 3.637 1.360 -3.514
216 HG11 VAL 32 1HG1 VAL 32 4.649 -1.043 -2.019
217 HG12 VAL 32 2HG1 VAL 32 5.045 0.640 -1.659
218 HG13 VAL 32 3HG1 VAL 32 5.588 -0.103 -3.174
219 HG21 VAL 32 3HG2 VAL 32 4.091 -0.598 -4.940
220 HG22 VAL 32 1HG2 VAL 32 2.381 -0.175 -4.843
221 HG23 VAL 32 2HG2 VAL 32 3.004 -1.542 -3.921
222 H CYS 33 H CYS 33 0.934 -1.334 -2.910
223 HA CYS 33 HA CYS 33 0.905 -2.846 -0.436
224 HB2 CYS 33 2HB CYS 33 -0.409 -3.329 -3.088
225 HB3 CYS 33 1HB CYS 33 -0.493 -4.487 -1.759
226 H ALA 34 H ALA 34 2.008 -4.616 0.085
227 HA ALA 34 HA ALA 34 3.400 -6.122 -1.903
228 HB1 ALA 34 1HB ALA 34 4.923 -4.568 0.195
229 HB2 ALA 34 2HB ALA 34 4.946 -4.243 -1.535
230 HB3 ALA 34 3HB ALA 34 5.610 -5.755 -0.915
231 H VAL 35 H VAL 35 3.753 -8.141 -1.132
232 HA VAL 35 HA VAL 35 2.656 -8.714 1.446
233 HB VAL 35 HB VAL 35 3.145 -11.126 0.964
234 HG11 VAL 35 1HG1 VAL 35 0.999 -10.218 0.354
235 HG12 VAL 35 2HG1 VAL 35 1.517 -11.386 -0.865
236 HG13 VAL 35 3HG1 VAL 35 1.644 -9.657 -1.186
237 HG21 VAL 35 3HG2 VAL 35 5.110 -10.846 -0.485
238 HG22 VAL 35 1HG2 VAL 35 4.089 -10.129 -1.729
239 HG23 VAL 35 2HG2 VAL 35 3.866 -11.818 -1.273
Start of MODEL 18
1 H1 CYS 1 1HT CYS 1 -10.887 -3.438 -4.014
2 H2 CYS 1 2HT CYS 1 -10.750 -1.769 -4.051
3 H3 CYS 1 3HT CYS 1 -11.489 -2.540 -2.717
4 HA CYS 1 HA CYS 1 -9.235 -1.800 -2.243
5 HB2 CYS 1 2HB CYS 1 -8.403 -4.002 -1.457
6 HB3 CYS 1 1HB CYS 1 -10.095 -3.746 -1.062
7 H VAL 2 H VAL 2 -7.031 -1.907 -2.737
8 HA VAL 2 HA VAL 2 -6.572 -2.559 -5.536
9 HB VAL 2 HB VAL 2 -4.487 -1.187 -5.360
10 HG11 VAL 2 1HG1 VAL 2 -5.601 0.995 -5.255
11 HG12 VAL 2 2HG1 VAL 2 -7.021 0.223 -4.548
12 HG13 VAL 2 3HG1 VAL 2 -6.527 -0.178 -6.193
13 HG21 VAL 2 3HG2 VAL 2 -4.174 0.276 -3.411
14 HG22 VAL 2 1HG2 VAL 2 -4.064 -1.427 -2.965
15 HG23 VAL 2 2HG2 VAL 2 -5.529 -0.514 -2.605
16 H LEU 3 H LEU 3 -4.242 -3.223 -6.026
17 HA LEU 3 HA LEU 3 -3.759 -5.527 -4.263
18 HB2 LEU 3 2HB LEU 3 -3.101 -5.412 -7.203
19 HB3 LEU 3 1HB LEU 3 -3.055 -6.766 -6.094
20 HG LEU 3 HG LEU 3 -5.605 -5.409 -6.976
21 HD11 LEU 3 1HD1 LEU 3 -5.954 -7.374 -8.385
22 HD12 LEU 3 2HD1 LEU 3 -4.351 -7.967 -7.952
23 HD13 LEU 3 3HD1 LEU 3 -4.520 -6.470 -8.869
24 HD21 LEU 3 3HD2 LEU 3 -6.675 -7.424 -6.067
25 HD22 LEU 3 1HD2 LEU 3 -5.794 -6.535 -4.825
26 HD23 LEU 3 2HD2 LEU 3 -5.102 -8.002 -5.516
27 H ILE 4 H ILE 4 -1.441 -6.445 -4.966
28 HA ILE 4 HA ILE 4 0.478 -4.764 -3.947
29 HB ILE 4 HB ILE 4 2.193 -6.325 -5.070
30 HG12 ILE 4 2HG1 ILE 4 1.218 -8.589 -5.700
31 HG13 ILE 4 1HG1 ILE 4 -0.357 -7.825 -5.767
32 HG21 ILE 4 1HG2 ILE 4 1.596 -6.495 -2.768
33 HG22 ILE 4 2HG2 ILE 4 1.723 -8.113 -3.462
34 HG23 ILE 4 3HG2 ILE 4 0.138 -7.397 -3.175
35 HD11 ILE 4 3HD1 ILE 4 0.554 -8.113 -7.981
36 HD12 ILE 4 1HD1 ILE 4 2.009 -7.225 -7.530
37 HD13 ILE 4 2HD1 ILE 4 0.457 -6.394 -7.598
38 H GLY 5 H GLY 5 2.177 -3.570 -4.689
39 HA2 GLY 5 2HA GLY 5 3.396 -2.262 -6.145
40 HA3 GLY 5 1HA GLY 5 2.550 -2.977 -7.496
41 H GLN 6 H GLN 6 -0.002 -2.125 -5.901
42 HA GLN 6 HA GLN 6 -0.182 0.469 -7.158
43 HB2 GLN 6 2HB GLN 6 -2.106 -1.348 -5.778
44 HB3 GLN 6 1HB GLN 6 -2.536 0.304 -6.163
45 HG2 GLN 6 2HG GLN 6 -2.678 -0.070 -8.383
46 HG3 GLN 6 1HG GLN 6 -1.374 -1.255 -8.362
47 HE21 GLN 6 1HE2 GLN 6 -1.839 -3.348 -8.157
48 HE22 GLN 6 2HE2 GLN 6 -3.451 -3.970 -8.180
49 H ARG 7 H ARG 7 -1.043 2.238 -6.011
50 HA ARG 7 HA ARG 7 0.428 2.558 -3.536
51 HB2 ARG 7 2HB ARG 7 0.736 4.336 -5.188
52 HB3 ARG 7 1HB ARG 7 -0.993 4.661 -5.199
53 HG2 ARG 7 2HG ARG 7 -0.922 5.365 -2.885
54 HG3 ARG 7 1HG ARG 7 0.779 4.944 -2.780
55 HD2 ARG 7 2HD ARG 7 1.337 6.714 -4.341
56 HD3 ARG 7 1HD ARG 7 -0.379 7.089 -4.559
57 HE ARG 7 HE ARG 7 -0.038 7.240 -1.898
58 HH11 ARG 7 1HH1 ARG 7 1.664 8.873 -4.544
59 HH12 ARG 7 2HH1 ARG 7 1.987 10.275 -3.649
60 HH21 ARG 7 1HH2 ARG 7 0.372 9.167 -0.690
61 HH22 ARG 7 2HH2 ARG 7 1.193 10.460 -1.409
62 H CYS 8 H CYS 8 -0.389 2.594 -1.685
63 HA CYS 8 HA CYS 8 -3.303 2.478 -1.363
64 HB2 CYS 8 2HB CYS 8 -2.666 1.033 0.587
65 HB3 CYS 8 1HB CYS 8 -2.378 0.341 -1.010
66 H ASP 9 H ASP 9 -4.006 3.164 0.736
67 HA ASP 9 HA ASP 9 -2.153 4.626 2.421
68 HB2 ASP 9 2HB ASP 9 -3.107 6.332 0.833
69 HB3 ASP 9 1HB ASP 9 -4.707 5.925 1.457
