NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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14420 |
1wo7   |
6325 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H PHE 1 1HT PHE 1 -2.332 2.161 5.127
2 2H PHE 1 2HT PHE 1 -3.024 1.865 3.585
3 3H PHE 1 3HT PHE 1 -1.376 1.483 3.877
4 HA PHE 1 HA PHE 1 -1.888 -0.269 5.245
5 1HB PHE 1 2HB PHE 1 -4.455 1.203 5.462
6 2HB PHE 1 1HB PHE 1 -4.555 -0.552 5.561
7 HD1 PHE 1 1HD PHE 1 -4.054 -1.659 7.546
8 HD2 PHE 1 2HD PHE 1 -2.857 2.394 7.043
9 HE1 PHE 1 1HE PHE 1 -3.392 -1.565 9.914
10 HE2 PHE 1 2HE PHE 1 -2.192 2.495 9.410
11 HZ PHE 1 HZ PHE 1 -2.459 0.514 10.849
12 H VAL 2 H VAL 2 -1.754 -2.068 4.080
13 HA VAL 2 HA VAL 2 -2.503 -2.250 1.393
14 HB VAL 2 HB VAL 2 -0.759 -3.663 2.394
15 1HG1 VAL 2 1HG1 VAL 2 -1.382 -5.639 3.714
16 2HG1 VAL 2 2HG1 VAL 2 -3.057 -5.086 3.733
17 3HG1 VAL 2 3HG1 VAL 2 -1.805 -4.135 4.533
18 1HG2 VAL 2 1HG2 VAL 2 -1.040 -5.287 0.858
19 2HG2 VAL 2 2HG2 VAL 2 -2.443 -4.327 0.388
20 3HG2 VAL 2 3HG2 VAL 2 -2.643 -5.719 1.453
21 H SER 3 H SER 3 -4.234 -3.050 4.321
22 HA SER 3 HA SER 3 -6.251 -4.653 3.155
23 1HB SER 3 2HB SER 3 -6.312 -2.969 5.671
24 2HB SER 3 1HB SER 3 -7.520 -4.177 5.234
25 HG SER 3 HG SER 3 -6.248 -5.594 6.092
26 H THR 4 H THR 4 -5.810 -1.203 3.453
27 HA THR 4 HA THR 4 -8.457 -0.767 2.242
28 HB THR 4 HB THR 4 -8.173 1.599 3.015
29 HG1 THR 4 1HG THR 4 -6.528 2.030 4.482
30 1HG2 THR 4 1HG2 THR 4 -9.291 -0.265 4.397
31 2HG2 THR 4 2HG2 THR 4 -8.871 1.255 5.186
32 3HG2 THR 4 3HG2 THR 4 -7.845 -0.164 5.400
33 H CYS 5 H CYS 5 -5.979 -1.572 0.842
34 HA CYS 5 HA CYS 5 -4.870 0.631 -0.530
35 1HB CYS 5 2HB CYS 5 -3.754 -1.542 -0.457
36 2HB CYS 5 1HB CYS 5 -5.072 -2.268 -1.369
37 H TYR 6 H TYR 6 -5.165 1.221 -2.769
38 HA TYR 6 HA TYR 6 -7.984 1.192 -3.505
39 1HB TYR 6 2HB TYR 6 -7.354 2.943 -5.125
40 2HB TYR 6 1HB TYR 6 -6.857 3.352 -3.487
41 HD1 TYR 6 1HD TYR 6 -4.489 3.348 -2.869
42 HD2 TYR 6 2HD TYR 6 -5.725 2.500 -6.851
43 HE1 TYR 6 1HE TYR 6 -2.185 3.700 -3.653
44 HE2 TYR 6 2HE TYR 6 -3.424 2.848 -7.645
45 HH TYR 6 HH TYR 6 -0.761 3.109 -5.511
46 H LEU 7 H LEU 7 -4.832 0.393 -4.933
47 HA LEU 7 HA LEU 7 -6.146 -0.834 -7.225
48 1HB LEU 7 2HB LEU 7 -3.903 -1.118 -8.126
49 2HB LEU 7 1HB LEU 7 -4.173 0.540 -7.626
50 HG LEU 7 HG LEU 7 -3.000 -0.237 -5.412
51 1HD1 LEU 7 1HD1 LEU 7 -1.105 -1.869 -6.406
52 2HD1 LEU 7 2HD1 LEU 7 -2.516 -2.459 -7.284
53 3HD1 LEU 7 3HD1 LEU 7 -2.522 -2.436 -5.520
54 1HD2 LEU 7 1HD2 LEU 7 -1.280 1.001 -6.136
55 2HD2 LEU 7 2HD2 LEU 7 -2.226 1.186 -7.613
56 3HD2 LEU 7 3HD2 LEU 7 -0.976 -0.054 -7.515
57 HA PRO 8 HA PRO 8 -5.916 -4.915 -5.531
58 1HB PRO 8 2HB PRO 8 -6.141 -6.381 -7.778
59 2HB PRO 8 1HB PRO 8 -7.491 -5.434 -7.139
60 1HG PRO 8 2HG PRO 8 -5.602 -4.776 -9.367
61 2HG PRO 8 1HG PRO 8 -7.360 -4.557 -9.289
62 1HD PRO 8 2HD PRO 8 -5.569 -2.542 -8.852
63 2HD PRO 8 1HD PRO 8 -7.185 -2.592 -8.118
64 H LYS 9 H LYS 9 -4.777 -7.107 -6.116
65 HA LYS 9 HA LYS 9 -2.828 -8.277 -6.198
66 1HB LYS 9 2HB LYS 9 -1.897 -6.183 -8.164
67 2HB LYS 9 1HB LYS 9 -1.317 -7.836 -8.011
68 1HG LYS 9 2HG LYS 9 -4.199 -7.509 -8.550
69 2HG LYS 9 1HG LYS 9 -3.095 -7.056 -9.851
70 1HD LYS 9 2HD LYS 9 -2.018 -9.415 -9.075
71 2HD LYS 9 1HD LYS 9 -3.724 -9.707 -8.731
72 1HE LYS 9 2HE LYS 9 -3.969 -8.619 -11.155
73 2HE LYS 9 1HE LYS 9 -2.346 -9.289 -11.321
74 1HZ LYS 9 1HZ LYS 9 -3.506 -11.106 -11.927
75 2HZ LYS 9 2HZ LYS 9 -4.903 -10.654 -11.086
76 3HZ LYS 9 3HZ LYS 9 -3.610 -11.362 -10.257
77 H CYS 10 H CYS 10 -3.094 -6.329 -4.161
78 HA CYS 10 HA CYS 10 -0.285 -5.505 -3.807
79 1HB CYS 10 2HB CYS 10 -2.393 -3.803 -3.899
80 2HB CYS 10 1HB CYS 10 -2.348 -4.153 -2.175
81 H ALA 11 H ALA 11 -3.192 -6.729 -2.210
82 HA ALA 11 HA ALA 11 -1.712 -7.336 0.216
83 1HB ALA 11 1HB ALA 11 -4.573 -8.040 -0.395
84 2HB ALA 11 2HB ALA 11 -4.074 -6.466 0.222
85 3HB ALA 11 3HB ALA 11 -3.800 -7.918 1.184
86 H ALA 12 H ALA 12 -0.331 -9.004 -0.088
87 HA ALA 12 HA ALA 12 -1.408 -11.476 -1.271
88 1HB ALA 12 1HB ALA 12 0.581 -10.399 -2.372
89 2HB ALA 12 2HB ALA 12 0.799 -12.084 -1.898
90 3HB ALA 12 3HB ALA 12 1.503 -10.796 -0.922
91 H ALA 13 H ALA 13 0.174 -10.083 1.516
92 HA ALA 13 HA ALA 13 -0.473 -12.470 3.053
93 1HB ALA 13 1HB ALA 13 2.299 -11.361 3.308
94 2HB ALA 13 2HB ALA 13 1.922 -12.611 2.122
95 3HB ALA 13 3HB ALA 13 1.671 -12.921 3.840
96 H ALA 14 H ALA 14 -1.449 -9.722 2.940
97 HA ALA 14 HA ALA 14 -2.109 -8.061 4.349
98 1HB ALA 14 1HB ALA 14 -2.171 -8.590 6.766
99 2HB ALA 14 2HB ALA 14 -1.251 -10.059 6.438
100 3HB ALA 14 3HB ALA 14 -2.868 -9.861 5.761
101 H ASN 15 H ASN 15 0.634 -8.092 3.345
102 HA ASN 15 HA ASN 15 2.223 -6.968 5.504
103 1HB ASN 15 2HB ASN 15 2.746 -7.839 2.703
104 2HB ASN 15 1HB ASN 15 3.807 -6.611 3.388
105 1HD2 ASN 15 1HD2 ASN 15 5.603 -7.488 4.088
106 2HD2 ASN 15 2HD2 ASN 15 5.750 -8.990 4.929
107 H VAL 16 H VAL 16 2.065 -4.899 6.027
108 HA VAL 16 HA VAL 16 0.703 -2.994 4.411
109 HB VAL 16 HB VAL 16 0.707 -2.850 6.864
110 1HG1 VAL 16 1HG1 VAL 16 3.510 -1.807 6.795
111 2HG1 VAL 16 2HG1 VAL 16 3.204 -3.538 6.949
112 3HG1 VAL 16 3HG1 VAL 16 2.576 -2.420 8.160
113 1HG2 VAL 16 1HG2 VAL 16 0.476 -0.607 6.846
114 2HG2 VAL 16 2HG2 VAL 16 0.744 -0.795 5.113
115 3HG2 VAL 16 3HG2 VAL 16 2.082 -0.340 6.168
116 H ALA 17 H ALA 17 4.117 -3.565 5.169
117 HA ALA 17 HA ALA 17 5.198 -1.322 3.904
118 1HB ALA 17 1HB ALA 17 6.241 -4.007 4.650
119 2HB ALA 17 2HB ALA 17 6.760 -2.405 5.175
120 3HB ALA 17 3HB ALA 17 7.208 -2.997 3.575
121 H ALA 18 H ALA 18 4.593 -4.581 2.617
122 HA ALA 18 HA ALA 18 5.587 -4.170 0.041
123 1HB ALA 18 1HB ALA 18 3.769 -5.984 -0.514
124 2HB ALA 18 2HB ALA 18 3.625 -6.063 1.242
125 3HB ALA 18 3HB ALA 18 5.178 -6.383 0.469
126 H HIS 19 H HIS 19 2.743 -2.946 1.530
127 HA HIS 19 HA HIS 19 1.391 -2.416 -0.982
128 1HB HIS 19 2HB HIS 19 -0.192 -2.912 0.625
129 2HB HIS 19 1HB HIS 19 0.717 -2.136 1.914
130 HD2 HIS 19 2HD HIS 19 -0.519 0.060 2.763
131 HE1 HIS 19 1HE HIS 19 -2.374 1.126 -0.889
132 HE2 HIS 19 2HE HIS 19 -2.210 1.639 1.590
133 H ILE 20 H ILE 20 2.310 -0.349 1.780
134 HA ILE 20 HA ILE 20 2.133 2.067 0.379
135 HB ILE 20 HB ILE 20 2.134 1.928 2.830
136 1HG1 ILE 20 2HG1 ILE 20 4.496 3.623 2.072
137 2HG1 ILE 20 1HG1 ILE 20 2.896 3.993 1.438
138 1HG2 ILE 20 1HG2 ILE 20 4.252 0.283 2.601
139 2HG2 ILE 20 2HG2 ILE 20 3.828 1.133 4.087
140 3HG2 ILE 20 3HG2 ILE 20 5.070 1.788 3.019
141 1HD1 ILE 20 1HD1 ILE 20 2.655 3.600 4.232
142 2HD1 ILE 20 2HD1 ILE 20 2.420 5.079 3.300
143 3HD1 ILE 20 3HD1 ILE 20 4.015 4.685 3.942
144 H THR 21 H THR 21 4.609 -0.332 0.348
145 HA THR 21 HA THR 21 6.920 1.068 -0.131
146 HB THR 21 HB THR 21 6.915 -1.347 0.013
147 HG1 THR 21 1HG THR 21 8.626 -1.323 -1.167
148 1HG2 THR 21 1HG2 THR 21 5.897 -2.810 -1.393
149 2HG2 THR 21 2HG2 THR 21 5.921 -1.692 -2.757
150 3HG2 THR 21 3HG2 THR 21 4.742 -1.480 -1.463
151 H HIS 22 H HIS 22 4.435 0.189 -2.516
152 HA HIS 22 HA HIS 22 5.684 2.071 -4.402
153 1HB HIS 22 2HB HIS 22 4.526 0.855 -6.181
154 2HB HIS 22 1HB HIS 22 5.517 -0.242 -5.224
155 HD1 HIS 22 1HD HIS 22 4.349 -2.166 -4.091
156 HD2 HIS 22 2HD HIS 22 1.703 0.595 -5.714
157 HE1 HIS 22 1HE HIS 22 2.078 -3.233 -3.923
158 HE2 HIS 22 2HE HIS 22 0.507 -1.584 -4.999
159 H CYS 23 H CYS 23 2.769 1.273 -2.676
160 HA CYS 23 HA CYS 23 1.110 3.136 -4.110
161 1HB CYS 23 2HB CYS 23 0.725 1.466 -1.636
162 2HB CYS 23 1HB CYS 23 -0.468 2.659 -2.131
163 H TYR 24 H TYR 24 1.000 5.251 -3.783
164 HA TYR 24 HA TYR 24 1.617 6.328 -1.128
165 1HB TYR 24 2HB TYR 24 2.941 7.071 -3.721
166 2HB TYR 24 1HB TYR 24 2.798 8.252 -2.422
167 HD1 TYR 24 1HD TYR 24 3.396 6.947 -0.007
168 HD2 TYR 24 2HD TYR 24 5.059 6.185 -3.848
169 HE1 TYR 24 1HE TYR 24 5.415 6.028 1.056
170 HE2 TYR 24 2HE TYR 24 7.081 5.262 -2.797
171 HH TYR 24 HH TYR 24 8.240 5.665 -0.370
172 H LYS 25 H LYS 25 1.235 8.902 -1.358
173 HA LYS 25 HA LYS 25 -1.559 9.163 -1.822
174 1HB LYS 25 2HB LYS 25 -1.263 11.486 -1.156
175 2HB LYS 25 1HB LYS 25 -0.383 10.424 -0.066
176 1HG LYS 25 2HG LYS 25 1.588 10.953 -1.765
177 2HG LYS 25 1HG LYS 25 0.629 12.414 -2.008
178 1HD LYS 25 2HD LYS 25 1.923 13.109 -0.263
179 2HD LYS 25 1HD LYS 25 0.594 12.382 0.642
180 1HE LYS 25 2HE LYS 25 2.427 11.449 1.681
181 2HE LYS 25 1HE LYS 25 2.036 10.218 0.481
182 1HZ LYS 25 1HZ LYS 25 3.981 12.351 -0.129
183 2HZ LYS 25 2HZ LYS 25 3.822 10.824 -0.839
184 3HZ LYS 25 3HZ LYS 25 4.459 10.968 0.721
Start of MODEL 2
1 1H PHE 1 1HT PHE 1 -2.691 2.791 4.883
2 2H PHE 1 2HT PHE 1 -3.625 2.316 3.524
3 3H PHE 1 3HT PHE 1 -1.914 2.189 3.479
4 HA PHE 1 HA PHE 1 -1.884 0.479 5.012
5 1HB PHE 1 2HB PHE 1 -4.621 1.502 5.567
6 2HB PHE 1 1HB PHE 1 -4.354 -0.224 5.788
7 HD1 PHE 1 1HD PHE 1 -3.250 3.130 6.861
8 HD2 PHE 1 2HD PHE 1 -3.175 -1.050 7.653
9 HE1 PHE 1 1HE PHE 1 -2.270 3.572 9.074
10 HE2 PHE 1 2HE PHE 1 -2.195 -0.616 9.868
11 HZ PHE 1 HZ PHE 1 -1.742 1.697 10.582
12 H VAL 2 H VAL 2 -1.925 -1.567 4.218
13 HA VAL 2 HA VAL 2 -2.683 -2.039 1.576
14 HB VAL 2 HB VAL 2 -0.987 -3.379 2.744
15 1HG1 VAL 2 1HG1 VAL 2 -3.179 -4.907 4.099
16 2HG1 VAL 2 2HG1 VAL 2 -2.433 -3.507 4.870
17 3HG1 VAL 2 3HG1 VAL 2 -1.449 -4.906 4.438
18 1HG2 VAL 2 1HG2 VAL 2 -2.166 -4.224 0.712
19 2HG2 VAL 2 2HG2 VAL 2 -3.242 -5.131 1.777
20 3HG2 VAL 2 3HG2 VAL 2 -1.516 -5.493 1.752
21 H SER 3 H SER 3 -4.357 -2.766 4.603
22 HA SER 3 HA SER 3 -6.448 -4.299 3.545
23 1HB SER 3 2HB SER 3 -6.156 -2.619 6.018
24 2HB SER 3 1HB SER 3 -7.706 -3.362 5.625
25 HG SER 3 HG SER 3 -6.044 -4.558 6.978
26 H THR 4 H THR 4 -5.917 -0.854 3.618
27 HA THR 4 HA THR 4 -8.583 -0.418 2.452
28 HB THR 4 HB THR 4 -7.881 2.069 2.975
29 HG1 THR 4 1HG THR 4 -5.853 1.809 3.730
30 1HG2 THR 4 1HG2 THR 4 -9.744 0.819 4.058