70 H ASN 10 H ASN 10 -2.599 4.201 4.458
71 HA ASN 10 HA ASN 10 -4.717 2.340 4.962
72 HB2 ASN 10 2HB ASN 10 -2.581 3.451 6.784
73 HB3 ASN 10 1HB ASN 10 -3.796 2.299 7.314
74 HD21 ASN 10 1HD2 ASN 10 -2.241 0.744 7.798
75 HD22 ASN 10 2HD2 ASN 10 -1.388 -0.118 6.576
76 H ASP 11 H ASP 11 -4.359 5.689 5.310
77 HA ASP 11 HA ASP 11 -6.309 5.871 7.473
78 HB2 ASP 11 2HB ASP 11 -4.834 8.032 5.969
79 HB3 ASP 11 1HB ASP 11 -5.952 8.309 7.291
80 H ARG 12 H ARG 12 -5.889 7.070 4.202
81 HA ARG 12 HA ARG 12 -8.676 7.944 4.102
82 HB2 ARG 12 2HB ARG 12 -6.317 8.499 2.333
83 HB3 ARG 12 1HB ARG 12 -7.914 9.211 2.156
84 HG2 ARG 12 2HG ARG 12 -7.674 10.523 4.051
85 HG3 ARG 12 1HG ARG 12 -6.404 9.493 4.714
86 HD2 ARG 12 2HD ARG 12 -6.115 11.169 2.232
87 HD3 ARG 12 1HD ARG 12 -5.588 11.670 3.841
88 HE ARG 12 HE ARG 12 -4.507 9.138 3.184
89 HH11 ARG 12 1HH1 ARG 12 -4.070 12.568 2.385
90 HH12 ARG 12 2HH1 ARG 12 -2.400 12.416 2.097
91 HH21 ARG 12 1HH2 ARG 12 -2.237 8.953 2.744
92 HH22 ARG 12 2HH2 ARG 12 -1.329 10.318 2.273
93 H GLY 13 H GLY 13 -6.475 5.650 2.721
94 HA2 GLY 13 2HA GLY 13 -7.233 3.774 1.487
95 HA3 GLY 13 1HA GLY 13 -8.613 4.733 0.949
96 HA PRO 14 HA PRO 14 -8.320 3.017 -0.684
97 HB2 PRO 14 2HB PRO 14 -7.301 1.565 -2.693
98 HB3 PRO 14 1HB PRO 14 -8.309 2.984 -3.003
99 HG2 PRO 14 2HG PRO 14 -5.334 2.714 -3.108
100 HG3 PRO 14 1HG PRO 14 -6.416 3.590 -4.204
101 HD2 PRO 14 2HD PRO 14 -4.966 4.770 -2.183
102 HD3 PRO 14 1HD PRO 14 -6.459 5.444 -2.863
103 H ARG 15 H ARG 15 -8.066 0.881 -0.018
104 HA ARG 15 HA ARG 15 -5.450 0.278 1.147
105 HB2 ARG 15 2HB ARG 15 -8.244 -0.569 1.941
106 HB3 ARG 15 1HB ARG 15 -6.776 -1.156 2.713
107 HG2 ARG 15 2HG ARG 15 -6.232 1.052 3.488
108 HG3 ARG 15 1HG ARG 15 -7.566 1.747 2.583
109 HD2 ARG 15 2HD ARG 15 -9.153 0.504 3.970
110 HD3 ARG 15 1HD ARG 15 -7.817 -0.201 4.878
111 HE ARG 15 HE ARG 15 -7.236 2.177 5.443
112 HH11 ARG 15 1HH1 ARG 15 -10.579 1.139 4.933
113 HH12 ARG 15 2HH1 ARG 15 -11.266 2.392 5.845
114 HH21 ARG 15 1HH2 ARG 15 -8.167 3.911 6.678
115 HH22 ARG 15 2HH2 ARG 15 -9.860 4.051 6.842
116 H CYS 16 H CYS 16 -4.603 -1.753 0.871
117 HA CYS 16 HA CYS 16 -5.347 -3.121 -1.543
118 HB2 CYS 16 2HB CYS 16 -3.298 -3.801 0.556
119 HB3 CYS 16 1HB CYS 16 -3.456 -4.551 -1.030
120 H CYS 17 H CYS 17 -5.911 -5.200 -1.774
121 HA CYS 17 HA CYS 17 -8.163 -5.930 -0.259
122 HB2 CYS 17 2HB CYS 17 -6.443 -7.597 -2.118
123 HB3 CYS 17 1HB CYS 17 -8.098 -7.994 -1.612
124 H SER 18 H SER 18 -8.456 -7.449 1.415
125 HA SER 18 HA SER 18 -6.206 -7.885 3.073
126 HB2 SER 18 2HB SER 18 -8.589 -7.594 3.878
127 HB3 SER 18 1HB SER 18 -8.929 -9.214 3.272
128 HG SER 18 HG SER 18 -8.181 -9.914 5.088
129 H GLY 19 H GLY 19 -4.701 -9.101 2.269
130 HA2 GLY 19 2HA GLY 19 -4.222 -11.631 2.161
131 HA3 GLY 19 1HA GLY 19 -5.317 -11.540 0.774
132 H GLN 20 H GLN 20 -4.359 -8.717 0.431
133 HA GLN 20 HA GLN 20 -2.192 -9.292 -1.333
134 HB2 GLN 20 2HB GLN 20 -3.936 -6.871 -0.897
135 HB3 GLN 20 1HB GLN 20 -2.481 -6.669 -1.792
136 HG2 GLN 20 2HG GLN 20 -4.659 -8.614 -2.407
137 HG3 GLN 20 1HG GLN 20 -4.344 -7.096 -3.250
138 HE21 GLN 20 1HE2 GLN 20 -3.406 -10.374 -2.821
139 HE22 GLN 20 2HE2 GLN 20 -2.222 -10.403 -4.077
140 H GLY 21 H GLY 21 -0.544 -7.263 -1.370
141 HA2 GLY 21 2HA GLY 21 1.248 -7.816 0.735
142 HA3 GLY 21 1HA GLY 21 1.401 -6.539 -0.445
143 H ASN 22 H ASN 22 2.337 -6.124 1.970
144 HA ASN 22 HA ASN 22 0.391 -4.707 3.591
145 HB2 ASN 22 2HB ASN 22 2.138 -5.982 4.770
146 HB3 ASN 22 1HB ASN 22 3.373 -5.118 3.875
147 HD21 ASN 22 1HD2 ASN 22 4.047 -3.168 4.585
148 HD22 ASN 22 2HD2 ASN 22 3.465 -2.401 6.019
149 H CYS 23 H CYS 23 0.307 -2.514 3.749
150 HA CYS 23 HA CYS 23 1.233 -1.073 1.463
151 HB2 CYS 23 2HB CYS 23 -0.996 -0.748 2.643
152 HB3 CYS 23 1HB CYS 23 -0.091 -0.011 3.956
153 H VAL 24 H VAL 24 3.390 -0.727 1.451
154 HA VAL 24 HA VAL 24 4.651 0.143 3.925
155 HB VAL 24 HB VAL 24 6.028 -0.382 1.337
156 HG11 VAL 24 1HG1 VAL 24 6.979 -0.496 4.177
157 HG12 VAL 24 2HG1 VAL 24 7.318 0.782 3.006
158 HG13 VAL 24 3HG1 VAL 24 7.977 -0.842 2.765
159 HG21 VAL 24 3HG2 VAL 24 6.517 -2.691 2.083
160 HG22 VAL 24 1HG2 VAL 24 4.793 -2.424 1.822
161 HG23 VAL 24 2HG2 VAL 24 5.444 -2.443 3.461