31 2HG2 THR 4 2HG2 THR 4 -8.940 1.995 5.097
32 3HG2 THR 4 3HG2 THR 4 -8.593 0.276 5.278
33 H CYS 5 H CYS 5 -6.141 -1.388 1.055
34 HA CYS 5 HA CYS 5 -5.042 0.686 -0.513
35 1HB CYS 5 2HB CYS 5 -3.960 -1.501 -0.289
36 2HB CYS 5 1HB CYS 5 -5.303 -2.264 -1.133
37 H TYR 6 H TYR 6 -5.428 1.201 -2.725
38 HA TYR 6 HA TYR 6 -8.252 0.900 -3.462
39 1HB TYR 6 2HB TYR 6 -7.794 2.815 -5.009
40 2HB TYR 6 1HB TYR 6 -7.556 3.196 -3.307
41 HD1 TYR 6 1HD TYR 6 -5.942 2.788 -6.551
42 HD2 TYR 6 2HD TYR 6 -5.299 3.539 -2.413
43 HE1 TYR 6 1HE TYR 6 -3.667 3.576 -7.054
44 HE2 TYR 6 2HE TYR 6 -3.024 4.329 -2.904
45 HH TYR 6 HH TYR 6 -1.296 3.867 -4.860
46 H LEU 7 H LEU 7 -5.008 0.785 -4.926
47 HA LEU 7 HA LEU 7 -6.024 -0.380 -7.357
48 1HB LEU 7 2HB LEU 7 -3.683 -0.479 -8.046
49 2HB LEU 7 1HB LEU 7 -4.107 1.111 -7.440
50 HG LEU 7 HG LEU 7 -3.116 0.196 -5.187
51 1HD1 LEU 7 1HD1 LEU 7 -1.026 -1.219 -6.103
52 2HD1 LEU 7 2HD1 LEU 7 -2.285 -1.798 -7.194
53 3HD1 LEU 7 3HD1 LEU 7 -2.489 -1.955 -5.449
54 1HD2 LEU 7 1HD2 LEU 7 -1.975 2.005 -5.932
55 2HD2 LEU 7 2HD2 LEU 7 -1.830 1.377 -7.574
56 3HD2 LEU 7 3HD2 LEU 7 -0.760 0.782 -6.305
57 HA PRO 8 HA PRO 8 -5.761 -4.617 -6.131
58 1HB PRO 8 2HB PRO 8 -5.499 -5.809 -8.542
59 2HB PRO 8 1HB PRO 8 -7.011 -5.062 -8.015
60 1HG PRO 8 2HG PRO 8 -4.890 -3.973 -9.826
61 2HG PRO 8 1HG PRO 8 -6.653 -3.906 -10.002
62 1HD PRO 8 2HD PRO 8 -5.180 -1.820 -9.071
63 2HD PRO 8 1HD PRO 8 -6.854 -2.122 -8.565
64 H LYS 9 H LYS 9 -4.376 -6.670 -7.131
65 HA LYS 9 HA LYS 9 -2.357 -7.716 -7.077
66 1HB LYS 9 2HB LYS 9 -1.482 -5.086 -8.279
67 2HB LYS 9 1HB LYS 9 -0.436 -6.492 -8.137
68 1HG LYS 9 2HG LYS 9 -1.604 -7.687 -9.732
69 2HG LYS 9 1HG LYS 9 -3.067 -6.723 -9.530
70 1HD LYS 9 2HD LYS 9 -2.312 -5.865 -11.509
71 2HD LYS 9 1HD LYS 9 -1.482 -4.787 -10.384
72 1HE LYS 9 2HE LYS 9 0.237 -5.395 -11.788
73 2HE LYS 9 1HE LYS 9 0.405 -6.581 -10.494
74 1HZ LYS 9 1HZ LYS 9 0.426 -8.002 -12.221
75 2HZ LYS 9 2HZ LYS 9 -0.404 -6.955 -13.259
76 3HZ LYS 9 3HZ LYS 9 -1.258 -7.866 -12.117
77 H CYS 10 H CYS 10 -3.264 -6.231 -4.745
78 HA CYS 10 HA CYS 10 -0.649 -5.774 -3.471
79 1HB CYS 10 2HB CYS 10 -2.706 -3.885 -3.807
80 2HB CYS 10 1HB CYS 10 -2.770 -4.360 -2.113
81 H ALA 11 H ALA 11 -0.638 -6.153 -1.127
82 HA ALA 11 HA ALA 11 -0.986 -7.481 0.688
83 1HB ALA 11 1HB ALA 11 -3.057 -7.384 1.558
84 2HB ALA 11 2HB ALA 11 -3.808 -8.058 0.111
85 3HB ALA 11 3HB ALA 11 -3.393 -6.345 0.173
86 H ALA 12 H ALA 12 0.292 -9.191 -0.029
87 HA ALA 12 HA ALA 12 -1.132 -11.420 -1.321
88 1HB ALA 12 1HB ALA 12 0.979 -10.362 -2.364
89 2HB ALA 12 2HB ALA 12 0.864 -12.120 -2.283
90 3HB ALA 12 3HB ALA 12 1.850 -11.245 -1.112
91 H ALA 13 H ALA 13 0.769 -10.471 1.452
92 HA ALA 13 HA ALA 13 0.051 -12.995 2.753
93 1HB ALA 13 1HB ALA 13 2.461 -12.805 3.805
94 2HB ALA 13 2HB ALA 13 2.809 -11.983 2.284
95 3HB ALA 13 3HB ALA 13 2.192 -13.635 2.272
96 H ALA 14 H ALA 14 -0.938 -10.252 2.955
97 HA ALA 14 HA ALA 14 -1.593 -8.763 4.546
98 1HB ALA 14 1HB ALA 14 -0.630 -10.663 6.655
99 2HB ALA 14 2HB ALA 14 -2.056 -11.023 5.683
100 3HB ALA 14 3HB ALA 14 -2.017 -9.574 6.688
101 H ASN 15 H ASN 15 0.200 -7.416 3.804
102 HA ASN 15 HA ASN 15 1.974 -6.773 6.021
103 1HB ASN 15 2HB ASN 15 3.077 -8.378 4.255
104 2HB ASN 15 1HB ASN 15 3.217 -6.905 3.299
105 1HD2 ASN 15 1HD2 ASN 15 5.425 -6.813 3.387
106 2HD2 ASN 15 2HD2 ASN 15 6.300 -6.463 4.835
107 H VAL 16 H VAL 16 1.967 -4.650 6.347
108 HA VAL 16 HA VAL 16 0.592 -2.883 4.598
109 HB VAL 16 HB VAL 16 0.646 -2.541 7.034
110 1HG1 VAL 16 1HG1 VAL 16 3.439 -1.490 6.812
111 2HG1 VAL 16 2HG1 VAL 16 3.151 -3.203 7.118
112 3HG1 VAL 16 3HG1 VAL 16 2.542 -1.993 8.245
113 1HG2 VAL 16 1HG2 VAL 16 0.026 -0.533 6.238
114 2HG2 VAL 16 2HG2 VAL 16 1.341 -0.480 5.064
115 3HG2 VAL 16 3HG2 VAL 16 1.638 -0.027 6.743
116 H ALA 17 H ALA 17 4.012 -3.441 5.311
117 HA ALA 17 HA ALA 17 5.092 -1.307 3.869
118 1HB ALA 17 1HB ALA 17 6.122 -3.968 4.736
119 2HB ALA 17 2HB ALA 17 6.652 -2.350 5.195
120 3HB ALA 17 3HB ALA 17 7.077 -3.001 3.612
121 H ALA 18 H ALA 18 4.371 -4.627 2.824
122 HA ALA 18 HA ALA 18 5.315 -4.431 0.206
123 1HB ALA 18 1HB ALA 18 3.680 -6.282 -0.272
124 2HB ALA 18 2HB ALA 18 3.111 -6.106 1.388
125 3HB ALA 18 3HB ALA 18 4.783 -6.575 1.073
126 H HIS 19 H HIS 19 2.550 -3.005 1.664
127 HA HIS 19 HA HIS 19 1.156 -2.601 -0.847
128 1HB HIS 19 2HB HIS 19 -0.397 -2.920 0.835
129 2HB HIS 19 1HB HIS 19 0.573 -2.080 2.036
130 HD2 HIS 19 2HD HIS 19 -0.565 0.217 2.741
131 HE1 HIS 19 1HE HIS 19 -2.486 1.064 -0.935
132 HE2 HIS 19 2HE HIS 19 -1.954 1.938 1.386
133 H ILE 20 H ILE 20 2.202 -0.368 1.734
134 HA ILE 20 HA ILE 20 2.084 1.942 0.163
135 HB ILE 20 HB ILE 20 2.144 1.981 2.619
136 1HG1 ILE 20 2HG1 ILE 20 4.562 3.549 1.919
137 2HG1 ILE 20 1HG1 ILE 20 3.131 3.841 0.936
138 1HG2 ILE 20 1HG2 ILE 20 4.194 0.245 2.460
139 2HG2 ILE 20 2HG2 ILE 20 3.841 1.217 3.889
140 3HG2 ILE 20 3HG2 ILE 20 5.076 1.745 2.747
141 1HD1 ILE 20 1HD1 ILE 20 2.689 3.816 3.841
142 2HD1 ILE 20 2HD1 ILE 20 2.047 4.890 2.598
143 3HD1 ILE 20 3HD1 ILE 20 3.679 5.138 3.220
144 H THR 21 H THR 21 4.491 -0.532 0.284
145 HA THR 21 HA THR 21 6.827 0.750 -0.366
146 HB THR 21 HB THR 21 6.745 -1.649 -0.025
147 HG1 THR 21 1HG THR 21 8.496 -1.086 -1.215
148 1HG2 THR 21 1HG2 THR 21 5.668 -3.186 -1.309
149 2HG2 THR 21 2HG2 THR 21 5.685 -2.164 -2.746
150 3HG2 THR 21 3HG2 THR 21 4.544 -1.833 -1.442
151 H HIS 22 H HIS 22 4.264 -0.247 -2.618
152 HA HIS 22 HA HIS 22 5.520 1.435 -4.681
153 1HB HIS 22 2HB HIS 22 4.266 0.119 -6.322
154 2HB HIS 22 1HB HIS 22 5.261 -0.924 -5.312
155 HD1 HIS 22 1HD HIS 22 4.066 -2.618 -3.824
156 HD2 HIS 22 2HD HIS 22 1.475 -0.127 -5.909
157 HE1 HIS 22 1HE HIS 22 1.782 -3.631 -3.536
158 HE2 HIS 22 2HE HIS 22 0.247 -2.161 -4.887
159 H CYS 23 H CYS 23 2.636 0.893 -2.813
160 HA CYS 23 HA CYS 23 1.005 2.694 -4.361
161 1HB CYS 23 2HB CYS 23 0.611 1.228 -1.761
162 2HB CYS 23 1HB CYS 23 -0.555 2.413 -2.334
163 H TYR 24 H TYR 24 0.559 4.800 -3.959
164 HA TYR 24 HA TYR 24 1.473 6.034 -1.485
165 1HB TYR 24 2HB TYR 24 2.691 6.497 -4.157
166 2HB TYR 24 1HB TYR 24 2.420 7.913 -3.147
167 HD1 TYR 24 1HD TYR 24 3.076 7.212 -0.504
168 HD2 TYR 24 2HD TYR 24 4.882 5.803 -4.088
169 HE1 TYR 24 1HE TYR 24 5.144 6.726 0.736
170 HE2 TYR 24 2HE TYR 24 6.954 5.312 -2.859
171 HH TYR 24 HH TYR 24 7.114 5.356 0.566
172 H LYS 25 H LYS 25 0.155 6.759 -4.718
173 HA LYS 25 HA LYS 25 -2.314 7.691 -3.750
174 1HB LYS 25 2HB LYS 25 -2.037 10.114 -4.264
175 2HB LYS 25 1HB LYS 25 -1.112 9.577 -2.868
176 1HG LYS 25 2HG LYS 25 0.806 9.293 -4.621
177 2HG LYS 25 1HG LYS 25 -0.164 10.432 -5.557
178 1HD LYS 25 2HD LYS 25 1.296 11.802 -4.356
179 2HD LYS 25 1HD LYS 25 -0.194 11.849 -3.412
180 1HE LYS 25 2HE LYS 25 0.758 10.014 -1.994
181 2HE LYS 25 1HE LYS 25 2.282 10.225 -2.856
182 1HZ LYS 25 1HZ LYS 25 1.026 12.576 -1.632
183 2HZ LYS 25 2HZ LYS 25 2.664 12.235 -1.875
184 3HZ LYS 25 3HZ LYS 25 1.820 11.472 -0.625
Start of MODEL 3
1 1H PHE 1 1HT PHE 1 -2.346 2.517 5.161
2 2H PHE 1 2HT PHE 1 -3.867 2.176 4.442
3 3H PHE 1 3HT PHE 1 -2.434 2.109 3.499
4 HA PHE 1 HA PHE 1 -1.645 0.330 4.977
5 1HB PHE 1 2HB PHE 1 -4.547 0.368 5.839
6 2HB PHE 1 1HB PHE 1 -3.323 -0.788 6.354
7 HD1 PHE 1 1HD PHE 1 -1.814 -0.282 8.104
8 HD2 PHE 1 2HD PHE 1 -4.391 2.733 6.564
9 HE1 PHE 1 1HE PHE 1 -1.232 1.176 9.998
10 HE2 PHE 1 2HE PHE 1 -3.814 4.198 8.455
11 HZ PHE 1 HZ PHE 1 -2.232 3.420 10.175
12 H VAL 2 H VAL 2 -1.876 -1.801 4.195
13 HA VAL 2 HA VAL 2 -2.725 -2.046 1.546
14 HB VAL 2 HB VAL 2 -1.047 -3.529 2.558
15 1HG1 VAL 2 1HG1 VAL 2 -3.162 -5.195 3.821
16 2HG1 VAL 2 2HG1 VAL 2 -2.591 -3.767 4.683
17 3HG1 VAL 2 3HG1 VAL 2 -1.454 -5.035 4.228
18 1HG2 VAL 2 1HG2 VAL 2 -1.996 -4.303 0.525
19 2HG2 VAL 2 2HG2 VAL 2 -3.462 -4.849 1.339
20 3HG2 VAL 2 3HG2 VAL 2 -1.936 -5.690 1.614
21 H SER 3 H SER 3 -4.367 -2.795 4.567
22 HA SER 3 HA SER 3 -6.523 -4.251 3.531
23 1HB SER 3 2HB SER 3 -5.991 -2.730 6.030
24 2HB SER 3 1HB SER 3 -7.677 -3.082 5.654
25 HG SER 3 HG SER 3 -7.334 -5.066 6.223
26 H THR 4 H THR 4 -5.875 -0.828 3.607
27 HA THR 4 HA THR 4 -8.547 -0.292 2.499
28 HB THR 4 HB THR 4 -6.680 1.867 3.408
29 HG1 THR 4 1HG THR 4 -6.785 1.177 5.367
30 1HG2 THR 4 1HG2 THR 4 -8.797 2.483 2.318
31 2HG2 THR 4 2HG2 THR 4 -8.693 3.040 3.989
32 3HG2 THR 4 3HG2 THR 4 -9.671 1.628 3.588
33 H CYS 5 H CYS 5 -6.138 -1.351 1.064
34 HA CYS 5 HA CYS 5 -5.043 0.681 -0.562
35 1HB CYS 5 2HB CYS 5 -3.998 -1.529 -0.314
36 2HB CYS 5 1HB CYS 5 -5.360 -2.272 -1.146
37 H TYR 6 H TYR 6 -5.438 1.068 -2.832
38 HA TYR 6 HA TYR 6 -8.286 0.769 -3.506
39 1HB TYR 6 2HB TYR 6 -7.986 2.735 -4.954
40 2HB TYR 6 1HB TYR 6 -7.554 3.089 -3.285
41 HD1 TYR 6 1HD TYR 6 -6.314 2.720 -6.700
42 HD2 TYR 6 2HD TYR 6 -5.222 3.466 -2.656
43 HE1 TYR 6 1HE TYR 6 -4.119 3.537 -7.450
44 HE2 TYR 6 2HE TYR 6 -3.025 4.286 -3.394
45 HH TYR 6 HH TYR 6 -1.518 3.881 -5.492
46 H LEU 7 H LEU 7 -5.040 0.729 -4.959
47 HA LEU 7 HA LEU 7 -6.033 -0.411 -7.416
48 1HB LEU 7 2HB LEU 7 -3.703 -0.436 -8.118
49 2HB LEU 7 1HB LEU 7 -4.140 1.127 -7.452
50 HG LEU 7 HG LEU 7 -3.117 0.145 -5.242
51 1HD1 LEU 7 1HD1 LEU 7 -2.468 -1.989 -5.589
52 2HD1 LEU 7 2HD1 LEU 7 -1.020 -1.210 -6.225
53 3HD1 LEU 7 3HD1 LEU 7 -2.278 -1.764 -7.328
54 1HD2 LEU 7 1HD2 LEU 7 -1.893 1.450 -7.587
55 2HD2 LEU 7 2HD2 LEU 7 -0.776 0.789 -6.393
56 3HD2 LEU 7 3HD2 LEU 7 -1.983 1.980 -5.907
57 HA PRO 8 HA PRO 8 -5.693 -4.662 -6.265
58 1HB PRO 8 2HB PRO 8 -5.335 -5.804 -8.692
59 2HB PRO 8 1HB PRO 8 -6.881 -5.116 -8.186
60 1HG PRO 8 2HG PRO 8 -4.756 -3.923 -9.926
61 2HG PRO 8 1HG PRO 8 -6.517 -3.910 -10.141
62 1HD PRO 8 2HD PRO 8 -5.143 -1.794 -9.143
63 2HD PRO 8 1HD PRO 8 -6.811 -2.168 -8.666