162 HA PRO 25 HA PRO 25 4.233 4.158 1.951
163 HB2 PRO 25 2HB PRO 25 5.429 5.249 4.358
164 HB3 PRO 25 1HB PRO 25 3.778 5.450 3.773
165 HG2 PRO 25 2HG PRO 25 4.436 4.005 6.001
166 HG3 PRO 25 1HG PRO 25 2.996 3.699 5.017
167 HD2 PRO 25 2HD PRO 25 5.604 2.205 5.042
168 HD3 PRO 25 1HD PRO 25 3.940 1.621 4.829
169 H LEU 26 H LEU 26 5.713 4.755 0.510
170 HA LEU 26 HA LEU 26 8.494 4.804 1.350
171 HB2 LEU 26 2HB LEU 26 7.325 4.257 -1.374
172 HB3 LEU 26 1HB LEU 26 9.033 4.497 -1.069
173 HG LEU 26 HG LEU 26 7.382 2.314 0.147
174 HD11 LEU 26 1HD1 LEU 26 9.330 2.223 -2.174
175 HD12 LEU 26 2HD1 LEU 26 7.583 2.006 -2.285
176 HD13 LEU 26 3HD1 LEU 26 8.568 0.817 -1.433
177 HD21 LEU 26 3HD2 LEU 26 10.350 2.815 0.115
178 HD22 LEU 26 1HD2 LEU 26 9.584 1.338 0.703
179 HD23 LEU 26 2HD2 LEU 26 9.273 2.872 1.510
180 HA PRO 27 HA PRO 27 7.910 9.153 0.792
181 HB2 PRO 27 2HB PRO 27 10.447 9.883 1.380
182 HB3 PRO 27 1HB PRO 27 9.313 9.329 2.622
183 HG2 PRO 27 2HG PRO 27 11.500 7.833 1.229
184 HG3 PRO 27 1HG PRO 27 11.062 7.820 2.946
185 HD2 PRO 27 2HD PRO 27 10.325 5.869 1.190
186 HD3 PRO 27 1HD PRO 27 9.352 6.284 2.605
187 H PHE 28 H PHE 28 8.201 7.750 -1.576
188 HA PHE 28 HA PHE 28 9.850 9.585 -3.178
189 HB2 PHE 28 2HB PHE 28 9.694 6.608 -3.736
190 HB3 PHE 28 1HB PHE 28 10.638 7.797 -4.617
191 HD1 PHE 28 2HD PHE 28 12.489 9.015 -3.282
192 HD2 PHE 28 1HD PHE 28 10.632 5.402 -2.030
193 HE1 PHE 28 2HE PHE 28 14.396 8.547 -1.801
194 HE2 PHE 28 1HE PHE 28 12.527 4.931 -0.545
195 HZ PHE 28 HZ PHE 28 14.409 6.500 -0.432
196 H LEU 29 H LEU 29 7.766 6.767 -3.701
197 HA LEU 29 HA LEU 29 6.194 8.347 -5.598
198 HB2 LEU 29 2HB LEU 29 5.575 6.331 -6.717
199 HB3 LEU 29 1HB LEU 29 7.308 6.343 -6.531
200 HG LEU 29 HG LEU 29 5.403 4.694 -4.843
201 HD11 LEU 29 1HD1 LEU 29 7.127 3.895 -7.169
202 HD12 LEU 29 2HD1 LEU 29 5.366 3.956 -7.136
203 HD13 LEU 29 3HD1 LEU 29 6.228 2.787 -6.134
204 HD21 LEU 29 3HD2 LEU 29 7.468 3.434 -4.216
205 HD22 LEU 29 1HD2 LEU 29 7.481 5.098 -3.631
206 HD23 LEU 29 2HD2 LEU 29 8.421 4.660 -5.047
207 H GLY 30 H GLY 30 6.023 7.263 -2.472
208 HA2 GLY 30 2HA GLY 30 4.007 7.725 -1.254
209 HA3 GLY 30 1HA GLY 30 3.106 7.064 -2.615
210 H GLY 31 H GLY 31 2.278 5.797 -0.646
211 HA2 GLY 31 2HA GLY 31 4.052 3.611 0.044
212 HA3 GLY 31 1HA GLY 31 2.472 3.909 0.763
213 H VAL 32 H VAL 32 3.895 1.670 -0.638
214 HA VAL 32 HA VAL 32 1.666 0.959 -2.403
215 HB VAL 32 HB VAL 32 3.234 -0.262 -3.924
216 HG11 VAL 32 1HG1 VAL 32 4.061 1.676 -5.157
217 HG12 VAL 32 2HG1 VAL 32 3.706 2.710 -3.768
218 HG13 VAL 32 3HG1 VAL 32 2.397 1.882 -4.620
219 HG21 VAL 32 3HG2 VAL 32 5.621 0.308 -3.926
220 HG22 VAL 32 1HG2 VAL 32 5.142 -0.510 -2.439
221 HG23 VAL 32 2HG2 VAL 32 5.397 1.237 -2.440
222 H CYS 33 H CYS 33 1.140 -1.178 -2.435
223 HA CYS 33 HA CYS 33 1.953 -2.583 -0.067
224 HB2 CYS 33 2HB CYS 33 -0.090 -3.242 -2.158
225 HB3 CYS 33 1HB CYS 33 0.310 -4.330 -0.832
226 H ALA 34 H ALA 34 3.469 -3.898 0.112
227 HA ALA 34 HA ALA 34 4.416 -5.389 -2.216
228 HB1 ALA 34 1HB ALA 34 6.077 -3.724 -1.543
229 HB2 ALA 34 2HB ALA 34 6.655 -5.339 -1.128
230 HB3 ALA 34 3HB ALA 34 5.992 -4.290 0.123
231 H VAL 35 H VAL 35 4.673 -7.567 -1.840
232 HA VAL 35 HA VAL 35 3.670 -8.420 0.742
233 HB VAL 35 HB VAL 35 2.154 -9.083 -1.020
234 HG11 VAL 35 1HG1 VAL 35 2.760 -10.625 -2.813
235 HG12 VAL 35 2HG1 VAL 35 4.448 -10.512 -2.313
236 HG13 VAL 35 3HG1 VAL 35 3.616 -9.086 -2.926
237 HG21 VAL 35 3HG2 VAL 35 2.071 -11.513 -0.686
238 HG22 VAL 35 1HG2 VAL 35 2.353 -10.634 0.817
239 HG23 VAL 35 2HG2 VAL 35 3.689 -11.456 0.010
Start of MODEL 19
1 H1 CYS 1 1HT CYS 1 -10.942 -1.586 -2.931
2 H2 CYS 1 2HT CYS 1 -10.349 -2.412 -4.298
3 H3 CYS 1 3HT CYS 1 -10.076 -0.767 -4.119
4 HA CYS 1 HA CYS 1 -8.663 -1.076 -2.308
5 HB2 CYS 1 2HB CYS 1 -8.071 -3.380 -1.600
6 HB3 CYS 1 1HB CYS 1 -9.762 -3.018 -1.297
7 H VAL 2 H VAL 2 -6.389 -1.743 -2.613
8 HA VAL 2 HA VAL 2 -5.895 -2.155 -5.451
9 HB VAL 2 HB VAL 2 -3.690 -1.015 -5.096
10 HG11 VAL 2 1HG1 VAL 2 -4.621 1.255 -5.048
11 HG12 VAL 2 2HG1 VAL 2 -6.160 0.597 -4.491
12 HG13 VAL 2 3HG1 VAL 2 -5.546 0.175 -6.089
13 HG21 VAL 2 3HG2 VAL 2 -4.901 -0.271 -2.435
14 HG22 VAL 2 1HG2 VAL 2 -3.427 0.407 -3.125
15 HG23 VAL 2 2HG2 VAL 2 -3.490 -1.301 -2.685
16 H LEU 3 H LEU 3 -3.984 -3.235 -6.076
17 HA LEU 3 HA LEU 3 -3.663 -5.613 -4.403
18 HB2 LEU 3 2HB LEU 3 -2.942 -5.291 -7.317
19 HB3 LEU 3 1HB LEU 3 -3.030 -6.752 -6.345
20 HG LEU 3 HG LEU 3 -5.418 -5.085 -7.122
21 HD11 LEU 3 1HD1 LEU 3 -4.429 -6.119 -9.071
22 HD12 LEU 3 2HD1 LEU 3 -5.935 -6.937 -8.644
23 HD13 LEU 3 3HD1 LEU 3 -4.386 -7.678 -8.248
24 HD21 LEU 3 3HD2 LEU 3 -5.188 -7.789 -5.796
25 HD22 LEU 3 1HD2 LEU 3 -6.691 -7.048 -6.355
26 HD23 LEU 3 2HD2 LEU 3 -5.770 -6.298 -5.057
27 H ILE 4 H ILE 4 -1.385 -6.703 -5.183
28 HA ILE 4 HA ILE 4 0.583 -5.187 -3.871
29 HB ILE 4 HB ILE 4 2.220 -6.901 -4.680
30 HG12 ILE 4 2HG1 ILE 4 -0.213 -8.184 -5.953
31 HG13 ILE 4 1HG1 ILE 4 1.100 -7.424 -6.839
32 HG21 ILE 4 1HG2 ILE 4 1.076 -7.195 -2.576
33 HG22 ILE 4 2HG2 ILE 4 1.266 -8.754 -3.379
34 HG23 ILE 4 3HG2 ILE 4 -0.296 -7.938 -3.397
35 HD11 ILE 4 3HD1 ILE 4 1.321 -9.865 -5.085
36 HD12 ILE 4 1HD1 ILE 4 2.648 -9.112 -5.969
37 HD13 ILE 4 2HD1 ILE 4 1.308 -9.845 -6.850
38 H GLY 5 H GLY 5 2.038 -3.816 -4.464
39 HA2 GLY 5 2HA GLY 5 3.625 -2.823 -5.892
40 HA3 GLY 5 1HA GLY 5 2.778 -3.484 -7.282
41 H GLN 6 H GLN 6 0.226 -2.550 -5.948
42 HA GLN 6 HA GLN 6 0.168 0.018 -7.241
43 HB2 GLN 6 2HB GLN 6 -1.936 -1.598 -5.826
44 HB3 GLN 6 1HB GLN 6 -2.259 -0.061 -6.623
45 HG2 GLN 6 2HG GLN 6 -1.607 -1.010 -8.763
46 HG3 GLN 6 1HG GLN 6 -1.193 -2.529 -7.979
47 HE21 GLN 6 1HE2 GLN 6 -2.624 -3.670 -9.227
48 HE22 GLN 6 2HE2 GLN 6 -4.332 -3.568 -9.075
49 H ARG 7 H ARG 7 -0.695 1.864 -6.194
50 HA ARG 7 HA ARG 7 0.716 2.281 -3.701
51 HB2 ARG 7 2HB ARG 7 1.118 3.795 -5.591
52 HB3 ARG 7 1HB ARG 7 -0.580 4.196 -5.657
53 HG2 ARG 7 2HG ARG 7 1.066 4.806 -3.226
54 HG3 ARG 7 1HG ARG 7 1.063 5.876 -4.622
55 HD2 ARG 7 2HD ARG 7 -1.364 6.136 -4.405
56 HD3 ARG 7 1HD ARG 7 -1.359 5.048 -3.018
57 HE ARG 7 HE ARG 7 0.408 6.957 -2.331
58 HH11 ARG 7 1HH1 ARG 7 -2.981 7.041 -3.379
59 HH12 ARG 7 2HH1 ARG 7 -3.337 8.489 -2.559
60 HH21 ARG 7 1HH2 ARG 7 -0.138 8.970 -1.181
61 HH22 ARG 7 2HH2 ARG 7 -1.718 9.590 -1.342
62 H CYS 8 H CYS 8 -0.193 2.861 -1.810
63 HA CYS 8 HA CYS 8 -3.100 3.049 -1.682
64 HB2 CYS 8 2HB CYS 8 -2.993 1.532 0.290
65 HB3 CYS 8 1HB CYS 8 -2.606 0.747 -1.237
66 H ASP 9 H ASP 9 -3.766 3.767 0.518
67 HA ASP 9 HA ASP 9 -1.770 5.174 2.100
68 HB2 ASP 9 2HB ASP 9 -2.818 6.876 0.505
69 HB3 ASP 9 1HB ASP 9 -4.372 6.454 1.223
70 H ASN 10 H ASN 10 -2.101 4.589 4.085
71 HA ASN 10 HA ASN 10 -3.961 2.562 4.683
72 HB2 ASN 10 2HB ASN 10 -2.362 4.180 6.667
73 HB3 ASN 10 1HB ASN 10 -3.145 2.650 6.981
74 HD21 ASN 10 1HD2 ASN 10 -1.286 1.638 7.600
75 HD22 ASN 10 2HD2 ASN 10 0.003 1.250 6.522
76 H ASP 11 H ASP 11 -3.995 5.980 5.293
77 HA ASP 11 HA ASP 11 -6.270 5.634 7.057
78 HB2 ASP 11 2HB ASP 11 -4.648 8.099 6.471
79 HB3 ASP 11 1HB ASP 11 -6.084 8.077 7.489
80 H ARG 12 H ARG 12 -5.517 7.450 4.111
81 HA ARG 12 HA ARG 12 -8.302 8.283 3.953
82 HB2 ARG 12 2HB ARG 12 -5.940 8.848 2.196
83 HB3 ARG 12 1HB ARG 12 -7.548 9.500 1.931
84 HG2 ARG 12 2HG ARG 12 -7.443 10.767 3.934
85 HG3 ARG 12 1HG ARG 12 -5.963 9.943 4.440
86 HD2 ARG 12 2HD ARG 12 -6.247 11.676 1.991
87 HD3 ARG 12 1HD ARG 12 -5.510 12.178 3.514
88 HE ARG 12 HE ARG 12 -4.201 9.889 2.795
89 HH11 ARG 12 1HH1 ARG 12 -4.693 13.022 1.264
90 HH12 ARG 12 2HH1 ARG 12 -3.191 13.047 0.486
91 HH21 ARG 12 1HH2 ARG 12 -2.171 9.878 1.751
92 HH22 ARG 12 2HH2 ARG 12 -1.699 11.209 0.765
93 H GLY 13 H GLY 13 -6.214 5.944 2.516
94 HA2 GLY 13 2HA GLY 13 -7.076 4.088 1.335
95 HA3 GLY 13 1HA GLY 13 -8.434 5.088 0.819
96 HA PRO 14 HA PRO 14 -8.080 3.194 -0.752
97 HB2 PRO 14 2HB PRO 14 -6.921 1.619 -2.581
98 HB3 PRO 14 1HB PRO 14 -7.967 2.966 -3.044
99 HG2 PRO 14 2HG PRO 14 -4.981 2.824 -2.992
100 HG3 PRO 14 1HG PRO 14 -6.046 3.521 -4.223
101 HD2 PRO 14 2HD PRO 14 -4.763 5.002 -2.309
102 HD3 PRO 14 1HD PRO 14 -6.288 5.487 -3.073
103 H ARG 15 H ARG 15 -7.704 0.937 -0.171
104 HA ARG 15 HA ARG 15 -5.173 0.540 1.254
105 HB2 ARG 15 2HB ARG 15 -7.980 -0.357 1.932
106 HB3 ARG 15 1HB ARG 15 -6.542 -0.903 2.785
107 HG2 ARG 15 2HG ARG 15 -6.063 1.346 3.507
108 HG3 ARG 15 1HG ARG 15 -7.404 1.965 2.549
109 HD2 ARG 15 2HD ARG 15 -8.998 0.827 3.932