64 H LYS 9 H LYS 9 -4.234 -6.665 -7.267
65 HA LYS 9 HA LYS 9 -2.192 -7.663 -7.175
66 1HB LYS 9 2HB LYS 9 -1.972 -5.820 -9.102
67 2HB LYS 9 1HB LYS 9 -0.773 -5.180 -7.988
68 1HG LYS 9 2HG LYS 9 0.524 -6.540 -9.290
69 2HG LYS 9 1HG LYS 9 0.101 -7.644 -7.978
70 1HD LYS 9 2HD LYS 9 -1.170 -8.946 -9.314
71 2HD LYS 9 1HD LYS 9 -1.796 -7.573 -10.230
72 1HE LYS 9 2HE LYS 9 0.782 -7.553 -11.024
73 2HE LYS 9 1HE LYS 9 0.559 -9.276 -10.727
74 1HZ LYS 9 1HZ LYS 9 0.036 -8.440 -13.038
75 2HZ LYS 9 2HZ LYS 9 -1.336 -7.710 -12.372
76 3HZ LYS 9 3HZ LYS 9 -1.154 -9.390 -12.299
77 H CYS 10 H CYS 10 -3.197 -6.240 -4.845
78 HA CYS 10 HA CYS 10 -0.630 -5.769 -3.485
79 1HB CYS 10 2HB CYS 10 -2.731 -3.902 -3.853
80 2HB CYS 10 1HB CYS 10 -2.745 -4.359 -2.153
81 H ALA 11 H ALA 11 -0.822 -6.031 -1.073
82 HA ALA 11 HA ALA 11 -1.251 -7.349 0.732
83 1HB ALA 11 1HB ALA 11 -3.406 -7.427 1.399
84 2HB ALA 11 2HB ALA 11 -3.969 -8.092 -0.135
85 3HB ALA 11 3HB ALA 11 -3.648 -6.363 0.012
86 H ALA 12 H ALA 12 0.201 -8.979 0.163
87 HA ALA 12 HA ALA 12 -0.966 -11.332 -1.168
88 1HB ALA 12 1HB ALA 12 0.870 -10.743 -2.452
89 2HB ALA 12 2HB ALA 12 1.535 -11.974 -1.378
90 3HB ALA 12 3HB ALA 12 1.827 -10.266 -1.049
91 H ALA 13 H ALA 13 0.678 -10.176 1.690
92 HA ALA 13 HA ALA 13 0.003 -12.667 3.051
93 1HB ALA 13 1HB ALA 13 2.466 -12.570 2.116
94 2HB ALA 13 2HB ALA 13 2.115 -13.251 3.704
95 3HB ALA 13 3HB ALA 13 2.733 -11.605 3.568
96 H ALA 14 H ALA 14 -1.094 -10.020 3.175
97 HA ALA 14 HA ALA 14 -1.808 -8.492 4.703
98 1HB ALA 14 1HB ALA 14 -2.242 -9.261 6.815
99 2HB ALA 14 2HB ALA 14 -0.682 -10.071 6.960
100 3HB ALA 14 3HB ALA 14 -1.961 -10.788 5.979
101 H ASN 15 H ASN 15 0.886 -8.276 3.604
102 HA ASN 15 HA ASN 15 2.395 -7.066 5.798
103 1HB ASN 15 2HB ASN 15 3.075 -8.055 3.070
104 2HB ASN 15 1HB ASN 15 4.057 -6.757 3.742
105 1HD2 ASN 15 1HD2 ASN 15 5.855 -7.539 4.545
106 2HD2 ASN 15 2HD2 ASN 15 6.016 -8.989 5.469
107 H VAL 16 H VAL 16 1.880 -5.022 6.225
108 HA VAL 16 HA VAL 16 0.571 -3.264 4.481
109 HB VAL 16 HB VAL 16 0.562 -2.969 6.918
110 1HG1 VAL 16 1HG1 VAL 16 3.352 -1.877 6.720
111 2HG1 VAL 16 2HG1 VAL 16 3.034 -3.563 7.130
112 3HG1 VAL 16 3HG1 VAL 16 2.422 -2.272 8.166
113 1HG2 VAL 16 1HG2 VAL 16 0.597 -0.606 6.938
114 2HG2 VAL 16 2HG2 VAL 16 0.158 -1.070 5.294
115 3HG2 VAL 16 3HG2 VAL 16 1.802 -0.538 5.652
116 H ALA 17 H ALA 17 4.001 -3.714 5.193
117 HA ALA 17 HA ALA 17 5.011 -1.477 3.857
118 1HB ALA 17 1HB ALA 17 6.257 -4.194 4.259
119 2HB ALA 17 2HB ALA 17 6.408 -2.792 5.317
120 3HB ALA 17 3HB ALA 17 7.123 -2.761 3.707
121 H ALA 18 H ALA 18 4.349 -4.752 2.661
122 HA ALA 18 HA ALA 18 5.319 -4.435 0.063
123 1HB ALA 18 1HB ALA 18 3.104 -6.176 1.127
124 2HB ALA 18 2HB ALA 18 4.791 -6.618 0.860
125 3HB ALA 18 3HB ALA 18 3.737 -6.288 -0.515
126 H HIS 19 H HIS 19 2.538 -3.088 1.555
127 HA HIS 19 HA HIS 19 1.150 -2.600 -0.945
128 1HB HIS 19 2HB HIS 19 -0.406 -2.986 0.723
129 2HB HIS 19 1HB HIS 19 0.556 -2.180 1.954
130 HD2 HIS 19 2HD HIS 19 -0.573 0.101 2.722
131 HE1 HIS 19 1HE HIS 19 -2.525 1.034 -0.915
132 HE2 HIS 19 2HE HIS 19 -1.979 1.851 1.422
133 H ILE 20 H ILE 20 2.155 -0.445 1.718
134 HA ILE 20 HA ILE 20 2.035 1.914 0.229
135 HB ILE 20 HB ILE 20 2.086 1.879 2.679
136 1HG1 ILE 20 2HG1 ILE 20 4.517 3.446 1.932
137 2HG1 ILE 20 1HG1 ILE 20 2.999 3.822 1.125
138 1HG2 ILE 20 1HG2 ILE 20 3.562 0.460 3.587
139 2HG2 ILE 20 2HG2 ILE 20 4.696 1.803 3.452
140 3HG2 ILE 20 3HG2 ILE 20 4.654 0.556 2.205
141 1HD1 ILE 20 1HD1 ILE 20 1.998 4.552 3.072
142 2HD1 ILE 20 2HD1 ILE 20 3.658 5.118 3.251
143 3HD1 ILE 20 3HD1 ILE 20 3.124 3.670 4.103
144 H THR 21 H THR 21 4.458 -0.549 0.265
145 HA THR 21 HA THR 21 6.784 0.779 -0.339
146 HB THR 21 HB THR 21 6.714 -1.634 -0.059
147 HG1 THR 21 1HG THR 21 8.477 -1.007 -1.203
148 1HG2 THR 21 1HG2 THR 21 5.678 -3.142 -1.412
149 2HG2 THR 21 2HG2 THR 21 5.701 -2.071 -2.813
150 3HG2 THR 21 3HG2 THR 21 4.539 -1.798 -1.515
151 H HIS 22 H HIS 22 4.224 -0.171 -2.613
152 HA HIS 22 HA HIS 22 5.469 1.576 -4.629
153 1HB HIS 22 2HB HIS 22 4.235 0.290 -6.310
154 2HB HIS 22 1HB HIS 22 5.242 -0.768 -5.327
155 HD1 HIS 22 1HD HIS 22 4.061 -2.503 -3.864
156 HD2 HIS 22 2HD HIS 22 1.453 -0.022 -5.937
157 HE1 HIS 22 1HE HIS 22 1.792 -3.557 -3.618
158 HE2 HIS 22 2HE HIS 22 0.248 -2.093 -4.965
159 H CYS 23 H CYS 23 2.578 0.933 -2.798
160 HA CYS 23 HA CYS 23 0.928 2.755 -4.298
161 1HB CYS 23 2HB CYS 23 0.560 1.205 -1.747
162 2HB CYS 23 1HB CYS 23 -0.612 2.413 -2.253
163 H TYR 24 H TYR 24 0.480 4.850 -3.867
164 HA TYR 24 HA TYR 24 1.117 6.074 -1.349
165 1HB TYR 24 2HB TYR 24 2.933 6.356 -3.686
166 2HB TYR 24 1HB TYR 24 2.582 7.816 -2.767
167 HD1 TYR 24 1HD TYR 24 2.537 7.060 -0.033
168 HD2 TYR 24 2HD TYR 24 5.011 5.531 -3.138
169 HE1 TYR 24 1HE TYR 24 4.226 6.417 1.636
170 HE2 TYR 24 2HE TYR 24 6.706 4.884 -1.477
171 HH TYR 24 HH TYR 24 6.104 4.716 1.795
172 H LYS 25 H LYS 25 0.468 6.678 -4.790
173 HA LYS 25 HA LYS 25 -1.965 8.022 -4.264
174 1HB LYS 25 2HB LYS 25 -1.263 10.277 -5.105
175 2HB LYS 25 1HB LYS 25 -0.627 9.862 -3.518
176 1HG LYS 25 2HG LYS 25 1.508 9.219 -4.586
177 2HG LYS 25 1HG LYS 25 0.859 9.764 -6.134
178 1HD LYS 25 2HD LYS 25 2.050 11.617 -5.416
179 2HD LYS 25 1HD LYS 25 0.413 11.990 -4.874
180 1HE LYS 25 2HE LYS 25 2.347 10.574 -3.076
181 2HE LYS 25 1HE LYS 25 2.382 12.329 -3.236
182 1HZ LYS 25 1HZ LYS 25 -0.207 11.936 -2.807
183 2HZ LYS 25 2HZ LYS 25 0.904 12.197 -1.560
184 3HZ LYS 25 3HZ LYS 25 0.418 10.623 -1.942
Start of MODEL 4
1 1H PHE 1 1HT PHE 1 -1.527 2.081 5.512
2 2H PHE 1 2HT PHE 1 -2.392 2.094 4.029
3 3H PHE 1 3HT PHE 1 -0.870 1.307 4.131
4 HA PHE 1 HA PHE 1 -1.738 -0.300 5.612
5 1HB PHE 1 2HB PHE 1 -4.234 1.385 5.359
6 2HB PHE 1 1HB PHE 1 -4.243 -0.251 6.011
7 HD1 PHE 1 1HD PHE 1 -3.759 3.204 6.723
8 HD2 PHE 1 2HD PHE 1 -2.771 -0.720 8.039
9 HE1 PHE 1 1HE PHE 1 -3.195 4.097 8.945
10 HE2 PHE 1 2HE PHE 1 -2.206 0.165 10.266
11 HZ PHE 1 HZ PHE 1 -2.417 2.576 10.720
12 H VAL 2 H VAL 2 -1.977 -2.149 4.528
13 HA VAL 2 HA VAL 2 -2.384 -2.233 1.760
14 HB VAL 2 HB VAL 2 -1.184 -3.990 2.988
15 1HG1 VAL 2 1HG1 VAL 2 -3.804 -5.141 3.866
16 2HG1 VAL 2 2HG1 VAL 2 -2.953 -3.970 4.872
17 3HG1 VAL 2 3HG1 VAL 2 -2.177 -5.496 4.448
18 1HG2 VAL 2 1HG2 VAL 2 -1.992 -4.516 0.776
19 2HG2 VAL 2 2HG2 VAL 2 -3.575 -4.955 1.421
20 3HG2 VAL 2 3HG2 VAL 2 -2.161 -5.936 1.808
21 H SER 3 H SER 3 -4.603 -2.872 4.443
22 HA SER 3 HA SER 3 -6.774 -3.810 2.945
23 1HB SER 3 2HB SER 3 -6.310 -3.512 5.590
24 2HB SER 3 1HB SER 3 -7.396 -2.150 5.320
25 HG SER 3 HG SER 3 -7.880 -4.889 5.123
26 H THR 4 H THR 4 -5.623 -0.573 3.571
27 HA THR 4 HA THR 4 -7.976 0.765 2.666
28 HB THR 4 HB THR 4 -5.159 1.844 2.848
29 HG1 THR 4 1HG THR 4 -5.838 2.541 4.927
30 1HG2 THR 4 1HG2 THR 4 -7.622 3.062 2.069
31 2HG2 THR 4 2HG2 THR 4 -6.005 3.761 2.159
32 3HG2 THR 4 3HG2 THR 4 -7.051 3.773 3.579
33 H CYS 5 H CYS 5 -5.266 -0.673 1.108
34 HA CYS 5 HA CYS 5 -5.114 0.807 -1.251
35 1HB CYS 5 2HB CYS 5 -3.595 -1.096 -0.418
36 2HB CYS 5 1HB CYS 5 -4.760 -2.182 -1.168
37 H TYR 6 H TYR 6 -6.398 1.015 -2.969
38 HA TYR 6 HA TYR 6 -8.898 -0.467 -3.026
39 1HB TYR 6 2HB TYR 6 -9.419 1.114 -4.938
40 2HB TYR 6 1HB TYR 6 -9.148 1.874 -3.373
41 HD1 TYR 6 1HD TYR 6 -7.730 1.294 -6.719
42 HD2 TYR 6 2HD TYR 6 -7.268 3.326 -3.010
43 HE1 TYR 6 1HE TYR 6 -6.006 2.729 -7.727
44 HE2 TYR 6 2HE TYR 6 -5.544 4.768 -4.008
45 HH TYR 6 HH TYR 6 -3.871 4.505 -6.034
46 H LEU 7 H LEU 7 -6.087 0.086 -5.117
47 HA LEU 7 HA LEU 7 -7.029 -1.677 -7.169
48 1HB LEU 7 2HB LEU 7 -4.888 -1.318 -8.218
49 2HB LEU 7 1HB LEU 7 -5.517 0.211 -7.635
50 HG LEU 7 HG LEU 7 -4.014 -0.366 -5.530
51 1HD1 LEU 7 1HD1 LEU 7 -3.006 -2.358 -5.922
52 2HD1 LEU 7 2HD1 LEU 7 -1.836 -1.316 -6.732
53 3HD1 LEU 7 3HD1 LEU 7 -3.059 -2.168 -7.675
54 1HD2 LEU 7 1HD2 LEU 7 -3.469 1.624 -6.472
55 2HD2 LEU 7 2HD2 LEU 7 -3.431 0.967 -8.108
56 3HD2 LEU 7 3HD2 LEU 7 -2.072 0.696 -7.017
57 HA PRO 8 HA PRO 8 -5.606 -5.482 -5.406
58 1HB PRO 8 2HB PRO 8 -5.559 -7.030 -7.611
59 2HB PRO 8 1HB PRO 8 -7.073 -6.476 -6.884
60 1HG PRO 8 2HG PRO 8 -5.601 -5.392 -9.255
61 2HG PRO 8 1HG PRO 8 -7.340 -5.670 -9.050
62 1HD PRO 8 2HD PRO 8 -6.174 -3.221 -8.775
63 2HD PRO 8 1HD PRO 8 -7.646 -3.701 -7.908
64 H LYS 9 H LYS 9 -4.013 -7.380 -6.398
65 HA LYS 9 HA LYS 9 -1.841 -7.993 -6.673
66 1HB LYS 9 2HB LYS 9 -1.473 -5.456 -8.258
67 2HB LYS 9 1HB LYS 9 -0.593 -6.970 -8.420
68 1HG LYS 9 2HG LYS 9 -2.718 -8.039 -9.170
69 2HG LYS 9 1HG LYS 9 -3.457 -6.436 -9.172
70 1HD LYS 9 2HD LYS 9 -2.778 -6.387 -11.318
71 2HD LYS 9 1HD LYS 9 -1.212 -5.968 -10.620
72 1HE LYS 9 2HE LYS 9 -0.572 -7.710 -11.941
73 2HE LYS 9 1HE LYS 9 -0.982 -8.600 -10.476
74 1HZ LYS 9 1HZ LYS 9 -1.903 -9.460 -12.665
75 2HZ LYS 9 2HZ LYS 9 -2.967 -8.146 -12.619
76 3HZ LYS 9 3HZ LYS 9 -2.998 -9.301 -11.383
77 H CYS 10 H CYS 10 -2.487 -6.534 -4.344
78 HA CYS 10 HA CYS 10 0.139 -5.366 -3.764
79 1HB CYS 10 2HB CYS 10 -2.081 -3.780 -4.077
80 2HB CYS 10 1HB CYS 10 -2.072 -4.060 -2.339
81 H ALA 11 H ALA 11 -2.939 -6.478 -2.372
82 HA ALA 11 HA ALA 11 -1.599 -7.197 0.111
83 1HB ALA 11 1HB ALA 11 -3.682 -7.344 1.083
84 2HB ALA 11 2HB ALA 11 -4.475 -7.786 -0.429
85 3HB ALA 11 3HB ALA 11 -3.960 -6.121 -0.157
86 H ALA 12 H ALA 12 -0.319 -8.952 -0.366
87 HA ALA 12 HA ALA 12 -1.661 -11.331 -1.457
88 1HB ALA 12 1HB ALA 12 0.557 -10.251 -2.416
89 2HB ALA 12 2HB ALA 12 0.304 -11.997 -2.403
90 3HB ALA 12 3HB ALA 12 1.292 -11.240 -1.154
91 H ALA 13 H ALA 13 0.148 -10.085 1.263
92 HA ALA 13 HA ALA 13 -0.607 -12.458 2.799
93 1HB ALA 13 1HB ALA 13 1.798 -12.170 3.863
94 2HB ALA 13 2HB ALA 13 2.169 -11.549 2.254
95 3HB ALA 13 3HB ALA 13 1.527 -13.181 2.444
96 H ALA 14 H ALA 14 -1.535 -9.677 2.691
97 HA ALA 14 HA ALA 14 -2.174 -8.010 4.103
98 1HB ALA 14 1HB ALA 14 -2.604 -10.248 5.455
99 2HB ALA 14 2HB ALA 14 -2.856 -8.660 6.177
100 3HB ALA 14 3HB ALA 14 -1.373 -9.553 6.509
101 H ASN 15 H ASN 15 0.603 -8.125 3.196
102 HA ASN 15 HA ASN 15 2.139 -7.074 5.431
103 1HB ASN 15 2HB ASN 15 2.864 -8.558 3.259
104 2HB ASN 15 1HB ASN 15 3.312 -6.939 2.730
105 1HD2 ASN 15 1HD2 ASN 15 5.362 -6.548 3.083
106 2HD2 ASN 15 2HD2 ASN 15 6.280 -7.052 4.456
107 H VAL 16 H VAL 16 1.796 -5.025 5.978
108 HA VAL 16 HA VAL 16 0.660 -3.070 4.300
109 HB VAL 16 HB VAL 16 0.550 -2.936 6.749
110 1HG1 VAL 16 1HG1 VAL 16 2.458 -2.258 8.071
111 2HG1 VAL 16 2HG1 VAL 16 3.475 -2.214 6.631
112 3HG1 VAL 16 3HG1 VAL 16 2.831 -3.751 7.208
113 1HG2 VAL 16 1HG2 VAL 16 0.263 -0.913 5.353
114 2HG2 VAL 16 2HG2 VAL 16 1.976 -0.553 5.572
115 3HG2 VAL 16 3HG2 VAL 16 0.890 -0.557 6.961
116 H ALA 17 H ALA 17 4.013 -3.795 5.154
117 HA ALA 17 HA ALA 17 5.233 -1.559 4.007
118 1HB ALA 17 1HB ALA 17 6.210 -4.362 4.473
119 2HB ALA 17 2HB ALA 17 6.558 -2.907 5.408
120 3HB ALA 17 3HB ALA 17 7.241 -3.103 3.793
121 H ALA 18 H ALA 18 4.607 -4.764 2.586
122 HA ALA 18 HA ALA 18 5.679 -4.270 0.058
123 1HB ALA 18 1HB ALA 18 3.281 -5.980 0.146
124 2HB ALA 18 2HB ALA 18 4.586 -6.425 1.246
125 3HB ALA 18 3HB ALA 18 4.893 -6.313 -0.487
126 H HIS 19 H HIS 19 2.799 -3.078 1.502
127 HA HIS 19 HA HIS 19 1.536 -2.435 -1.030
128 1HB HIS 19 2HB HIS 19 -0.115 -2.973 0.486
129 2HB HIS 19 1HB HIS 19 0.763 -2.291 1.848
130 HD2 HIS 19 2HD HIS 19 -0.414 -0.091 2.769
131 HE1 HIS 19 1HE HIS 19 -2.206 1.165 -0.853
132 HE2 HIS 19 2HE HIS 19 -2.058 1.572 1.646
133 H ILE 20 H ILE 20 2.406 -0.504 1.844
134 HA ILE 20 HA ILE 20 2.273 1.980 0.567
135 HB ILE 20 HB ILE 20 2.254 1.717 3.009
136 1HG1 ILE 20 2HG1 ILE 20 3.709 3.638 3.546
137 2HG1 ILE 20 1HG1 ILE 20 4.511 3.458 1.989
138 1HG2 ILE 20 1HG2 ILE 20 4.251 1.263 4.263
139 2HG2 ILE 20 2HG2 ILE 20 5.214 1.200 2.787
140 3HG2 ILE 20 3HG2 ILE 20 4.001 -0.042 3.104
141 1HD1 ILE 20 1HD1 ILE 20 1.719 3.637 1.529
142 2HD1 ILE 20 2HD1 ILE 20 2.994 4.761 1.059
143 3HD1 ILE 20 3HD1 ILE 20 2.191 4.940 2.619
144 H THR 21 H THR 21 4.696 -0.451 0.395
145 HA THR 21 HA THR 21 7.046 0.915 0.025
146 HB THR 21 HB THR 21 6.893 -1.529 -0.008
147 HG1 THR 21 1HG THR 21 8.680 -1.517 -1.078
148 1HG2 THR 21 1HG2 THR 21 5.999 -2.806 -1.690
149 2HG2 THR 21 2HG2 THR 21 6.056 -1.493 -2.865
150 3HG2 THR 21 3HG2 THR 21 4.837 -1.483 -1.591
151 H HIS 22 H HIS 22 4.543 0.298 -2.423
152 HA HIS 22 HA HIS 22 5.851 2.300 -4.143
153 1HB HIS 22 2HB HIS 22 4.728 1.223 -6.038
154 2HB HIS 22 1HB HIS 22 5.729 0.071 -5.159
155 HD1 HIS 22 1HD HIS 22 4.580 -1.941 -4.146
156 HD2 HIS 22 2HD HIS 22 1.914 0.851 -5.686
157 HE1 HIS 22 1HE HIS 22 2.331 -3.067 -4.109
158 HE2 HIS 22 2HE HIS 22 0.752 -1.393 -5.135
159 H CYS 23 H CYS 23 2.879 1.346 -2.587
160 HA CYS 23 HA CYS 23 1.234 3.273 -3.925
161 1HB CYS 23 2HB CYS 23 0.865 1.458 -1.562
162 2HB CYS 23 1HB CYS 23 -0.317 2.714 -1.907
163 H TYR 24 H TYR 24 0.965 5.359 -3.463
164 HA TYR 24 HA TYR 24 1.591 6.349 -0.787
165 1HB TYR 24 2HB TYR 24 3.069 7.015 -3.274
166 2HB TYR 24 1HB TYR 24 2.696 8.355 -2.195
167 HD1 TYR 24 1HD TYR 24 4.158 8.834 -0.462
168 HD2 TYR 24 2HD TYR 24 4.162 4.920 -2.130
169 HE1 TYR 24 1HE TYR 24 6.090 8.245 0.940
170 HE2 TYR 24 2HE TYR 24 6.094 4.320 -0.732
171 HH TYR 24 HH TYR 24 7.186 6.301 1.844
172 H LYS 25 H LYS 25 1.037 8.792 -0.694
173 HA LYS 25 HA LYS 25 -0.574 10.395 -0.769
174 1HB LYS 25 2HB LYS 25 -0.527 9.386 -3.581
175 2HB LYS 25 1HB LYS 25 -1.804 10.496 -3.103
176 1HG LYS 25 2HG LYS 25 1.011 11.207 -2.460
177 2HG LYS 25 1HG LYS 25 0.449 11.366 -4.126
178 1HD LYS 25 2HD LYS 25 -0.889 13.119 -3.642
179 2HD LYS 25 1HD LYS 25 -1.351 12.465 -2.070
180 1HE LYS 25 2HE LYS 25 1.205 13.900 -2.769
181 2HE LYS 25 1HE LYS 25 -0.095 14.486 -1.732
182 1HZ LYS 25 1HZ LYS 25 1.255 13.692 -0.133
183 2HZ LYS 25 2HZ LYS 25 2.028 12.587 -1.153
184 3HZ LYS 25 3HZ LYS 25 0.512 12.217 -0.502
Start of MODEL 5
1 1H PHE 1 1HT PHE 1 -2.132 2.370 5.072
2 2H PHE 1 2HT PHE 1 -2.821 2.044 3.535
3 3H PHE 1 3HT PHE 1 -1.205 1.575 3.869
4 HA PHE 1 HA PHE 1 -1.845 -0.072 5.315
5 1HB PHE 1 2HB PHE 1 -4.336 1.548 5.390
6 2HB PHE 1 1HB PHE 1 -4.520 -0.191 5.601
7 HD1 PHE 1 1HD PHE 1 -4.506 2.609 7.412
8 HD2 PHE 1 2HD PHE 1 -2.309 -1.029 7.173
9 HE1 PHE 1 1HE PHE 1 -3.879 2.836 9.781
10 HE2 PHE 1 2HE PHE 1 -1.678 -0.808 9.541
11 HZ PHE 1 HZ PHE 1 -2.465 1.126 10.848
12 H VAL 2 H VAL 2 -1.687 -1.867 4.152
13 HA VAL 2 HA VAL 2 -2.491 -2.129 1.491
14 HB VAL 2 HB VAL 2 -0.741 -3.523 2.506
15 1HG1 VAL 2 1HG1 VAL 2 -1.420 -5.500 3.857
16 2HG1 VAL 2 2HG1 VAL 2 -3.042 -4.816 3.961
17 3HG1 VAL 2 3HG1 VAL 2 -1.675 -3.956 4.670
18 1HG2 VAL 2 1HG2 VAL 2 -1.812 -4.253 0.434
19 2HG2 VAL 2 2HG2 VAL 2 -3.026 -5.131 1.366
20 3HG2 VAL 2 3HG2 VAL 2 -1.337 -5.632 1.425
21 H SER 3 H SER 3 -4.177 -2.828 4.470
22 HA SER 3 HA SER 3 -6.221 -4.456 3.399
23 1HB SER 3 2HB SER 3 -5.675 -4.226 5.837
24 2HB SER 3 1HB SER 3 -6.424 -2.631 5.804
25 HG SER 3 HG SER 3 -7.610 -5.163 5.517
26 H THR 4 H THR 4 -5.757 -1.001 3.535
27 HA THR 4 HA THR 4 -8.422 -0.601 2.352
28 HB THR 4 HB THR 4 -6.693 1.590 3.473
29 HG1 THR 4 1HG THR 4 -6.937 0.623 5.321
30 1HG2 THR 4 1HG2 THR 4 -8.654 2.269 2.174
31 2HG2 THR 4 2HG2 THR 4 -8.787 2.722 3.873
32 3HG2 THR 4 3HG2 THR 4 -9.682 1.332 3.258
33 H CYS 5 H CYS 5 -5.965 -1.489 0.951
34 HA CYS 5 HA CYS 5 -4.875 0.641 -0.548
35 1HB CYS 5 2HB CYS 5 -3.759 -1.525 -0.387
36 2HB CYS 5 1HB CYS 5 -5.095 -2.299 -1.232
37 H TYR 6 H TYR 6 -5.207 1.117 -2.808
38 HA TYR 6 HA TYR 6 -8.040 0.969 -3.524
39 1HB TYR 6 2HB TYR 6 -7.498 2.758 -5.146
40 2HB TYR 6 1HB TYR 6 -7.070 3.197 -3.495
41 HD1 TYR 6 1HD TYR 6 -5.779 2.350 -6.816
42 HD2 TYR 6 2HD TYR 6 -4.746 3.434 -2.834
43 HE1 TYR 6 1HE TYR 6 -3.488 2.857 -7.555
44 HE2 TYR 6 2HE TYR 6 -2.453 3.944 -3.561
45 HH TYR 6 HH TYR 6 -0.923 3.316 -5.404
46 H LEU 7 H LEU 7 -4.833 0.412 -4.952
47 HA LEU 7 HA LEU 7 -6.001 -0.827 -7.295
48 1HB LEU 7 2HB LEU 7 -3.750 -1.028 -8.109
49 2HB LEU 7 1HB LEU 7 -3.975 0.581 -7.450
50 HG LEU 7 HG LEU 7 -2.931 -0.500 -5.285
51 1HD1 LEU 7 1HD1 LEU 7 -2.513 -2.684 -5.674
52 2HD1 LEU 7 2HD1 LEU 7 -1.031 -2.040 -6.381
53 3HD1 LEU 7 3HD1 LEU 7 -2.392 -2.465 -7.420
54 1HD2 LEU 7 1HD2 LEU 7 -1.704 1.246 -6.052
55 2HD2 LEU 7 2HD2 LEU 7 -1.699 0.659 -7.715
56 3HD2 LEU 7 3HD2 LEU 7 -0.611 -0.055 -6.523
57 HA PRO 8 HA PRO 8 -5.878 -4.942 -5.662
58 1HB PRO 8 2HB PRO 8 -6.038 -6.358 -7.945
59 2HB PRO 8 1HB PRO 8 -7.400 -5.412 -7.334
60 1HG PRO 8 2HG PRO 8 -5.431 -4.728 -9.482
61 2HG PRO 8 1HG PRO 8 -7.188 -4.492 -9.459
62 1HD PRO 8 2HD PRO 8 -5.393 -2.504 -8.918
63 2HD PRO 8 1HD PRO 8 -7.035 -2.551 -8.245
64 H LYS 9 H LYS 9 -4.711 -7.096 -6.120
65 HA LYS 9 HA LYS 9 -2.766 -8.273 -6.141
66 1HB LYS 9 2HB LYS 9 -2.412 -6.354 -8.399
67 2HB LYS 9 1HB LYS 9 -1.023 -7.300 -7.883
68 1HG LYS 9 2HG LYS 9 -3.519 -8.807 -8.299
69 2HG LYS 9 1HG LYS 9 -2.780 -8.111 -9.743
70 1HD LYS 9 2HD LYS 9 -0.733 -9.268 -9.344
71 2HD LYS 9 1HD LYS 9 -1.266 -9.779 -7.741
72 1HE LYS 9 2HE LYS 9 -1.371 -11.533 -9.556
73 2HE LYS 9 1HE LYS 9 -2.857 -11.275 -8.643
74 1HZ LYS 9 1HZ LYS 9 -3.177 -11.457 -11.079
75 2HZ LYS 9 2HZ LYS 9 -2.297 -10.026 -11.275
76 3HZ LYS 9 3HZ LYS 9 -3.761 -10.008 -10.428
77 H CYS 10 H CYS 10 -2.982 -6.472 -4.088
78 HA CYS 10 HA CYS 10 -0.212 -5.512 -3.795
79 1HB CYS 10 2HB CYS 10 -2.384 -3.882 -3.832
80 2HB CYS 10 1HB CYS 10 -2.278 -4.237 -2.111
81 H ALA 11 H ALA 11 -3.062 -6.780 -2.117
82 HA ALA 11 HA ALA 11 -1.399 -7.508 0.179
83 1HB ALA 11 1HB ALA 11 -4.272 -8.161 0.217
84 2HB ALA 11 2HB ALA 11 -3.875 -6.445 0.121
85 3HB ALA 11 3HB ALA 11 -3.256 -7.419 1.454
86 H ALA 12 H ALA 12 -0.315 -9.351 -0.203
87 HA ALA 12 HA ALA 12 -1.804 -11.628 -1.331
88 1HB ALA 12 1HB ALA 12 0.385 -10.652 -2.404
89 2HB ALA 12 2HB ALA 12 0.106 -12.392 -2.344
90 3HB ALA 12 3HB ALA 12 1.170 -11.629 -1.163
91 H ALA 13 H ALA 13 0.179 -10.532 1.332
92 HA ALA 13 HA ALA 13 -0.624 -12.895 2.853
93 1HB ALA 13 1HB ALA 13 2.210 -12.000 3.113
94 2HB ALA 13 2HB ALA 13 1.756 -13.069 1.785
95 3HB ALA 13 3HB ALA 13 1.489 -13.574 3.454
96 H ALA 14 H ALA 14 -1.396 -10.068 2.852
97 HA ALA 14 HA ALA 14 -1.870 -8.404 4.330
98 1HB ALA 14 1HB ALA 14 -2.406 -10.594 5.657
99 2HB ALA 14 2HB ALA 14 -2.396 -9.034 6.477
100 3HB ALA 14 3HB ALA 14 -1.008 -10.113 6.617
101 H ASN 15 H ASN 15 0.022 -7.293 3.436
102 HA ASN 15 HA ASN 15 1.990 -6.769 5.545
103 1HB ASN 15 2HB ASN 15 2.685 -8.281 3.396
104 2HB ASN 15 1HB ASN 15 3.057 -6.669 2.791
105 1HD2 ASN 15 1HD2 ASN 15 5.160 -6.393 2.948
106 2HD2 ASN 15 2HD2 ASN 15 6.130 -6.745 4.334
107 H VAL 16 H VAL 16 1.949 -4.684 6.023
108 HA VAL 16 HA VAL 16 0.627 -2.773 4.365
109 HB VAL 16 HB VAL 16 0.583 -2.606 6.819
110 1HG1 VAL 16 1HG1 VAL 16 3.400 -1.603 6.794
111 2HG1 VAL 16 2HG1 VAL 16 3.069 -3.327 6.960
112 3HG1 VAL 16 3HG1 VAL 16 2.431 -2.189 8.146
113 1HG2 VAL 16 1HG2 VAL 16 0.324 -0.611 5.286
114 2HG2 VAL 16 2HG2 VAL 16 1.990 -0.198 5.692
115 3HG2 VAL 16 3HG2 VAL 16 0.761 -0.252 6.956
116 H ALA 17 H ALA 17 4.010 -3.415 5.199
117 HA ALA 17 HA ALA 17 5.166 -1.207 3.938
118 1HB ALA 17 1HB ALA 17 6.339 -2.765 5.480
119 2HB ALA 17 2HB ALA 17 7.237 -2.423 4.001
120 3HB ALA 17 3HB ALA 17 6.382 -3.955 4.180
121 H ALA 18 H ALA 18 4.612 -4.489 2.669
122 HA ALA 18 HA ALA 18 5.632 -4.080 0.106
123 1HB ALA 18 1HB ALA 18 3.398 -5.911 0.975
124 2HB ALA 18 2HB ALA 18 5.120 -6.293 0.954
125 3HB ALA 18 3HB ALA 18 4.261 -6.009 -0.560
126 H HIS 19 H HIS 19 2.743 -2.899 1.542
127 HA HIS 19 HA HIS 19 1.419 -2.403 -0.990