110 HD3 ARG 15 1HD ARG 15 -7.713 -0.007 4.806
111 HE ARG 15 HE ARG 15 -6.977 2.224 5.545
112 HH11 ARG 15 1HH1 ARG 15 -10.379 1.785 4.685
113 HH12 ARG 15 2HH1 ARG 15 -10.945 3.063 5.640
114 HH21 ARG 15 1HH2 ARG 15 -7.693 3.900 6.858
115 HH22 ARG 15 2HH2 ARG 15 -9.333 4.355 6.957
116 H CYS 16 H CYS 16 -4.640 -1.772 1.542
117 HA CYS 16 HA CYS 16 -4.445 -3.066 -0.973
118 HB2 CYS 16 2HB CYS 16 -3.837 -4.106 1.792
119 HB3 CYS 16 1HB CYS 16 -3.211 -4.735 0.271
120 H CYS 17 H CYS 17 -5.525 -4.855 -1.746
121 HA CYS 17 HA CYS 17 -8.016 -5.603 -0.592
122 HB2 CYS 17 2HB CYS 17 -6.310 -7.092 -2.607
123 HB3 CYS 17 1HB CYS 17 -8.000 -7.416 -2.262
124 H SER 18 H SER 18 -8.536 -7.785 0.243
125 HA SER 18 HA SER 18 -7.055 -8.435 2.457
126 HB2 SER 18 2HB SER 18 -8.642 -10.488 2.276
127 HB3 SER 18 1HB SER 18 -9.324 -8.875 2.517
128 HG SER 18 HG SER 18 -10.071 -10.423 0.683
129 H GLY 19 H GLY 19 -4.954 -9.014 2.093
130 HA2 GLY 19 2HA GLY 19 -3.482 -10.880 2.010
131 HA3 GLY 19 1HA GLY 19 -4.569 -11.640 0.849
132 H GLN 20 H GLN 20 -3.564 -8.308 0.682
133 HA GLN 20 HA GLN 20 -1.843 -8.992 -1.581
134 HB2 GLN 20 2HB GLN 20 -3.827 -6.760 -1.338
135 HB3 GLN 20 1HB GLN 20 -2.478 -6.661 -2.463
136 HG2 GLN 20 2HG GLN 20 -4.528 -8.862 -2.425
137 HG3 GLN 20 1HG GLN 20 -4.545 -7.469 -3.510
138 HE21 GLN 20 1HE2 GLN 20 -2.924 -10.474 -2.744
139 HE22 GLN 20 2HE2 GLN 20 -2.042 -10.546 -4.227
140 H GLY 21 H GLY 21 -1.073 -8.792 1.073
141 HA2 GLY 21 2HA GLY 21 0.857 -8.053 2.064
142 HA3 GLY 21 1HA GLY 21 1.084 -6.962 0.709
143 H ASN 22 H ASN 22 1.763 -5.579 2.444
144 HA ASN 22 HA ASN 22 -0.502 -4.088 3.565
145 HB2 ASN 22 2HB ASN 22 2.189 -4.577 4.900
146 HB3 ASN 22 1HB ASN 22 0.907 -3.559 5.525
147 HD21 ASN 22 1HD2 ASN 22 2.038 -6.785 5.115
148 HD22 ASN 22 2HD2 ASN 22 0.828 -7.551 6.085
149 H CYS 23 H CYS 23 0.014 -1.838 3.768
150 HA CYS 23 HA CYS 23 1.408 -0.838 1.543
151 HB2 CYS 23 2HB CYS 23 0.293 0.546 3.970
152 HB3 CYS 23 1HB CYS 23 0.970 1.387 2.584
153 H VAL 24 H VAL 24 3.499 -1.310 1.543
154 HA VAL 24 HA VAL 24 5.173 -0.556 3.763
155 HB VAL 24 HB VAL 24 5.789 -2.562 2.426
156 HG11 VAL 24 1HG1 VAL 24 4.958 -1.931 0.254
157 HG12 VAL 24 2HG1 VAL 24 6.658 -2.389 0.156
158 HG13 VAL 24 3HG1 VAL 24 6.200 -0.687 0.119
159 HG21 VAL 24 3HG2 VAL 24 7.585 -1.405 3.544
160 HG22 VAL 24 1HG2 VAL 24 7.793 -0.332 2.158
161 HG23 VAL 24 2HG2 VAL 24 8.156 -2.052 2.004
162 HA PRO 25 HA PRO 25 5.081 3.510 2.278
163 HB2 PRO 25 2HB PRO 25 6.997 4.637 3.863
164 HB3 PRO 25 1HB PRO 25 5.372 4.215 4.417
165 HG2 PRO 25 2HG PRO 25 7.937 2.737 4.780
166 HG3 PRO 25 1HG PRO 25 6.601 2.960 5.920
167 HD2 PRO 25 2HD PRO 25 6.987 0.678 4.459
168 HD3 PRO 25 1HD PRO 25 5.401 1.214 5.040
169 H LEU 26 H LEU 26 5.857 4.491 0.628
170 HA LEU 26 HA LEU 26 8.651 4.128 -0.203
171 HB2 LEU 26 2HB LEU 26 6.131 3.955 -1.804
172 HB3 LEU 26 1HB LEU 26 7.533 4.659 -2.569
173 HG LEU 26 HG LEU 26 7.284 2.342 -3.198
174 HD11 LEU 26 1HD1 LEU 26 9.478 1.511 -2.669
175 HD12 LEU 26 2HD1 LEU 26 9.641 2.703 -1.384
176 HD13 LEU 26 3HD1 LEU 26 9.517 3.228 -3.065
177 HD21 LEU 26 3HD2 LEU 26 7.633 1.663 -0.290
178 HD22 LEU 26 1HD2 LEU 26 7.490 0.516 -1.621
179 HD23 LEU 26 2HD2 LEU 26 6.119 1.549 -1.179
180 HA PRO 27 HA PRO 27 9.230 8.445 0.169
181 HB2 PRO 27 2HB PRO 27 10.265 8.276 -2.632
182 HB3 PRO 27 1HB PRO 27 10.958 9.096 -1.228
183 HG2 PRO 27 2HG PRO 27 11.925 6.750 -1.964
184 HG3 PRO 27 1HG PRO 27 11.668 7.105 -0.246
185 HD2 PRO 27 2HD PRO 27 10.081 5.377 -2.081
186 HD3 PRO 27 1HD PRO 27 10.404 5.166 -0.359
187 H PHE 28 H PHE 28 8.325 7.949 -3.268
188 HA PHE 28 HA PHE 28 6.852 10.479 -3.183
189 HB2 PHE 28 2HB PHE 28 7.376 8.648 -5.519
190 HB3 PHE 28 1HB PHE 28 6.640 10.240 -5.608
191 HD1 PHE 28 2HD PHE 28 7.992 12.243 -5.080
192 HD2 PHE 28 1HD PHE 28 9.688 8.361 -5.382
193 HE1 PHE 28 2HE PHE 28 10.229 13.234 -5.324
194 HE2 PHE 28 1HE PHE 28 11.908 9.334 -5.624
195 HZ PHE 28 HZ PHE 28 12.189 11.753 -5.598
196 H LEU 29 H LEU 29 6.186 7.146 -3.227
197 HA LEU 29 HA LEU 29 3.478 7.537 -4.213
198 HB2 LEU 29 2HB LEU 29 4.915 5.013 -3.385
199 HB3 LEU 29 1HB LEU 29 3.268 5.055 -3.960
200 HG LEU 29 HG LEU 29 4.584 4.299 -5.754