128 1HB HIS 19 2HB HIS 19 -0.186 -2.894 0.590
129 2HB HIS 19 1HB HIS 19 0.708 -2.125 1.895
130 HD2 HIS 19 2HD HIS 19 -0.484 0.103 2.727
131 HE1 HIS 19 1HE HIS 19 -2.402 1.119 -0.907
132 HE2 HIS 19 2HE HIS 19 -1.920 1.861 1.470
133 H ILE 20 H ILE 20 2.289 -0.302 1.764
134 HA ILE 20 HA ILE 20 2.087 2.104 0.354
135 HB ILE 20 HB ILE 20 2.102 1.959 2.812
136 1HG1 ILE 20 2HG1 ILE 20 3.629 3.926 3.210
137 2HG1 ILE 20 1HG1 ILE 20 4.197 3.739 1.554
138 1HG2 ILE 20 1HG2 ILE 20 4.024 0.277 2.815
139 2HG2 ILE 20 2HG2 ILE 20 4.011 1.502 4.083
140 3HG2 ILE 20 3HG2 ILE 20 5.087 1.679 2.697
141 1HD1 ILE 20 1HD1 ILE 20 1.449 4.491 2.496
142 2HD1 ILE 20 2HD1 ILE 20 1.797 4.011 0.835
143 3HD1 ILE 20 3HD1 ILE 20 2.571 5.439 1.520
144 H THR 21 H THR 21 4.627 -0.246 0.407
145 HA THR 21 HA THR 21 6.903 1.178 -0.119
146 HB THR 21 HB THR 21 6.905 -1.246 0.083
147 HG1 THR 21 1HG THR 21 8.697 -0.645 -0.952
148 1HG2 THR 21 1HG2 THR 21 5.954 -2.737 -1.340
149 2HG2 THR 21 2HG2 THR 21 6.017 -1.637 -2.717
150 3HG2 THR 21 3HG2 THR 21 4.789 -1.420 -1.472
151 H HIS 22 H HIS 22 4.399 0.264 -2.465
152 HA HIS 22 HA HIS 22 5.650 2.105 -4.395
153 1HB HIS 22 2HB HIS 22 4.537 0.835 -6.159
154 2HB HIS 22 1HB HIS 22 5.524 -0.231 -5.166
155 HD1 HIS 22 1HD HIS 22 4.362 -2.156 -4.031
156 HD2 HIS 22 2HD HIS 22 1.707 0.563 -5.711
157 HE1 HIS 22 1HE HIS 22 2.098 -3.240 -3.872
158 HE2 HIS 22 2HE HIS 22 0.525 -1.621 -4.990
159 H CYS 23 H CYS 23 2.692 1.242 -2.742
160 HA CYS 23 HA CYS 23 1.024 3.047 -4.214
161 1HB CYS 23 2HB CYS 23 0.679 1.424 -1.709
162 2HB CYS 23 1HB CYS 23 -0.520 2.628 -2.163
163 H TYR 24 H TYR 24 0.558 5.132 -3.818
164 HA TYR 24 HA TYR 24 1.329 6.331 -1.270
165 1HB TYR 24 2HB TYR 24 2.564 6.928 -3.908
166 2HB TYR 24 1HB TYR 24 2.211 8.300 -2.863
167 HD1 TYR 24 1HD TYR 24 4.422 5.531 -3.498
168 HD2 TYR 24 2HD TYR 24 3.222 8.359 -0.555
169 HE1 TYR 24 1HE TYR 24 6.496 5.102 -2.248
170 HE2 TYR 24 2HE TYR 24 5.293 7.939 0.702
171 HH TYR 24 HH TYR 24 7.766 7.012 -0.081
172 H LYS 25 H LYS 25 -0.090 6.910 -4.477
173 HA LYS 25 HA LYS 25 -2.550 7.809 -3.462
174 1HB LYS 25 2HB LYS 25 -2.434 10.191 -3.971
175 2HB LYS 25 1HB LYS 25 -1.242 9.764 -2.751
176 1HG LYS 25 2HG LYS 25 0.420 9.604 -4.679
177 2HG LYS 25 1HG LYS 25 -0.801 10.443 -5.637
178 1HD LYS 25 2HD LYS 25 0.320 12.263 -4.873
179 2HD LYS 25 1HD LYS 25 -0.773 12.049 -3.504
180 1HE LYS 25 2HE LYS 25 1.764 10.533 -3.426
181 2HE LYS 25 1HE LYS 25 1.888 12.282 -3.247
182 1HZ LYS 25 1HZ LYS 25 0.274 10.439 -1.570
183 2HZ LYS 25 2HZ LYS 25 0.233 12.125 -1.443
184 3HZ LYS 25 3HZ LYS 25 1.660 11.286 -1.099
Start of MODEL 6
1 1H PHE 1 1HT PHE 1 -2.944 2.722 4.906
2 2H PHE 1 2HT PHE 1 -3.793 2.190 3.512
3 3H PHE 1 3HT PHE 1 -2.077 2.229 3.512
4 HA PHE 1 HA PHE 1 -1.906 0.476 4.962
5 1HB PHE 1 2HB PHE 1 -4.844 0.987 5.450
6 2HB PHE 1 1HB PHE 1 -4.027 -0.471 6.005
7 HD1 PHE 1 1HD PHE 1 -1.592 0.265 7.138
8 HD2 PHE 1 2HD PHE 1 -5.224 2.481 7.134
9 HE1 PHE 1 1HE PHE 1 -0.870 1.442 9.175
10 HE2 PHE 1 2HE PHE 1 -4.509 3.664 9.170
11 HZ PHE 1 HZ PHE 1 -2.330 3.145 10.192
12 H VAL 2 H VAL 2 -1.911 -1.611 4.210
13 HA VAL 2 HA VAL 2 -2.611 -2.082 1.545
14 HB VAL 2 HB VAL 2 -0.884 -3.372 2.726
15 1HG1 VAL 2 1HG1 VAL 2 -3.052 -4.972 4.042
16 2HG1 VAL 2 2HG1 VAL 2 -2.333 -3.570 4.835
17 3HG1 VAL 2 3HG1 VAL 2 -1.323 -4.946 4.391
18 1HG2 VAL 2 1HG2 VAL 2 -1.404 -5.556 1.777
19 2HG2 VAL 2 2HG2 VAL 2 -1.884 -4.265 0.676
20 3HG2 VAL 2 3HG2 VAL 2 -3.102 -5.102 1.637
21 H SER 3 H SER 3 -4.276 -2.940 4.548
22 HA SER 3 HA SER 3 -6.313 -4.504 3.427
23 1HB SER 3 2HB SER 3 -5.937 -3.024 5.983
24 2HB SER 3 1HB SER 3 -7.580 -3.511 5.564
25 HG SER 3 HG SER 3 -6.693 -5.193 6.682
26 H THR 4 H THR 4 -5.888 -1.051 3.617
27 HA THR 4 HA THR 4 -8.579 -0.650 2.497
28 HB THR 4 HB THR 4 -6.813 1.543 3.553
29 HG1 THR 4 1HG THR 4 -6.971 0.210 5.287
30 1HG2 THR 4 1HG2 THR 4 -8.756 2.317 2.378
31 2HG2 THR 4 2HG2 THR 4 -8.970 2.594 4.107
32 3HG2 THR 4 3HG2 THR 4 -9.796 1.249 3.320
33 H CYS 5 H CYS 5 -6.084 -1.509 1.061
34 HA CYS 5 HA CYS 5 -5.120 0.638 -0.499
35 1HB CYS 5 2HB CYS 5 -3.925 -1.500 -0.297
36 2HB CYS 5 1HB CYS 5 -5.223 -2.312 -1.165
37 H TYR 6 H TYR 6 -5.520 1.058 -2.760
38 HA TYR 6 HA TYR 6 -8.341 0.616 -3.459
39 1HB TYR 6 2HB TYR 6 -8.076 2.588 -4.941
40 2HB TYR 6 1HB TYR 6 -7.754 2.959 -3.250
41 HD1 TYR 6 1HD TYR 6 -6.350 2.748 -6.599
42 HD2 TYR 6 2HD TYR 6 -5.443 3.364 -2.488
43 HE1 TYR 6 1HE TYR 6 -4.161 3.674 -7.228
44 HE2 TYR 6 2HE TYR 6 -3.252 4.292 -3.105
45 HH TYR 6 HH TYR 6 -2.444 5.115 -6.329
46 H LEU 7 H LEU 7 -5.097 0.722 -4.913
47 HA LEU 7 HA LEU 7 -6.029 -0.441 -7.376
48 1HB LEU 7 2HB LEU 7 -3.683 -0.409 -8.044
49 2HB LEU 7 1HB LEU 7 -4.183 1.141 -7.396
50 HG LEU 7 HG LEU 7 -3.169 0.184 -5.161
51 1HD1 LEU 7 1HD1 LEU 7 -2.384 -1.896 -5.490
52 2HD1 LEU 7 2HD1 LEU 7 -0.988 -1.053 -6.161
53 3HD1 LEU 7 3HD1 LEU 7 -2.239 -1.681 -7.234
54 1HD2 LEU 7 1HD2 LEU 7 -2.117 2.082 -5.791
55 2HD2 LEU 7 2HD2 LEU 7 -1.959 1.567 -7.471
56 3HD2 LEU 7 3HD2 LEU 7 -0.842 0.955 -6.252
57 HA PRO 8 HA PRO 8 -5.582 -4.698 -6.298
58 1HB PRO 8 2HB PRO 8 -5.060 -5.783 -8.724
59 2HB PRO 8 1HB PRO 8 -6.656 -5.166 -8.279
60 1HG PRO 8 2HG PRO 8 -4.502 -3.859 -9.898
61 2HG PRO 8 1HG PRO 8 -6.250 -3.910 -10.195
62 1HD PRO 8 2HD PRO 8 -5.013 -1.759 -9.100
63 2HD PRO 8 1HD PRO 8 -6.682 -2.212 -8.700
64 H LYS 9 H LYS 9 -4.007 -6.634 -7.262
65 HA LYS 9 HA LYS 9 -1.938 -7.563 -7.083
66 1HB LYS 9 2HB LYS 9 -1.424 -4.945 -8.397
67 2HB LYS 9 1HB LYS 9 -0.033 -5.819 -7.773
68 1HG LYS 9 2HG LYS 9 -0.100 -6.636 -9.896
69 2HG LYS 9 1HG LYS 9 -1.120 -7.824 -9.083
70 1HD LYS 9 2HD LYS 9 -3.062 -6.233 -9.721
71 2HD LYS 9 1HD LYS 9 -1.914 -5.563 -10.881
72 1HE LYS 9 2HE LYS 9 -2.911 -7.172 -12.170
73 2HE LYS 9 1HE LYS 9 -1.563 -8.090 -11.503
74 1HZ LYS 9 1HZ LYS 9 -4.411 -8.342 -10.994
75 2HZ LYS 9 2HZ LYS 9 -3.409 -8.512 -9.641
76 3HZ LYS 9 3HZ LYS 9 -3.198 -9.523 -10.981
77 H CYS 10 H CYS 10 -3.109 -6.219 -4.784
78 HA CYS 10 HA CYS 10 -0.635 -5.765 -3.264
79 1HB CYS 10 2HB CYS 10 -2.736 -3.866 -3.745
80 2HB CYS 10 1HB CYS 10 -2.686 -4.251 -2.028
81 H ALA 11 H ALA 11 -0.958 -6.047 -0.893
82 HA ALA 11 HA ALA 11 -1.553 -7.337 0.884
83 1HB ALA 11 1HB ALA 11 -3.743 -7.302 1.448
84 2HB ALA 11 2HB ALA 11 -4.273 -7.886 -0.130
85 3HB ALA 11 3HB ALA 11 -3.839 -6.190 0.082
86 H ALA 12 H ALA 12 -0.103 -8.984 0.133
87 HA ALA 12 HA ALA 12 -1.446 -11.318 -1.062
88 1HB ALA 12 1HB ALA 12 0.592 -10.196 -2.193
89 2HB ALA 12 2HB ALA 12 0.547 -11.954 -2.063
90 3HB ALA 12 3HB ALA 12 1.529 -11.012 -0.941
91 H ALA 13 H ALA 13 0.480 -10.178 1.621
92 HA ALA 13 HA ALA 13 -0.094 -12.672 3.040
93 1HB ALA 13 1HB ALA 13 2.374 -12.261 3.990
94 2HB ALA 13 2HB ALA 13 2.591 -11.645 2.352
95 3HB ALA 13 3HB ALA 13 2.038 -13.300 2.606
96 H ALA 14 H ALA 14 -1.221 -10.009 3.194
97 HA ALA 14 HA ALA 14 -1.887 -8.491 4.752
98 1HB ALA 14 1HB ALA 14 -2.278 -10.599 6.033
99 2HB ALA 14 2HB ALA 14 -1.971 -9.181 7.038
100 3HB ALA 14 3HB ALA 14 -0.696 -10.372 6.781
101 H ASN 15 H ASN 15 0.774 -8.270 3.574
102 HA ASN 15 HA ASN 15 2.353 -7.079 5.726
103 1HB ASN 15 2HB ASN 15 2.937 -8.023 2.959
104 2HB ASN 15 1HB ASN 15 3.944 -6.738 3.619
105 1HD2 ASN 15 1HD2 ASN 15 4.846 -7.176 5.812
106 2HD2 ASN 15 2HD2 ASN 15 5.394 -8.781 6.138
107 H VAL 16 H VAL 16 2.190 -4.985 6.142
108 HA VAL 16 HA VAL 16 0.712 -3.211 4.472
109 HB VAL 16 HB VAL 16 0.755 -2.951 6.914
110 1HG1 VAL 16 1HG1 VAL 16 2.704 -2.079 8.059
111 2HG1 VAL 16 2HG1 VAL 16 3.618 -2.077 6.551
112 3HG1 VAL 16 3HG1 VAL 16 3.100 -3.603 7.267
113 1HG2 VAL 16 1HG2 VAL 16 0.162 -1.022 5.598
114 2HG2 VAL 16 2HG2 VAL 16 1.862 -0.608 5.372
115 3HG2 VAL 16 3HG2 VAL 16 1.134 -0.501 6.975
116 H ALA 17 H ALA 17 4.151 -3.692 5.126
117 HA ALA 17 HA ALA 17 5.154 -1.454 3.789
118 1HB ALA 17 1HB ALA 17 6.339 -4.178 4.273
119 2HB ALA 17 2HB ALA 17 6.632 -2.686 5.168
120 3HB ALA 17 3HB ALA 17 7.237 -2.860 3.520
121 H ALA 18 H ALA 18 4.486 -4.726 2.578
122 HA ALA 18 HA ALA 18 5.403 -4.388 -0.032
123 1HB ALA 18 1HB ALA 18 2.989 -6.051 0.339
124 2HB ALA 18 2HB ALA 18 4.395 -6.465 1.319
125 3HB ALA 18 3HB ALA 18 4.525 -6.433 -0.440
126 H HIS 19 H HIS 19 2.634 -3.069 1.515
127 HA HIS 19 HA HIS 19 1.211 -2.556 -0.958
128 1HB HIS 19 2HB HIS 19 -0.316 -2.967 0.729
129 2HB HIS 19 1HB HIS 19 0.658 -2.165 1.952
130 HD2 HIS 19 2HD HIS 19 -0.501 0.085 2.765
131 HE1 HIS 19 1HE HIS 19 -2.470 1.061 -0.850
132 HE2 HIS 19 2HE HIS 19 -2.201 1.659 1.598
133 H ILE 20 H ILE 20 2.257 -0.427 1.709
134 HA ILE 20 HA ILE 20 2.105 1.946 0.242
135 HB ILE 20 HB ILE 20 2.184 1.881 2.695
136 1HG1 ILE 20 2HG1 ILE 20 4.587 3.495 2.030
137 2HG1 ILE 20 1HG1 ILE 20 3.133 3.824 1.093
138 1HG2 ILE 20 1HG2 ILE 20 4.242 0.167 2.452
139 2HG2 ILE 20 2HG2 ILE 20 3.900 1.083 3.920
140 3HG2 ILE 20 3HG2 ILE 20 5.122 1.659 2.786
141 1HD1 ILE 20 1HD1 ILE 20 2.807 3.669 4.021
142 2HD1 ILE 20 2HD1 ILE 20 2.053 4.745 2.845
143 3HD1 ILE 20 3HD1 ILE 20 3.702 5.050 3.387
144 H THR 21 H THR 21 4.548 -0.501 0.251
145 HA THR 21 HA THR 21 6.859 0.837 -0.371
146 HB THR 21 HB THR 21 6.802 -1.577 -0.116
147 HG1 THR 21 1HG THR 21 7.646 -0.930 -2.742
148 1HG2 THR 21 1HG2 THR 21 5.760 -3.076 -1.479
149 2HG2 THR 21 2HG2 THR 21 5.754 -1.983 -2.863
150 3HG2 THR 21 3HG2 THR 21 4.611 -1.741 -1.543
151 H HIS 22 H HIS 22 4.286 -0.105 -2.633
152 HA HIS 22 HA HIS 22 5.504 1.665 -4.644
153 1HB HIS 22 2HB HIS 22 4.250 0.394 -6.322
154 2HB HIS 22 1HB HIS 22 5.269 -0.672 -5.361
155 HD1 HIS 22 1HD HIS 22 4.105 -2.420 -3.898
156 HD2 HIS 22 2HD HIS 22 1.473 0.077 -5.923
157 HE1 HIS 22 1HE HIS 22 1.839 -3.478 -3.636
158 HE2 HIS 22 2HE HIS 22 0.281 -2.006 -4.959
159 H CYS 23 H CYS 23 2.649 1.027 -2.765