201 HD11 LEU 29 1HD1 LEU 29 4.303 5.964 -7.478
202 HD12 LEU 29 2HD1 LEU 29 4.040 7.194 -6.250
203 HD13 LEU 29 3HD1 LEU 29 2.892 5.860 -6.421
204 HD21 LEU 29 3HD2 LEU 29 6.532 5.506 -6.665
205 HD22 LEU 29 1HD2 LEU 29 6.799 4.972 -5.008
206 HD23 LEU 29 2HD2 LEU 29 6.426 6.658 -5.343
207 H GLY 30 H GLY 30 5.088 7.404 -1.250
208 HA2 GLY 30 2HA GLY 30 4.155 7.846 0.814
209 HA3 GLY 30 1HA GLY 30 2.554 7.476 0.158
210 H GLY 31 H GLY 31 2.427 5.189 -0.673
211 HA2 GLY 31 2HA GLY 31 4.027 3.209 0.588
212 HA3 GLY 31 1HA GLY 31 2.427 3.366 1.324
213 H VAL 32 H VAL 32 3.644 1.226 -0.219
214 HA VAL 32 HA VAL 32 1.422 0.938 -2.142
215 HB VAL 32 HB VAL 32 2.726 -0.184 -3.801
216 HG11 VAL 32 1HG1 VAL 32 4.349 1.480 -4.565
217 HG12 VAL 32 2HG1 VAL 32 4.192 2.303 -3.014
218 HG13 VAL 32 3HG1 VAL 32 2.798 2.168 -4.085
219 HG21 VAL 32 3HG2 VAL 32 4.252 -1.466 -2.442
220 HG22 VAL 32 1HG2 VAL 32 5.128 -0.007 -1.978
221 HG23 VAL 32 2HG2 VAL 32 5.160 -0.565 -3.652
222 H CYS 33 H CYS 33 0.663 -1.210 -2.426
223 HA CYS 33 HA CYS 33 0.845 -2.761 -0.029
224 HB2 CYS 33 2HB CYS 33 -0.551 -3.277 -2.654
225 HB3 CYS 33 1HB CYS 33 -0.748 -4.248 -1.197
226 H ALA 34 H ALA 34 2.437 -4.174 0.343
227 HA ALA 34 HA ALA 34 3.331 -5.798 -1.889
228 HB1 ALA 34 1HB ALA 34 5.231 -4.301 -0.093
229 HB2 ALA 34 2HB ALA 34 4.912 -3.940 -1.791
230 HB3 ALA 34 3HB ALA 34 5.681 -5.463 -1.340
231 H VAL 35 H VAL 35 4.045 -7.781 -1.323
232 HA VAL 35 HA VAL 35 3.344 -8.652 1.317
233 HB VAL 35 HB VAL 35 3.879 -10.971 0.500
234 HG11 VAL 35 1HG1 VAL 35 2.011 -9.399 -1.265
235 HG12 VAL 35 2HG1 VAL 35 1.623 -10.091 0.308
236 HG13 VAL 35 3HG1 VAL 35 1.993 -11.151 -1.054
237 HG21 VAL 35 3HG2 VAL 35 4.368 -9.611 -2.159
238 HG22 VAL 35 1HG2 VAL 35 4.280 -11.351 -1.900
239 HG23 VAL 35 2HG2 VAL 35 5.592 -10.418 -1.179
Start of MODEL 20
1 H1 CYS 1 1HT CYS 1 -11.217 -2.177 -2.780
2 H2 CYS 1 2HT CYS 1 -10.589 -3.109 -4.048
3 H3 CYS 1 3HT CYS 1 -10.497 -1.438 -4.117
4 HA CYS 1 HA CYS 1 -9.014 -1.404 -2.236
5 HB2 CYS 1 2HB CYS 1 -8.102 -3.598 -1.485
6 HB3 CYS 1 1HB CYS 1 -9.814 -3.421 -1.120
7 H VAL 2 H VAL 2 -6.628 -1.981 -2.538
8 HA VAL 2 HA VAL 2 -6.138 -2.266 -5.407
9 HB VAL 2 HB VAL 2 -4.078 -0.916 -5.077
10 HG11 VAL 2 1HG1 VAL 2 -6.624 0.437 -4.221
11 HG12 VAL 2 2HG1 VAL 2 -6.084 0.165 -5.877
12 HG13 VAL 2 3HG1 VAL 2 -5.184 1.257 -4.823
13 HG21 VAL 2 3HG2 VAL 2 -5.168 -0.458 -2.300
14 HG22 VAL 2 1HG2 VAL 2 -3.802 0.394 -3.020
15 HG23 VAL 2 2HG2 VAL 2 -3.695 -1.339 -2.705
16 H LEU 3 H LEU 3 -4.135 -3.272 -6.106
17 HA LEU 3 HA LEU 3 -3.557 -5.523 -4.345
18 HB2 LEU 3 2HB LEU 3 -2.818 -5.229 -7.250
19 HB3 LEU 3 1HB LEU 3 -2.841 -6.662 -6.243
20 HG LEU 3 HG LEU 3 -5.278 -5.167 -7.207
21 HD11 LEU 3 1HD1 LEU 3 -4.135 -6.310 -9.010
22 HD12 LEU 3 2HD1 LEU 3 -5.657 -7.117 -8.626
23 HD13 LEU 3 3HD1 LEU 3 -4.129 -7.808 -8.080
24 HD21 LEU 3 3HD2 LEU 3 -6.536 -7.102 -6.373
25 HD22 LEU 3 1HD2 LEU 3 -5.695 -6.255 -5.075
26 HD23 LEU 3 2HD2 LEU 3 -5.047 -7.770 -5.704
27 H ILE 4 H ILE 4 -1.165 -6.385 -5.059
28 HA ILE 4 HA ILE 4 0.674 -4.666 -3.872
29 HB ILE 4 HB ILE 4 2.464 -6.153 -4.757
30 HG12 ILE 4 2HG1 ILE 4 0.179 -7.651 -6.059
31 HG13 ILE 4 1HG1 ILE 4 1.392 -6.712 -6.919
32 HG21 ILE 4 1HG2 ILE 4 1.766 -8.157 -3.520
33 HG22 ILE 4 2HG2 ILE 4 0.113 -7.544 -3.491
34 HG23 ILE 4 3HG2 ILE 4 1.393 -6.667 -2.654
35 HD11 ILE 4 3HD1 ILE 4 3.123 -8.241 -6.136
36 HD12 ILE 4 1HD1 ILE 4 1.864 -9.093 -7.030
37 HD13 ILE 4 2HD1 ILE 4 1.905 -9.176 -5.268
38 H GLY 5 H GLY 5 2.049 -3.173 -4.527
39 HA2 GLY 5 2HA GLY 5 3.446 -2.021 -6.047
40 HA3 GLY 5 1HA GLY 5 2.580 -2.772 -7.380
41 H GLN 6 H GLN 6 0.059 -2.001 -5.810
42 HA GLN 6 HA GLN 6 -0.264 0.568 -7.130
43 HB2 GLN 6 2HB GLN 6 -2.207 -1.203 -5.664
44 HB3 GLN 6 1HB GLN 6 -2.650 0.204 -6.628
45 HG2 GLN 6 2HG GLN 6 -1.878 -0.911 -8.646
46 HG3 GLN 6 1HG GLN 6 -1.309 -2.281 -7.700
47 HE21 GLN 6 1HE2 GLN 6 -4.359 -0.620 -7.177
48 HE22 GLN 6 2HE2 GLN 6 -5.354 -1.949 -7.659
49 H ARG 7 H ARG 7 -1.157 2.356 -5.916
50 HA ARG 7 HA ARG 7 0.120 2.441 -3.314
51 HB2 ARG 7 2HB ARG 7 -0.107 4.860 -3.352
52 HB3 ARG 7 1HB ARG 7 0.644 4.293 -4.829
53 HG2 ARG 7 2HG ARG 7 -1.402 4.640 -6.050
54 HG3 ARG 7 1HG ARG 7 -2.249 5.050 -4.552
55 HD2 ARG 7 2HD ARG 7 -1.650 7.070 -5.783
56 HD3 ARG 7 1HD ARG 7 -0.786 6.985 -4.252
57 HE ARG 7 HE ARG 7 0.611 5.945 -6.545
58 HH11 ARG 7 1HH1 ARG 7 0.081 8.814 -4.514
59 HH12 ARG 7 2HH1 ARG 7 1.527 9.578 -4.982
60 HH21 ARG 7 1HH2 ARG 7 2.596 7.021 -7.181
61 HH22 ARG 7 2HH2 ARG 7 2.982 8.550 -6.530
62 H CYS 8 H CYS 8 -0.850 3.214 -1.450
63 HA CYS 8 HA CYS 8 -3.758 2.958 -1.402
64 HB2 CYS 8 2HB CYS 8 -3.493 1.476 0.598
65 HB3 CYS 8 1HB CYS 8 -3.025 0.751 -0.938
66 H ASP 9 H ASP 9 -4.696 3.711 0.514
67 HA ASP 9 HA ASP 9 -3.039 5.424 2.235
68 HB2 ASP 9 2HB ASP 9 -4.427 6.797 0.564
69 HB3 ASP 9 1HB ASP 9 -5.857 6.085 1.311
70 H ASN 10 H ASN 10 -3.355 4.861 4.294
71 HA ASN 10 HA ASN 10 -5.046 2.588 4.822
72 HB2 ASN 10 2HB ASN 10 -3.302 4.147 6.722
73 HB3 ASN 10 1HB ASN 10 -4.064 2.603 7.062
74 HD21 ASN 10 1HD2 ASN 10 -2.218 1.513 7.441
75 HD22 ASN 10 2HD2 ASN 10 -1.018 1.212 6.242
76 H ASP 11 H ASP 11 -5.183 5.951 5.305
77 HA ASP 11 HA ASP 11 -7.088 5.754 7.496
78 HB2 ASP 11 2HB ASP 11 -5.326 7.374 7.762
79 HB3 ASP 11 1HB ASP 11 -5.729 8.125 6.225
80 H ARG 12 H ARG 12 -6.927 6.933 4.200
81 HA ARG 12 HA ARG 12 -9.826 7.438 4.323
82 HB2 ARG 12 2HB ARG 12 -7.751 8.614 2.508
83 HB3 ARG 12 1HB ARG 12 -9.471 8.967 2.445
84 HG2 ARG 12 2HG ARG 12 -9.426 10.038 4.547
85 HG3 ARG 12 1HG ARG 12 -7.807 9.428 4.897
86 HD2 ARG 12 2HD ARG 12 -8.536 11.363 2.716
87 HD3 ARG 12 1HD ARG 12 -7.747 11.771 4.243
88 HE ARG 12 HE ARG 12 -6.200 9.812 3.080
89 HH11 ARG 12 1HH1 ARG 12 -7.169 13.104 2.298
90 HH12 ARG 12 2HH1 ARG 12 -5.805 13.445 1.353
91 HH21 ARG 12 1HH2 ARG 12 -4.380 10.214 1.792
92 HH22 ARG 12 2HH2 ARG 12 -4.148 11.744 1.035
93 H GLY 13 H GLY 13 -7.529 5.358 2.940
94 HA2 GLY 13 2HA GLY 13 -8.046 3.522 1.595
95 HA3 GLY 13 1HA GLY 13 -9.583 4.280 1.185
96 HA PRO 14 HA PRO 14 -9.030 2.523 -0.455
97 HB2 PRO 14 2HB PRO 14 -7.841 1.264 -2.503
98 HB3 PRO 14 1HB PRO 14 -9.123 2.450 -2.781
99 HG2 PRO 14 2HG PRO 14 -6.160 2.786 -3.013
100 HG3 PRO 14 1HG PRO 14 -7.436 3.371 -4.093
101 HD2 PRO 14 2HD PRO 14 -6.208 4.924 -2.196
102 HD3 PRO 14 1HD PRO 14 -7.852 5.211 -2.797
103 H ARG 15 H ARG 15 -8.224 0.403 0.187
104 HA ARG 15 HA ARG 15 -5.433 0.510 1.041
105 HB2 ARG 15 2HB ARG 15 -7.764 -0.864 2.370
106 HB3 ARG 15 1HB ARG 15 -6.094 -1.081 2.858
107 HG2 ARG 15 2HG ARG 15 -5.991 1.378 3.289
108 HG3 ARG 15 1HG ARG 15 -7.726 1.441 2.980
109 HD2 ARG 15 2HD ARG 15 -6.355 -0.189 5.115
110 HD3 ARG 15 1HD ARG 15 -7.271 1.294 5.373
111 HE ARG 15 HE ARG 15 -8.962 -0.444 4.078
112 HH11 ARG 15 1HH1 ARG 15 -7.212 -0.474 7.146
113 HH12 ARG 15 2HH1 ARG 15 -8.392 -1.395 7.959
114 HH21 ARG 15 1HH2 ARG 15 -10.528 -1.694 5.160
115 HH22 ARG 15 2HH2 ARG 15 -10.349 -2.106 6.801
116 H CYS 16 H CYS 16 -4.618 -1.806 1.483
117 HA CYS 16 HA CYS 16 -4.459 -3.134 -0.998
118 HB2 CYS 16 2HB CYS 16 -3.713 -4.139 1.744
119 HB3 CYS 16 1HB CYS 16 -3.053 -4.666 0.200
120 H CYS 17 H CYS 17 -5.542 -4.958 -1.704
121 HA CYS 17 HA CYS 17 -7.867 -5.887 -0.324
122 HB2 CYS 17 2HB CYS 17 -6.194 -7.363 -2.370
123 HB3 CYS 17 1HB CYS 17 -7.886 -7.646 -1.988
124 H SER 18 H SER 18 -8.038 -7.687 1.099
125 HA SER 18 HA SER 18 -5.862 -8.205 2.715
126 HB2 SER 18 2HB SER 18 -7.435 -10.074 3.578
127 HB3 SER 18 1HB SER 18 -7.962 -8.395 3.709
128 HG SER 18 HG SER 18 -9.130 -10.409 2.453
129 H GLY 19 H GLY 19 -4.117 -8.975 1.805
130 HA2 GLY 19 2HA GLY 19 -3.074 -11.286 1.615
131 HA3 GLY 19 1HA GLY 19 -4.210 -11.490 0.286
132 H GLN 20 H GLN 20 -3.552 -8.343 0.156
133 HA GLN 20 HA GLN 20 -1.520 -8.705 -1.913
134 HB2 GLN 20 2HB GLN 20 -3.544 -6.550 -1.395
135 HB3 GLN 20 1HB GLN 20 -2.333 -6.414 -2.653
136 HG2 GLN 20 2HG GLN 20 -4.368 -8.614 -2.440
137 HG3 GLN 20 1HG GLN 20 -4.522 -7.181 -3.459
138 HE21 GLN 20 1HE2 GLN 20 -4.443 -9.994 -4.150
139 HE22 GLN 20 2HE2 GLN 20 -3.144 -10.194 -5.252
140 H GLY 21 H GLY 21 -0.869 -8.512 0.954
141 HA2 GLY 21 2HA GLY 21 1.119 -7.737 1.875
142 HA3 GLY 21 1HA GLY 21 1.252 -6.599 0.553
143 H ASN 22 H ASN 22 1.983 -5.357 2.444
144 HA ASN 22 HA ASN 22 -0.253 -4.025 3.849
145 HB2 ASN 22 2HB ASN 22 2.662 -4.389 4.619
146 HB3 ASN 22 1HB ASN 22 1.615 -3.224 5.401
147 HD21 ASN 22 1HD2 ASN 22 0.429 -6.332 4.424