160 HA CYS 23 HA CYS 23 0.985 2.867 -4.236
161 1HB CYS 23 2HB CYS 23 0.621 1.290 -1.697
162 2HB CYS 23 1HB CYS 23 -0.560 2.486 -2.214
163 H TYR 24 H TYR 24 0.496 4.945 -3.727
164 HA TYR 24 HA TYR 24 1.442 6.082 -1.218
165 1HB TYR 24 2HB TYR 24 2.768 6.483 -3.768
166 2HB TYR 24 1HB TYR 24 2.205 8.008 -3.093
167 HD1 TYR 24 1HD TYR 24 2.559 7.664 -0.234
168 HD2 TYR 24 2HD TYR 24 5.057 6.382 -3.429
169 HE1 TYR 24 1HE TYR 24 4.502 7.719 1.272
170 HE2 TYR 24 2HE TYR 24 7.008 6.432 -1.932
171 HH TYR 24 HH TYR 24 6.706 6.791 1.470
172 H LYS 25 H LYS 25 0.108 7.040 -4.387
173 HA LYS 25 HA LYS 25 -2.390 7.826 -3.333
174 1HB LYS 25 2HB LYS 25 -2.123 10.301 -3.766
175 2HB LYS 25 1HB LYS 25 -1.300 9.689 -2.338
176 1HG LYS 25 2HG LYS 25 0.704 9.463 -4.065
177 2HG LYS 25 1HG LYS 25 -0.186 10.762 -4.862
178 1HD LYS 25 2HD LYS 25 0.205 12.248 -3.177
179 2HD LYS 25 1HD LYS 25 0.252 10.995 -1.936
180 1HE LYS 25 2HE LYS 25 2.435 10.323 -3.351
181 2HE LYS 25 1HE LYS 25 2.411 12.061 -3.649
182 1HZ LYS 25 1HZ LYS 25 2.023 12.055 -1.041
183 2HZ LYS 25 2HZ LYS 25 3.569 12.053 -1.724
184 3HZ LYS 25 3HZ LYS 25 2.889 10.607 -1.168
Start of MODEL 7
1 1H PHE 1 1HT PHE 1 -2.798 2.687 4.862
2 2H PHE 1 2HT PHE 1 -3.619 2.155 3.452
3 3H PHE 1 3HT PHE 1 -1.905 2.106 3.520
4 HA PHE 1 HA PHE 1 -1.883 0.395 5.027
5 1HB PHE 1 2HB PHE 1 -4.603 1.414 5.575
6 2HB PHE 1 1HB PHE 1 -4.412 -0.331 5.710
7 HD1 PHE 1 1HD PHE 1 -2.107 -0.972 6.996
8 HD2 PHE 1 2HD PHE 1 -4.380 2.587 7.521
9 HE1 PHE 1 1HE PHE 1 -1.145 -0.695 9.244
10 HE2 PHE 1 2HE PHE 1 -3.422 2.871 9.770
11 HZ PHE 1 HZ PHE 1 -1.803 1.230 10.634
12 H VAL 2 H VAL 2 -1.846 -1.650 4.242
13 HA VAL 2 HA VAL 2 -2.570 -2.160 1.593
14 HB VAL 2 HB VAL 2 -0.824 -3.422 2.781
15 1HG1 VAL 2 1HG1 VAL 2 -2.949 -5.061 4.107
16 2HG1 VAL 2 2HG1 VAL 2 -2.303 -3.618 4.888
17 3HG1 VAL 2 3HG1 VAL 2 -1.228 -4.954 4.477
18 1HG2 VAL 2 1HG2 VAL 2 -2.449 -4.325 0.827
19 2HG2 VAL 2 2HG2 VAL 2 -2.677 -5.588 2.037
20 3HG2 VAL 2 3HG2 VAL 2 -1.059 -5.220 1.439
21 H SER 3 H SER 3 -4.194 -3.018 4.621
22 HA SER 3 HA SER 3 -6.228 -4.606 3.544
23 1HB SER 3 2HB SER 3 -5.545 -4.078 6.037
24 2HB SER 3 1HB SER 3 -6.790 -2.837 5.893
25 HG SER 3 HG SER 3 -7.043 -5.546 6.114
26 H THR 4 H THR 4 -5.835 -1.147 3.654
27 HA THR 4 HA THR 4 -8.531 -0.808 2.522
28 HB THR 4 HB THR 4 -6.794 1.365 3.690
29 HG1 THR 4 1HG THR 4 -7.184 0.327 5.488
30 1HG2 THR 4 1HG2 THR 4 -8.494 2.372 2.442
31 2HG2 THR 4 2HG2 THR 4 -9.075 2.392 4.107
32 3HG2 THR 4 3HG2 THR 4 -9.697 1.195 2.971
33 H CYS 5 H CYS 5 -6.050 -1.630 1.095
34 HA CYS 5 HA CYS 5 -5.065 0.529 -0.434
35 1HB CYS 5 2HB CYS 5 -3.875 -1.609 -0.259
36 2HB CYS 5 1HB CYS 5 -5.179 -2.416 -1.122
37 H TYR 6 H TYR 6 -5.449 0.979 -2.692
38 HA TYR 6 HA TYR 6 -8.274 0.595 -3.398
39 1HB TYR 6 2HB TYR 6 -7.914 2.540 -4.926
40 2HB TYR 6 1HB TYR 6 -7.661 2.918 -3.225
41 HD1 TYR 6 1HD TYR 6 -6.115 2.652 -6.506
42 HD2 TYR 6 2HD TYR 6 -5.380 3.285 -2.364
43 HE1 TYR 6 1HE TYR 6 -3.882 3.532 -7.042
44 HE2 TYR 6 2HE TYR 6 -3.146 4.169 -2.889
45 HH TYR 6 HH TYR 6 -1.741 3.881 -6.006
46 H LEU 7 H LEU 7 -5.025 0.580 -4.847
47 HA LEU 7 HA LEU 7 -6.004 -0.592 -7.295
48 1HB LEU 7 2HB LEU 7 -3.666 -0.597 -7.989
49 2HB LEU 7 1HB LEU 7 -4.142 0.969 -7.363
50 HG LEU 7 HG LEU 7 -3.114 0.039 -5.123
51 1HD1 LEU 7 1HD1 LEU 7 -2.369 -2.063 -5.441
52 2HD1 LEU 7 2HD1 LEU 7 -0.957 -1.238 -6.103
53 3HD1 LEU 7 3HD1 LEU 7 -2.205 -1.857 -7.185
54 1HD2 LEU 7 1HD2 LEU 7 -1.914 1.369 -7.470
55 2HD2 LEU 7 2HD2 LEU 7 -0.792 0.770 -6.248
56 3HD2 LEU 7 3HD2 LEU 7 -2.054 1.918 -5.799
57 HA PRO 8 HA PRO 8 -5.589 -4.833 -6.152
58 1HB PRO 8 2HB PRO 8 -5.106 -5.966 -8.564
59 2HB PRO 8 1HB PRO 8 -6.689 -5.322 -8.114
60 1HG PRO 8 2HG PRO 8 -4.537 -4.068 -9.776
61 2HG PRO 8 1HG PRO 8 -6.288 -4.103 -10.054
62 1HD PRO 8 2HD PRO 8 -5.011 -1.950 -9.008
63 2HD PRO 8 1HD PRO 8 -6.683 -2.374 -8.586
64 H LYS 9 H LYS 9 -4.044 -6.802 -7.100
65 HA LYS 9 HA LYS 9 -1.984 -7.751 -6.928
66 1HB LYS 9 2HB LYS 9 -1.507 -5.199 -8.347
67 2HB LYS 9 1HB LYS 9 -0.086 -5.963 -7.648
68 1HG LYS 9 2HG LYS 9 -0.413 -6.615 -9.974
69 2HG LYS 9 1HG LYS 9 -0.543 -7.999 -8.889
70 1HD LYS 9 2HD LYS 9 -3.099 -7.410 -8.951
71 2HD LYS 9 1HD LYS 9 -2.663 -6.606 -10.460
72 1HE LYS 9 2HE LYS 9 -1.402 -8.985 -10.761
73 2HE LYS 9 1HE LYS 9 -2.802 -9.472 -9.806
74 1HZ LYS 9 1HZ LYS 9 -2.893 -7.974 -12.370
75 2HZ LYS 9 2HZ LYS 9 -4.238 -8.435 -11.453
76 3HZ LYS 9 3HZ LYS 9 -3.259 -9.614 -12.170
77 H CYS 10 H CYS 10 -3.119 -6.342 -4.642
78 HA CYS 10 HA CYS 10 -0.623 -5.889 -3.156
79 1HB CYS 10 2HB CYS 10 -2.716 -3.986 -3.641
80 2HB CYS 10 1HB CYS 10 -2.657 -4.350 -1.921
81 H ALA 11 H ALA 11 -1.085 -5.964 -0.712
82 HA ALA 11 HA ALA 11 -1.689 -7.204 1.098
83 1HB ALA 11 1HB ALA 11 -4.297 -8.004 -0.034
84 2HB ALA 11 2HB ALA 11 -3.997 -6.271 0.099
85 3HB ALA 11 3HB ALA 11 -3.907 -7.294 1.532
86 H ALA 12 H ALA 12 -0.181 -8.517 -0.847
87 HA ALA 12 HA ALA 12 -1.226 -11.031 -1.596
88 1HB ALA 12 1HB ALA 12 0.854 -11.492 -2.447
89 2HB ALA 12 2HB ALA 12 1.694 -10.674 -1.129
90 3HB ALA 12 3HB ALA 12 0.907 -9.729 -2.394
91 H ALA 13 H ALA 13 0.311 -9.865 1.315
92 HA ALA 13 HA ALA 13 -0.350 -12.374 2.642
93 1HB ALA 13 1HB ALA 13 2.352 -11.311 3.251
94 2HB ALA 13 2HB ALA 13 2.142 -12.211 1.748
95 3HB ALA 13 3HB ALA 13 1.749 -12.967 3.292
96 H ALA 14 H ALA 14 -1.377 -9.643 2.721
97 HA ALA 14 HA ALA 14 -2.105 -8.110 4.236
98 1HB ALA 14 1HB ALA 14 -1.517 -10.500 5.897
99 2HB ALA 14 2HB ALA 14 -3.039 -9.650 5.634
100 3HB ALA 14 3HB ALA 14 -1.830 -8.974 6.725
101 H ASN 15 H ASN 15 0.659 -8.008 3.318
102 HA ASN 15 HA ASN 15 2.111 -6.970 5.630
103 1HB ASN 15 2HB ASN 15 2.856 -7.815 2.870
104 2HB ASN 15 1HB ASN 15 3.864 -6.604 3.658
105 1HD2 ASN 15 1HD2 ASN 15 5.510 -7.378 4.740
106 2HD2 ASN 15 2HD2 ASN 15 5.611 -8.939 5.474
107 H VAL 16 H VAL 16 2.038 -4.890 6.133
108 HA VAL 16 HA VAL 16 0.711 -2.968 4.533
109 HB VAL 16 HB VAL 16 0.801 -2.797 6.983
110 1HG1 VAL 16 1HG1 VAL 16 3.638 -1.854 6.771
111 2HG1 VAL 16 2HG1 VAL 16 3.258 -3.556 7.034
112 3HG1 VAL 16 3HG1 VAL 16 2.734 -2.344 8.203
113 1HG2 VAL 16 1HG2 VAL 16 0.280 -0.789 5.804
114 2HG2 VAL 16 2HG2 VAL 16 1.982 -0.485 5.455
115 3HG2 VAL 16 3HG2 VAL 16 1.386 -0.366 7.111
116 H ALA 17 H ALA 17 4.142 -3.548 5.234
117 HA ALA 17 HA ALA 17 5.199 -1.361 3.856
118 1HB ALA 17 1HB ALA 17 6.734 -3.886 3.758
119 2HB ALA 17 2HB ALA 17 6.280 -3.297 5.357
120 3HB ALA 17 3HB ALA 17 7.229 -2.276 4.278
121 H ALA 18 H ALA 18 4.545 -4.665 2.724
122 HA ALA 18 HA ALA 18 5.492 -4.376 0.113
123 1HB ALA 18 1HB ALA 18 3.866 -6.248 -0.406
124 2HB ALA 18 2HB ALA 18 3.368 -6.152 1.283
125 3HB ALA 18 3HB ALA 18 5.036 -6.559 0.877
126 H HIS 19 H HIS 19 2.689 -3.066 1.605
127 HA HIS 19 HA HIS 19 1.280 -2.639 -0.893
128 1HB HIS 19 2HB HIS 19 -0.269 -3.028 0.771
129 2HB HIS 19 1HB HIS 19 0.690 -2.219 2.002
130 HD2 HIS 19 2HD HIS 19 -0.463 0.046 2.788
131 HE1 HIS 19 1HE HIS 19 -2.440 0.974 -0.838
132 HE2 HIS 19 2HE HIS 19 -2.170 1.601 1.605
133 H ILE 20 H ILE 20 2.293 -0.446 1.735
134 HA ILE 20 HA ILE 20 2.101 1.900 0.221
135 HB ILE 20 HB ILE 20 2.168 1.893 2.671
136 1HG1 ILE 20 2HG1 ILE 20 4.563 3.516 2.040
137 2HG1 ILE 20 1HG1 ILE 20 3.157 3.796 1.017
138 1HG2 ILE 20 1HG2 ILE 20 4.760 0.616 2.195
139 2HG2 ILE 20 2HG2 ILE 20 3.680 0.515 3.585
140 3HG2 ILE 20 3HG2 ILE 20 4.785 1.879 3.426
141 1HD1 ILE 20 1HD1 ILE 20 2.342 3.715 3.753
142 2HD1 ILE 20 2HD1 ILE 20 2.220 5.033 2.588
143 3HD1 ILE 20 3HD1 ILE 20 3.681 4.847 3.560
144 H THR 21 H THR 21 4.582 -0.510 0.289
145 HA THR 21 HA THR 21 6.875 0.850 -0.352
146 HB THR 21 HB THR 21 6.857 -1.558 -0.050
147 HG1 THR 21 1HG THR 21 8.575 -0.819 -1.259
148 1HG2 THR 21 1HG2 THR 21 5.831 -3.101 -1.372
149 2HG2 THR 21 2HG2 THR 21 5.816 -2.045 -2.785
150 3HG2 THR 21 3HG2 THR 21 4.666 -1.780 -1.473
151 H HIS 22 H HIS 22 4.322 -0.172 -2.601
152 HA HIS 22 HA HIS 22 5.525 1.564 -4.648
153 1HB HIS 22 2HB HIS 22 4.276 0.249 -6.296
154 2HB HIS 22 1HB HIS 22 5.304 -0.789 -5.314
155 HD1 HIS 22 1HD HIS 22 4.146 -2.491 -3.781
156 HD2 HIS 22 2HD HIS 22 1.507 -0.094 -5.915
157 HE1 HIS 22 1HE HIS 22 1.888 -3.561 -3.500
158 HE2 HIS 22 2HE HIS 22 0.326 -2.151 -4.884
159 H CYS 23 H CYS 23 2.675 0.947 -2.754
160 HA CYS 23 HA CYS 23 1.001 2.752 -4.259
161 1HB CYS 23 2HB CYS 23 0.636 1.223 -1.689
162 2HB CYS 23 1HB CYS 23 -0.555 2.388 -2.252
163 H TYR 24 H TYR 24 0.599 4.851 -3.850
164 HA TYR 24 HA TYR 24 1.542 6.025 -1.340
165 1HB TYR 24 2HB TYR 24 2.541 6.662 -4.075
166 2HB TYR 24 1HB TYR 24 2.331 7.997 -2.947
167 HD1 TYR 24 1HD TYR 24 3.285 7.313 -0.464
168 HD2 TYR 24 2HD TYR 24 4.679 5.831 -4.200
169 HE1 TYR 24 1HE TYR 24 5.458 6.790 0.561
170 HE2 TYR 24 2HE TYR 24 6.855 5.303 -3.187
171 HH TYR 24 HH TYR 24 8.209 6.101 -1.213
172 H LYS 25 H LYS 25 0.013 6.825 -4.462
173 HA LYS 25 HA LYS 25 -2.437 7.604 -3.328
174 1HB LYS 25 2HB LYS 25 -2.306 10.047 -3.685
175 2HB LYS 25 1HB LYS 25 -1.219 9.491 -2.420
176 1HG LYS 25 2HG LYS 25 0.581 9.455 -4.234
177 2HG LYS 25 1HG LYS 25 -0.550 10.416 -5.189
178 1HD LYS 25 2HD LYS 25 0.538 12.129 -4.176
179 2HD LYS 25 1HD LYS 25 -0.636 11.801 -2.901
180 1HE LYS 25 2HE LYS 25 1.923 10.287 -2.880
181 2HE LYS 25 1HE LYS 25 1.958 11.984 -2.402
182 1HZ LYS 25 1HZ LYS 25 0.353 9.812 -1.174
183 2HZ LYS 25 2HZ LYS 25 0.158 11.449 -0.797
184 3HZ LYS 25 3HZ LYS 25 1.624 10.673 -0.463
Start of MODEL 8
1 1H PHE 1 1HT PHE 1 -2.243 2.206 5.268
2 2H PHE 1 2HT PHE 1 -3.389 2.007 4.006
3 3H PHE 1 3HT PHE 1 -1.723 1.728 3.705
4 HA PHE 1 HA PHE 1 -1.722 -0.117 5.177
5 1HB PHE 1 2HB PHE 1 -4.563 0.789 5.606
6 2HB PHE 1 1HB PHE 1 -4.066 -0.862 5.958
7 HD1 PHE 1 1HD PHE 1 -4.797 2.033 7.510