148 HD22 ASN 22 2HD2 ASN 22 0.286 -7.004 6.003
149 H CYS 23 H CYS 23 0.130 -1.689 4.136
150 HA CYS 23 HA CYS 23 1.115 -0.531 1.721
151 HB2 CYS 23 2HB CYS 23 -0.031 0.665 4.243
152 HB3 CYS 23 1HB CYS 23 0.521 1.631 2.880
153 H VAL 24 H VAL 24 3.190 -0.730 1.536
154 HA VAL 24 HA VAL 24 4.948 -0.082 3.736
155 HB VAL 24 HB VAL 24 5.620 -1.076 0.964
156 HG11 VAL 24 1HG1 VAL 24 7.498 0.005 2.019
157 HG12 VAL 24 2HG1 VAL 24 7.769 -1.740 1.962
158 HG13 VAL 24 3HG1 VAL 24 7.275 -0.970 3.469
159 HG21 VAL 24 3HG2 VAL 24 5.309 -2.659 3.514
160 HG22 VAL 24 1HG2 VAL 24 5.913 -3.301 1.987
161 HG23 VAL 24 2HG2 VAL 24 4.249 -2.729 2.107
162 HA PRO 25 HA PRO 25 5.297 3.864 1.753
163 HB2 PRO 25 2HB PRO 25 6.837 5.066 3.616
164 HB3 PRO 25 1HB PRO 25 5.119 4.747 3.858
165 HG2 PRO 25 2HG PRO 25 7.460 3.398 5.026
166 HG3 PRO 25 1HG PRO 25 5.808 3.518 5.653
167 HD2 PRO 25 2HD PRO 25 7.017 1.316 4.276
168 HD3 PRO 25 1HD PRO 25 5.335 1.468 4.804
169 H LEU 26 H LEU 26 6.486 4.184 0.120
170 HA LEU 26 HA LEU 26 9.364 3.669 0.232
171 HB2 LEU 26 2HB LEU 26 7.422 3.534 -2.067
172 HB3 LEU 26 1HB LEU 26 9.123 3.793 -2.373
173 HG LEU 26 HG LEU 26 9.612 1.598 -1.285
174 HD11 LEU 26 1HD1 LEU 26 6.631 1.267 -1.215
175 HD12 LEU 26 2HD1 LEU 26 7.708 1.396 0.173
176 HD13 LEU 26 3HD1 LEU 26 7.820 0.002 -0.903
177 HD21 LEU 26 3HD2 LEU 26 7.659 1.478 -3.568
178 HD22 LEU 26 1HD2 LEU 26 8.785 0.205 -3.105
179 HD23 LEU 26 2HD2 LEU 26 9.398 1.748 -3.699
180 HA PRO 27 HA PRO 27 9.777 8.056 0.592
181 HB2 PRO 27 2HB PRO 27 12.340 7.559 -0.834
182 HB3 PRO 27 1HB PRO 27 12.041 8.433 0.671
183 HG2 PRO 27 2HG PRO 27 13.064 6.006 0.748
184 HG3 PRO 27 1HG PRO 27 11.812 6.479 1.910
185 HD2 PRO 27 2HD PRO 27 11.591 4.753 -0.519
186 HD3 PRO 27 1HD PRO 27 10.818 4.603 1.078
187 H PHE 28 H PHE 28 9.944 6.552 -2.508
188 HA PHE 28 HA PHE 28 9.781 9.200 -3.789
189 HB2 PHE 28 2HB PHE 28 10.487 6.547 -5.054
190 HB3 PHE 28 1HB PHE 28 10.466 8.107 -5.867
191 HD1 PHE 28 1HD PHE 28 12.238 9.714 -5.469
192 HD2 PHE 28 2HD PHE 28 12.214 5.922 -3.550
193 HE1 PHE 28 1HE PHE 28 14.604 10.002 -4.860
194 HE2 PHE 28 2HE PHE 28 14.567 6.200 -2.940
195 HZ PHE 28 HZ PHE 28 15.763 8.224 -3.593
196 H LEU 29 H LEU 29 8.009 6.334 -3.130
197 HA LEU 29 HA LEU 29 6.111 6.962 -5.287
198 HB2 LEU 29 2HB LEU 29 6.557 4.345 -3.849
199 HB3 LEU 29 1HB LEU 29 5.222 4.632 -4.935
200 HG LEU 29 HG LEU 29 6.913 5.017 -6.772
201 HD11 LEU 29 1HD1 LEU 29 9.181 4.147 -6.469
202 HD12 LEU 29 2HD1 LEU 29 8.855 3.900 -4.755
203 HD13 LEU 29 3HD1 LEU 29 8.860 5.526 -5.422
204 HD21 LEU 29 3HD2 LEU 29 7.344 2.641 -7.110
205 HD22 LEU 29 1HD2 LEU 29 5.697 2.927 -6.550
206 HD23 LEU 29 2HD2 LEU 29 6.918 2.321 -5.430
207 H GLY 30 H GLY 30 6.467 7.006 -1.923
208 HA2 GLY 30 2HA GLY 30 4.859 8.035 -0.538
209 HA3 GLY 30 1HA GLY 30 3.607 7.507 -1.668
210 H GLY 31 H GLY 31 2.570 5.672 -1.260
211 HA2 GLY 31 2HA GLY 31 3.933 3.608 0.232
212 HA3 GLY 31 1HA GLY 31 2.459 4.193 0.966
213 H VAL 32 H VAL 32 3.492 1.727 -0.456
214 HA VAL 32 HA VAL 32 1.163 1.308 -2.195
215 HB VAL 32 HB VAL 32 2.531 0.041 -3.816
216 HG11 VAL 32 1HG1 VAL 32 3.508 2.865 -3.433
217 HG12 VAL 32 2HG1 VAL 32 2.086 2.357 -4.344
218 HG13 VAL 32 3HG1 VAL 32 3.697 1.911 -4.903
219 HG21 VAL 32 3HG2 VAL 32 4.369 -0.635 -2.357
220 HG22 VAL 32 1HG2 VAL 32 4.904 1.041 -2.250
221 HG23 VAL 32 2HG2 VAL 32 4.990 0.186 -3.791
222 H CYS 33 H CYS 33 0.517 -0.832 -2.398
223 HA CYS 33 HA CYS 33 0.870 -2.406 -0.046
224 HB2 CYS 33 2HB CYS 33 -0.508 -3.011 -2.664
225 HB3 CYS 33 1HB CYS 33 -0.629 -3.989 -1.203
226 H ALA 34 H ALA 34 2.510 -3.748 0.286
227 HA ALA 34 HA ALA 34 3.515 -5.312 -1.945
228 HB1 ALA 34 1HB ALA 34 4.948 -3.329 -1.910
229 HB2 ALA 34 2HB ALA 34 5.843 -4.779 -1.456
230 HB3 ALA 34 3HB ALA 34 5.331 -3.635 -0.215
231 H VAL 35 H VAL 35 4.476 -7.221 -1.330
232 HA VAL 35 HA VAL 35 4.002 -7.961 1.424
233 HB VAL 35 HB VAL 35 4.405 -10.350 0.651
234 HG11 VAL 35 1HG1 VAL 35 2.160 -9.479 0.890
235 HG12 VAL 35 2HG1 VAL 35 2.257 -10.558 -0.502
236 HG13 VAL 35 3HG1 VAL 35 2.224 -8.812 -0.740
237 HG21 VAL 35 3HG2 VAL 35 5.721 -9.859 -1.382
238 HG22 VAL 35 1HG2 VAL 35 4.295 -9.122 -2.112
239 HG23 VAL 35 2HG2 VAL 35 4.305 -10.847 -1.745