8 HD2 PHE 1 2HD PHE 1 -1.582 -0.744 7.251
9 HE1 PHE 1 1HE PHE 1 -4.005 2.750 9.726
10 HE2 PHE 1 2HE PHE 1 -0.785 -0.032 9.468
11 HZ PHE 1 HZ PHE 1 -1.997 1.716 10.708
12 H VAL 2 H VAL 2 -1.733 -2.002 4.088
13 HA VAL 2 HA VAL 2 -2.503 -2.126 1.407
14 HB VAL 2 HB VAL 2 -0.788 -3.593 2.391
15 1HG1 VAL 2 1HG1 VAL 2 -1.408 -5.545 3.696
16 2HG1 VAL 2 2HG1 VAL 2 -3.104 -5.066 3.642
17 3HG1 VAL 2 3HG1 VAL 2 -1.935 -4.071 4.508
18 1HG2 VAL 2 1HG2 VAL 2 -1.255 -4.578 0.426
19 2HG2 VAL 2 2HG2 VAL 2 -2.996 -4.534 0.702
20 3HG2 VAL 2 3HG2 VAL 2 -2.021 -5.814 1.423
21 H SER 3 H SER 3 -4.224 -2.987 4.331
22 HA SER 3 HA SER 3 -6.284 -4.509 3.152
23 1HB SER 3 2HB SER 3 -5.908 -3.090 5.749
24 2HB SER 3 1HB SER 3 -7.544 -3.573 5.301
25 HG SER 3 HG SER 3 -7.027 -5.524 5.842
26 H THR 4 H THR 4 -5.762 -1.076 3.459
27 HA THR 4 HA THR 4 -8.427 -0.561 2.327
28 HB THR 4 HB THR 4 -6.599 1.538 3.469
29 HG1 THR 4 1HG THR 4 -6.899 -0.009 5.088
30 1HG2 THR 4 1HG2 THR 4 -9.556 1.357 3.013
31 2HG2 THR 4 2HG2 THR 4 -8.413 2.541 2.377
32 3HG2 THR 4 3HG2 THR 4 -8.829 2.549 4.091
33 H CYS 5 H CYS 5 -5.940 -1.450 0.890
34 HA CYS 5 HA CYS 5 -4.905 0.711 -0.602
35 1HB CYS 5 2HB CYS 5 -3.768 -1.462 -0.449
36 2HB CYS 5 1HB CYS 5 -5.080 -2.216 -1.346
37 H TYR 6 H TYR 6 -5.268 1.195 -2.861
38 HA TYR 6 HA TYR 6 -8.106 1.008 -3.536
39 1HB TYR 6 2HB TYR 6 -7.683 2.829 -5.097
40 2HB TYR 6 1HB TYR 6 -7.058 3.242 -3.503
41 HD1 TYR 6 1HD TYR 6 -6.166 2.375 -6.954
42 HD2 TYR 6 2HD TYR 6 -4.680 3.469 -3.121
43 HE1 TYR 6 1HE TYR 6 -3.970 2.854 -7.949
44 HE2 TYR 6 2HE TYR 6 -2.479 3.952 -4.106
45 HH TYR 6 HH TYR 6 -1.169 3.404 -6.047
46 H LEU 7 H LEU 7 -4.921 0.224 -4.826
47 HA LEU 7 HA LEU 7 -6.151 -0.993 -7.186
48 1HB LEU 7 2HB LEU 7 -3.964 -1.092 -8.132
49 2HB LEU 7 1HB LEU 7 -4.177 0.504 -7.438
50 HG LEU 7 HG LEU 7 -3.003 -0.867 -5.369
51 1HD1 LEU 7 1HD1 LEU 7 -1.662 -2.513 -6.048
52 2HD1 LEU 7 2HD1 LEU 7 -1.126 -1.608 -7.463
53 3HD1 LEU 7 3HD1 LEU 7 -2.625 -2.534 -7.525
54 1HD2 LEU 7 1HD2 LEU 7 -2.105 1.185 -5.670
55 2HD2 LEU 7 2HD2 LEU 7 -2.137 1.063 -7.429
56 3HD2 LEU 7 3HD2 LEU 7 -0.859 0.265 -6.513
57 HA PRO 8 HA PRO 8 -5.818 -5.049 -5.442
58 1HB PRO 8 2HB PRO 8 -5.986 -6.536 -7.685
59 2HB PRO 8 1HB PRO 8 -7.372 -5.649 -7.039
60 1HG PRO 8 2HG PRO 8 -5.526 -4.909 -9.278
61 2HG PRO 8 1HG PRO 8 -7.292 -4.771 -9.191
62 1HD PRO 8 2HD PRO 8 -5.610 -2.670 -8.772
63 2HD PRO 8 1HD PRO 8 -7.203 -2.806 -8.002
64 H LYS 9 H LYS 9 -4.625 -7.229 -6.106
65 HA LYS 9 HA LYS 9 -2.640 -8.336 -6.186
66 1HB LYS 9 2HB LYS 9 -2.353 -6.261 -8.308
67 2HB LYS 9 1HB LYS 9 -0.924 -7.174 -7.845
68 1HG LYS 9 2HG LYS 9 -1.845 -9.200 -8.551
69 2HG LYS 9 1HG LYS 9 -3.483 -8.547 -8.583
70 1HD LYS 9 2HD LYS 9 -3.159 -7.472 -10.588
71 2HD LYS 9 1HD LYS 9 -1.417 -7.328 -10.351
72 1HE LYS 9 2HE LYS 9 -0.993 -9.389 -11.199
73 2HE LYS 9 1HE LYS 9 -2.502 -10.068 -10.589
74 1HZ LYS 9 1HZ LYS 9 -2.571 -9.980 -12.969
75 2HZ LYS 9 2HZ LYS 9 -2.182 -8.334 -12.978
76 3HZ LYS 9 3HZ LYS 9 -3.671 -8.847 -12.360
77 H CYS 10 H CYS 10 -3.036 -6.256 -4.188
78 HA CYS 10 HA CYS 10 -0.235 -5.466 -3.722
79 1HB CYS 10 2HB CYS 10 -2.396 -3.800 -3.863
80 2HB CYS 10 1HB CYS 10 -2.310 -4.109 -2.133
81 H ALA 11 H ALA 11 -3.160 -6.786 -2.266
82 HA ALA 11 HA ALA 11 -1.734 -7.378 0.210
83 1HB ALA 11 1HB ALA 11 -3.899 -8.044 1.090
84 2HB ALA 11 2HB ALA 11 -4.625 -7.854 -0.506
85 3HB ALA 11 3HB ALA 11 -3.999 -6.445 0.352
86 H ALA 12 H ALA 12 -0.377 -9.066 -0.155
87 HA ALA 12 HA ALA 12 -1.535 -11.517 -1.305
88 1HB ALA 12 1HB ALA 12 0.483 -10.431 -2.414
89 2HB ALA 12 2HB ALA 12 0.601 -12.152 -2.046
90 3HB ALA 12 3HB ALA 12 1.405 -10.971 -1.011
91 H ALA 13 H ALA 13 0.147 -10.154 1.438
92 HA ALA 13 HA ALA 13 -0.497 -12.535 2.989
93 1HB ALA 13 1HB ALA 13 1.951 -12.184 3.984
94 2HB ALA 13 2HB ALA 13 2.252 -11.655 2.329
95 3HB ALA 13 3HB ALA 13 1.621 -13.273 2.637
96 H ALA 14 H ALA 14 -1.467 -9.785 2.895
97 HA ALA 14 HA ALA 14 -2.096 -8.123 4.316
98 1HB ALA 14 1HB ALA 14 -2.509 -10.271 5.710
99 2HB ALA 14 2HB ALA 14 -2.540 -8.701 6.513
100 3HB ALA 14 3HB ALA 14 -1.113 -9.728 6.639
101 H ASN 15 H ASN 15 0.628 -8.162 3.265
102 HA ASN 15 HA ASN 15 2.266 -7.056 5.392
103 1HB ASN 15 2HB ASN 15 2.718 -7.867 2.557
104 2HB ASN 15 1HB ASN 15 3.809 -6.677 3.261
105 1HD2 ASN 15 1HD2 ASN 15 4.059 -9.572 2.428
106 2HD2 ASN 15 2HD2 ASN 15 4.798 -10.338 3.788
107 H VAL 16 H VAL 16 2.061 -5.002 5.960
108 HA VAL 16 HA VAL 16 0.693 -3.077 4.376
109 HB VAL 16 HB VAL 16 0.693 -2.976 6.831
110 1HG1 VAL 16 1HG1 VAL 16 3.495 -1.925 6.775
111 2HG1 VAL 16 2HG1 VAL 16 3.188 -3.656 6.916
112 3HG1 VAL 16 3HG1 VAL 16 2.561 -2.547 8.136
113 1HG2 VAL 16 1HG2 VAL 16 0.622 -0.681 6.962
114 2HG2 VAL 16 2HG2 VAL 16 0.538 -0.919 5.217
115 3HG2 VAL 16 3HG2 VAL 16 2.067 -0.470 5.973
116 H ALA 17 H ALA 17 4.112 -3.627 5.138
117 HA ALA 17 HA ALA 17 5.174 -1.360 3.904
118 1HB ALA 17 1HB ALA 17 6.232 -3.404 5.305
119 2HB ALA 17 2HB ALA 17 7.191 -2.266 4.358
120 3HB ALA 17 3HB ALA 17 6.760 -3.835 3.678
121 H ALA 18 H ALA 18 4.568 -4.598 2.572
122 HA ALA 18 HA ALA 18 5.577 -4.157 0.006
123 1HB ALA 18 1HB ALA 18 3.388 -5.989 0.964
124 2HB ALA 18 2HB ALA 18 5.087 -6.382 0.704
125 3HB ALA 18 3HB ALA 18 4.045 -6.020 -0.673
126 H HIS 19 H HIS 19 2.739 -2.937 1.502
127 HA HIS 19 HA HIS 19 1.394 -2.369 -1.007
128 1HB HIS 19 2HB HIS 19 -0.194 -2.880 0.593
129 2HB HIS 19 1HB HIS 19 0.714 -2.120 1.892
130 HD2 HIS 19 2HD HIS 19 -0.500 0.083 2.754
131 HE1 HIS 19 1HE HIS 19 -2.372 1.171 -0.882
132 HE2 HIS 19 2HE HIS 19 -2.190 1.673 1.597
133 H ILE 20 H ILE 20 2.300 -0.338 1.786
134 HA ILE 20 HA ILE 20 2.141 2.096 0.419
135 HB ILE 20 HB ILE 20 2.144 1.922 2.869
136 1HG1 ILE 20 2HG1 ILE 20 4.526 3.618 2.356
137 2HG1 ILE 20 1HG1 ILE 20 3.097 3.955 1.384
138 1HG2 ILE 20 1HG2 ILE 20 4.244 0.266 2.620
139 2HG2 ILE 20 2HG2 ILE 20 3.841 1.112 4.114
140 3HG2 ILE 20 3HG2 ILE 20 5.082 1.760 3.041
141 1HD1 ILE 20 1HD1 ILE 20 2.605 3.651 4.260
142 2HD1 ILE 20 2HD1 ILE 20 1.977 4.834 3.114
143 3HD1 ILE 20 3HD1 ILE 20 3.590 5.040 3.800
144 H THR 21 H THR 21 4.607 -0.312 0.351
145 HA THR 21 HA THR 21 6.922 1.091 -0.112
146 HB THR 21 HB THR 21 6.912 -1.327 0.009
147 HG1 THR 21 1HG THR 21 7.774 -0.539 -2.571
148 1HG2 THR 21 1HG2 THR 21 5.894 -2.774 -1.415
149 2HG2 THR 21 2HG2 THR 21 5.917 -1.640 -2.765
150 3HG2 THR 21 3HG2 THR 21 4.740 -1.443 -1.468
151 H HIS 22 H HIS 22 4.435 0.237 -2.505
152 HA HIS 22 HA HIS 22 5.683 2.139 -4.371
153 1HB HIS 22 2HB HIS 22 4.533 0.939 -6.164
154 2HB HIS 22 1HB HIS 22 5.519 -0.168 -5.215
155 HD1 HIS 22 1HD HIS 22 4.349 -2.110 -4.120
156 HD2 HIS 22 2HD HIS 22 1.706 0.683 -5.694
157 HE1 HIS 22 1HE HIS 22 2.076 -3.175 -3.966
158 HE2 HIS 22 2HE HIS 22 0.507 -1.505 -5.014
159 H CYS 23 H CYS 23 2.763 1.312 -2.665
160 HA CYS 23 HA CYS 23 1.102 3.185 -4.081
161 1HB CYS 23 2HB CYS 23 0.728 1.486 -1.627
162 2HB CYS 23 1HB CYS 23 -0.464 2.694 -2.086
163 H TYR 24 H TYR 24 1.525 5.290 -3.885
164 HA TYR 24 HA TYR 24 2.584 6.387 -1.424
165 1HB TYR 24 2HB TYR 24 2.102 7.417 -4.186
166 2HB TYR 24 1HB TYR 24 2.237 8.578 -2.869
167 HD1 TYR 24 1HD TYR 24 4.065 5.378 -3.438
168 HD2 TYR 24 2HD TYR 24 4.298 9.616 -3.155
169 HE1 TYR 24 1HE TYR 24 6.517 5.248 -3.585
170 HE2 TYR 24 2HE TYR 24 6.750 9.498 -3.302
171 HH TYR 24 HH TYR 24 8.543 7.937 -2.935
172 H LYS 25 H LYS 25 -0.130 7.421 -3.497
173 HA LYS 25 HA LYS 25 -1.507 8.395 -1.107
174 1HB LYS 25 2HB LYS 25 -2.304 8.806 -3.990
175 2HB LYS 25 1HB LYS 25 -2.879 9.694 -2.585
176 1HG LYS 25 2HG LYS 25 0.033 9.739 -3.142
177 2HG LYS 25 1HG LYS 25 -1.029 10.662 -4.208
178 1HD LYS 25 2HD LYS 25 -0.361 12.148 -2.490
179 2HD LYS 25 1HD LYS 25 -2.025 11.686 -2.122
180 1HE LYS 25 2HE LYS 25 0.089 9.996 -0.943
181 2HE LYS 25 1HE LYS 25 -0.029 11.641 -0.318
182 1HZ LYS 25 1HZ LYS 25 -2.533 10.188 -0.573
183 2HZ LYS 25 2HZ LYS 25 -2.003 11.226 0.653
184 3HZ LYS 25 3HZ LYS 25 -1.470 9.620 0.615
Start of MODEL 9
1 1H PHE 1 1HT PHE 1 -1.677 1.958 3.433
2 2H PHE 1 2HT PHE 1 -2.681 2.780 4.557
3 3H PHE 1 3HT PHE 1 -3.340 2.189 3.086
4 HA PHE 1 HA PHE 1 -2.096 0.435 5.079
5 1HB PHE 1 2HB PHE 1 -4.279 2.011 5.597
6 2HB PHE 1 1HB PHE 1 -5.036 0.555 4.959
7 HD1 PHE 1 1HD PHE 1 -4.691 1.972 7.871
8 HD2 PHE 1 2HD PHE 1 -3.256 -1.546 5.955
9 HE1 PHE 1 1HE PHE 1 -4.437 0.887 10.064
10 HE2 PHE 1 2HE PHE 1 -3.000 -2.638 8.144
11 HZ PHE 1 HZ PHE 1 -3.591 -1.422 10.203
12 H VAL 2 H VAL 2 -1.878 -1.541 4.260
13 HA VAL 2 HA VAL 2 -2.552 -2.220 1.636
14 HB VAL 2 HB VAL 2 -0.792 -3.370 2.909
15 1HG1 VAL 2 1HG1 VAL 2 -1.296 -5.011 4.591
16 2HG1 VAL 2 2HG1 VAL 2 -3.029 -4.757 4.378
17 3HG1 VAL 2 3HG1 VAL 2 -2.027 -3.475 5.058
18 1HG2 VAL 2 1HG2 VAL 2 -2.346 -4.423 0.992
19 2HG2 VAL 2 2HG2 VAL 2 -2.618 -5.604 2.274
20 3HG2 VAL 2 3HG2 VAL 2 -0.980 -5.279 1.708
21 H SER 3 H SER 3 -4.335 -2.568 4.620
22 HA SER 3 HA SER 3 -6.292 -4.378 3.604
23 1HB SER 3 2HB SER 3 -6.202 -2.592 6.035
24 2HB SER 3 1HB SER 3 -7.592 -3.609 5.661
25 HG SER 3 HG SER 3 -6.076 -5.398 5.639
26 H THR 4 H THR 4 -5.914 -0.914 3.626
27 HA THR 4 HA THR 4 -8.599 -0.610 2.463
28 HB THR 4 HB THR 4 -6.922 1.695 3.399
29 HG1 THR 4 1HG THR 4 -8.430 -0.079 5.001
30 1HG2 THR 4 1HG2 THR 4 -9.289 1.754 2.215
31 2HG2 THR 4 2HG2 THR 4 -8.836 2.895 3.481
32 3HG2 THR 4 3HG2 THR 4 -9.833 1.494 3.872
33 H CYS 5 H CYS 5 -6.077 -1.484 1.095
34 HA CYS 5 HA CYS 5 -5.121 0.612 -0.537
35 1HB CYS 5 2HB CYS 5 -3.894 -1.492 -0.240
36 2HB CYS 5 1HB CYS 5 -5.175 -2.366 -1.072
37 H TYR 6 H TYR 6 -5.649 1.223 -2.632
38 HA TYR 6 HA TYR 6 -8.403 0.640 -3.397
39 1HB TYR 6 2HB TYR 6 -8.112 2.546 -4.970
40 2HB TYR 6 1HB TYR 6 -7.819 2.983 -3.290
41 HD1 TYR 6 1HD TYR 6 -6.305 2.514 -6.587
42 HD2 TYR 6 2HD TYR 6 -5.576 3.540 -2.523
43 HE1 TYR 6 1HE TYR 6 -4.104 3.412 -7.214
44 HE2 TYR 6 2HE TYR 6 -3.373 4.441 -3.139
45 HH TYR 6 HH TYR 6 -1.730 4.258 -4.886
46 H LEU 7 H LEU 7 -5.165 0.682 -4.877
47 HA LEU 7 HA LEU 7 -6.102 -0.564 -7.288
48 1HB LEU 7 2HB LEU 7 -3.728 -0.636 -7.914
49 2HB LEU 7 1HB LEU 7 -4.233 0.960 -7.395
50 HG LEU 7 HG LEU 7 -3.286 0.071 -5.060
51 1HD1 LEU 7 1HD1 LEU 7 -1.027 -1.061 -5.934
52 2HD1 LEU 7 2HD1 LEU 7 -2.152 -1.710 -7.127
53 3HD1 LEU 7 3HD1 LEU 7 -2.429 -1.991 -5.408
54 1HD2 LEU 7 1HD2 LEU 7 -2.430 1.811 -7.101
55 2HD2 LEU 7 2HD2 LEU 7 -1.014 0.892 -6.595
56 3HD2 LEU 7 3HD2 LEU 7 -1.944 1.803 -5.407
57 HA PRO 8 HA PRO 8 -5.751 -4.774 -5.981
58 1HB PRO 8 2HB PRO 8 -5.490 -6.001 -8.373
59 2HB PRO 8 1HB PRO 8 -7.011 -5.268 -7.848
60 1HG PRO 8 2HG PRO 8 -4.920 -4.179 -9.693
61 2HG PRO 8 1HG PRO 8 -6.685 -4.143 -9.858
62 1HD PRO 8 2HD PRO 8 -5.234 -2.019 -8.973
63 2HD PRO 8 1HD PRO 8 -6.903 -2.333 -8.457
64 H LYS 9 H LYS 9 -4.333 -6.815 -6.968
65 HA LYS 9 HA LYS 9 -2.292 -7.816 -6.918
66 1HB LYS 9 2HB LYS 9 -2.124 -6.137 -8.941
67 2HB LYS 9 1HB LYS 9 -0.981 -5.311 -7.891
68 1HG LYS 9 2HG LYS 9 0.583 -6.940 -8.075
69 2HG LYS 9 1HG LYS 9 -0.615 -8.225 -8.247
70 1HD LYS 9 2HD LYS 9 -0.535 -6.271 -10.448
71 2HD LYS 9 1HD LYS 9 0.907 -7.275 -10.277
72 1HE LYS 9 2HE LYS 9 -0.680 -8.317 -11.793
73 2HE LYS 9 1HE LYS 9 -0.495 -9.284 -10.331
74 1HZ LYS 9 1HZ LYS 9 -2.773 -9.225 -10.687
75 2HZ LYS 9 2HZ LYS 9 -2.776 -7.598 -11.147
76 3HZ LYS 9 3HZ LYS 9 -2.544 -8.016 -9.525
77 H CYS 10 H CYS 10 -3.207 -6.351 -4.593
78 HA CYS 10 HA CYS 10 -0.594 -5.839 -3.340
79 1HB CYS 10 2HB CYS 10 -2.676 -3.963 -3.704
80 2HB CYS 10 1HB CYS 10 -2.677 -4.380 -1.995
81 H ALA 11 H ALA 11 -0.832 -5.901 -0.859
82 HA ALA 11 HA ALA 11 -1.229 -7.138 1.010
83 1HB ALA 11 1HB ALA 11 -3.880 -8.072 0.101
84 2HB ALA 11 2HB ALA 11 -3.651 -6.327 0.206
85 3HB ALA 11 3HB ALA 11 -3.396 -7.337 1.629
86 H ALA 12 H ALA 12 0.220 -8.411 -0.960
87 HA ALA 12 HA ALA 12 -0.702 -10.929 -1.753
88 1HB ALA 12 1HB ALA 12 1.529 -9.513 -2.248
89 2HB ALA 12 2HB ALA 12 1.367 -11.233 -2.602
90 3HB ALA 12 3HB ALA 12 2.170 -10.710 -1.122
91 H ALA 13 H ALA 13 0.644 -9.820 1.273
92 HA ALA 13 HA ALA 13 -0.026 -12.394 2.478
93 1HB ALA 13 1HB ALA 13 2.164 -12.954 2.350
94 2HB ALA 13 2HB ALA 13 2.257 -11.969 3.810
95 3HB ALA 13 3HB ALA 13 2.701 -11.277 2.249
96 H ALA 14 H ALA 14 -1.182 -9.707 2.547
97 HA ALA 14 HA ALA 14 -2.102 -8.258 4.040
98 1HB ALA 14 1HB ALA 14 -2.400 -10.658 5.146
99 2HB ALA 14 2HB ALA 14 -2.899 -9.176 5.960
100 3HB ALA 14 3HB ALA 14 -1.360 -9.932 6.371
101 H ASN 15 H ASN 15 0.733 -8.024 3.379
102 HA ASN 15 HA ASN 15 1.887 -6.961 5.850
103 1HB ASN 15 2HB ASN 15 2.985 -7.835 3.222
104 2HB ASN 15 1HB ASN 15 3.858 -6.579 4.093
105 1HD2 ASN 15 1HD2 ASN 15 5.285 -7.212 5.541
106 2HD2 ASN 15 2HD2 ASN 15 5.374 -8.781 6.260
107 H VAL 16 H VAL 16 1.933 -4.854 6.278
108 HA VAL 16 HA VAL 16 0.633 -2.974 4.612
109 HB VAL 16 HB VAL 16 0.719 -2.738 7.059
110 1HG1 VAL 16 1HG1 VAL 16 3.551 -1.787 6.818
111 2HG1 VAL 16 2HG1 VAL 16 3.179 -3.482 7.132
112 3HG1 VAL 16 3HG1 VAL 16 2.648 -2.239 8.265
113 1HG2 VAL 16 1HG2 VAL 16 0.142 -0.684 6.352
114 2HG2 VAL 16 2HG2 VAL 16 1.451 -0.611 5.173
115 3HG2 VAL 16 3HG2 VAL 16 1.769 -0.240 6.868
116 H ALA 17 H ALA 17 4.055 -3.570 5.332
117 HA ALA 17 HA ALA 17 5.144 -1.426 3.915
118 1HB ALA 17 1HB ALA 17 6.184 -3.394 5.432
119 2HB ALA 17 2HB ALA 17 7.148 -2.352 4.387
120 3HB ALA 17 3HB ALA 17 6.662 -3.953 3.829
121 H ALA 18 H ALA 18 4.405 -4.727 2.831
122 HA ALA 18 HA ALA 18 5.370 -4.505 0.220
123 1HB ALA 18 1HB ALA 18 3.434 -6.267 -0.173
124 2HB ALA 18 2HB ALA 18 3.409 -6.263 1.590
125 3HB ALA 18 3HB ALA 18 4.893 -6.675 0.731
126 H HIS 19 H HIS 19 2.608 -3.086 1.683
127 HA HIS 19 HA HIS 19 1.219 -2.659 -0.827
128 1HB HIS 19 2HB HIS 19 -0.341 -2.991 0.844
129 2HB HIS 19 1HB HIS 19 0.628 -2.167 2.059
130 HD2 HIS 19 2HD HIS 19 -0.500 0.128 2.785
131 HE1 HIS 19 1HE HIS 19 -2.419 1.015 -0.881
132 HE2 HIS 19 2HE HIS 19 -1.884 1.867 1.446
133 H ILE 20 H ILE 20 2.268 -0.454 1.777
134 HA ILE 20 HA ILE 20 2.153 1.873 0.230
135 HB ILE 20 HB ILE 20 2.211 1.898 2.680
136 1HG1 ILE 20 2HG1 ILE 20 4.650 3.423 1.854
137 2HG1 ILE 20 1HG1 ILE 20 3.108 3.804 1.095
138 1HG2 ILE 20 1HG2 ILE 20 3.676 0.491 3.621
139 2HG2 ILE 20 2HG2 ILE 20 4.824 1.819 3.446
140 3HG2 ILE 20 3HG2 ILE 20 4.763 0.539 2.234
141 1HD1 ILE 20 1HD1 ILE 20 3.346 3.699 4.070
142 2HD1 ILE 20 2HD1 ILE 20 2.182 4.569 3.069
143 3HD1 ILE 20 3HD1 ILE 20 3.851 5.129 3.171
144 H THR 21 H THR 21 4.552 -0.610 0.320
145 HA THR 21 HA THR 21 6.892 0.671 -0.317
146 HB THR 21 HB THR 21 6.807 -1.730 -0.003
147 HG1 THR 21 1HG THR 21 7.641 -1.142 -2.646
148 1HG2 THR 21 1HG2 THR 21 5.716 -3.250 -1.293
149 2HG2 THR 21 2HG2 THR 21 5.734 -2.218 -2.723
150 3HG2 THR 21 3HG2 THR 21 4.598 -1.892 -1.414
151 H HIS 22 H HIS 22 4.326 -0.294 -2.581
152 HA HIS 22 HA HIS 22 5.587 1.410 -4.623
153 1HB HIS 22 2HB HIS 22 4.338 0.115 -6.281
154 2HB HIS 22 1HB HIS 22 5.320 -0.946 -5.277
155 HD1 HIS 22 1HD HIS 22 4.114 -2.699 -3.896
156 HD2 HIS 22 2HD HIS 22 1.531 -0.063 -5.807
157 HE1 HIS 22 1HE HIS 22 1.817 -3.684 -3.614
158 HE2 HIS 22 2HE HIS 22 0.283 -2.120 -4.860
159 H CYS 23 H CYS 23 2.695 0.844 -2.771
160 HA CYS 23 HA CYS 23 1.069 2.667 -4.296
161 1HB CYS 23 2HB CYS 23 0.678 1.176 -1.709
162 2HB CYS 23 1HB CYS 23 -0.485 2.374 -2.263
163 H TYR 24 H TYR 24 1.207 4.798 -4.164
164 HA TYR 24 HA TYR 24 1.919 6.014 -1.582
165 1HB TYR 24 2HB TYR 24 3.172 6.413 -4.248
166 2HB TYR 24 1HB TYR 24 2.956 7.841 -3.242
167 HD1 TYR 24 1HD TYR 24 3.579 7.143 -0.600
168 HD2 TYR 24 2HD TYR 24 5.322 5.602 -4.161
169 HE1 TYR 24 1HE TYR 24 5.618 6.574 0.651
170 HE2 TYR 24 2HE TYR 24 7.365 5.027 -2.920
171 HH TYR 24 HH TYR 24 8.320 6.221 -0.294
172 H LYS 25 H LYS 25 1.592 8.593 -1.985
173 HA LYS 25 HA LYS 25 -1.251 8.824 -2.539
174 1HB LYS 25 2HB LYS 25 -1.075 11.029 -1.516
175 2HB LYS 25 1HB LYS 25 -0.329 9.815 -0.486
176 1HG LYS 25 2HG LYS 25 1.746 10.677 -0.732
177 2HG LYS 25 1HG LYS 25 1.450 11.204 -2.390
178 1HD LYS 25 2HD LYS 25 1.691 13.157 -1.029
179 2HD LYS 25 1HD LYS 25 -0.010 13.013 -1.475
180 1HE LYS 25 2HE LYS 25 -0.347 13.350 0.727
181 2HE LYS 25 1HE LYS 25 0.001 11.625 0.836
182 1HZ LYS 25 1HZ LYS 25 1.498 12.346 2.337
183 2HZ LYS 25 2HZ LYS 25 1.605 13.899 1.675
184 3HZ LYS 25 3HZ LYS 25 2.457 12.619 0.971
Start of MODEL 10
1 1H PHE 1 1HT PHE 1 -2.378 2.404 5.242
2 2H PHE 1 2HT PHE 1 -3.569 2.150 4.032
3 3H PHE 1 3HT PHE 1 -1.911 1.881 3.678
4 HA PHE 1 HA PHE 1 -1.837 0.093 5.231
5 1HB PHE 1 2HB PHE 1 -4.556 1.151 5.806
6 2HB PHE 1 1HB PHE 1 -4.346 -0.595 5.894
7 HD1 PHE 1 1HD PHE 1 -4.412 2.234 7.810
8 HD2 PHE 1 2HD PHE 1 -1.994 -1.207 7.158
9 HE1 PHE 1 1HE PHE 1 -3.476 2.468 10.073
10 HE2 PHE 1 2HE PHE 1 -1.054 -0.980 9.421
11 HZ PHE 1 HZ PHE 1 -1.796 0.859 10.882
12 H VAL 2 H VAL 2 -1.939 -1.897 4.299
13 HA VAL 2 HA VAL 2 -2.652 -2.132 1.604
14 HB VAL 2 HB VAL 2 -0.999 -3.595 2.687
15 1HG1 VAL 2 1HG1 VAL 2 -3.403 -4.788 4.058
16 2HG1 VAL 2 2HG1 VAL 2 -2.036 -3.974 4.818
17 3HG1 VAL 2 3HG1 VAL 2 -1.803 -5.530 4.022
18 1HG2 VAL 2 1HG2 VAL 2 -2.140 -4.253 0.575
19 2HG2 VAL 2 2HG2 VAL 2 -3.275 -5.201 1.535
20 3HG2 VAL 2 3HG2 VAL 2 -1.562 -5.621 1.528
21 H SER 3 H SER 3 -4.462 -2.741 4.529
22 HA SER 3 HA SER 3 -6.539 -4.288 3.405
23 1HB SER 3 2HB SER 3 -6.126 -2.765 5.921
24 2HB SER 3 1HB SER 3 -7.797 -3.102 5.468
25 HG SER 3 HG SER 3 -7.424 -5.239 5.616
26 H THR 4 H THR 4 -5.939 -0.850 3.539
27 HA THR 4 HA THR 4 -8.541 -0.348 2.259
28 HB THR 4 HB THR 4 -6.804 1.859 3.288
29 HG1 THR 4 1HG THR 4 -6.976 1.196 5.253
30 1HG2 THR 4 1HG2 THR 4 -8.906 2.396 2.140
31 2HG2 THR 4 2HG2 THR 4 -8.896 2.921 3.824
32 3HG2 THR 4 3HG2 THR 4 -9.785 1.472 3.358
33 H CYS 5 H CYS 5 -6.084 -1.371 0.950
34 HA CYS 5 HA CYS 5 -4.856 0.680 -0.551
35 1HB CYS 5 2HB CYS 5 -3.843 -1.531 -0.315
36 2HB CYS 5 1HB CYS 5 -5.184 -2.260 -1.190
37 H TYR 6 H TYR 6 -5.096 1.127 -2.831
38 HA TYR 6 HA TYR 6 -7.911 1.091 -3.629
39 1HB TYR 6 2HB TYR 6 -7.242 2.822 -5.266
40 2HB TYR 6 1HB TYR 6 -6.842 3.274 -3.612
41 HD1 TYR 6 1HD TYR 6 -5.518 2.411 -6.898
42 HD2 TYR 6 2HD TYR 6 -4.506 3.315 -2.866
43 HE1 TYR 6 1HE TYR 6 -3.188 2.803 -7.577
44 HE2 TYR 6 2HE TYR 6 -2.173 3.709 -3.534
45 HH TYR 6 HH TYR 6 -0.979 2.854 -6.637
46 H LEU 7 H LEU 7 -4.693 0.340 -4.934
47 HA LEU 7 HA LEU 7 -5.855 -0.889 -7.290
48 1HB LEU 7 2HB LEU 7 -3.594 -1.202 -8.042
49 2HB LEU 7 1HB LEU 7 -3.772 0.431 -7.431
50 HG LEU 7 HG LEU 7 -2.822 -0.619 -5.214
51 1HD1 LEU 7 1HD1 LEU 7 -2.499 -2.835 -5.522
52 2HD1 LEU 7 2HD1 LEU 7 -0.969 -2.281 -6.203
53 3HD1 LEU 7 3HD1 LEU 7 -2.317 -2.679 -7.269
54 1HD2 LEU 7 1HD2 LEU 7 -1.485 1.032 -5.991
55 2HD2 LEU 7 2HD2 LEU 7 -1.500 0.418 -7.645
56 3HD2 LEU 7 3HD2 LEU 7 -0.457 -0.331 -6.436
57 HA PRO 8 HA PRO 8 -5.929 -4.976 -5.589
58 1HB PRO 8 2HB PRO 8 -6.048 -6.431 -7.849
59 2HB PRO 8 1HB PRO 8 -7.398 -5.423 -7.315
60 1HG PRO 8 2HG PRO 8 -5.315 -4.856 -9.389
61 2HG PRO 8 1HG PRO 8 -7.062 -4.556 -9.447
62 1HD PRO 8 2HD PRO 8 -5.219 -2.625 -8.867
63 2HD PRO 8 1HD PRO 8 -6.888 -2.597 -8.267
64 H LYS 9 H LYS 9 -4.853 -7.232 -6.183
65 HA LYS 9 HA LYS 9 -2.958 -8.486 -6.126
66 1HB LYS 9 2HB LYS 9 -2.275 -6.398 -8.165
67 2HB LYS 9 1HB LYS 9 -1.054 -7.556 -7.659
68 1HG LYS 9 2HG LYS 9 -2.553 -9.392 -8.320
69 2HG LYS 9 1HG LYS 9 -3.726 -8.202 -8.888
70 1HD LYS 9 2HD LYS 9 -2.481 -7.647 -10.718
71 2HD LYS 9 1HD LYS 9 -0.949 -7.994 -9.915
72 1HE LYS 9 2HE LYS 9 -1.060 -10.245 -10.377
73 2HE LYS 9 1HE LYS 9 -2.820 -10.240 -10.502
74 1HZ LYS 9 1HZ LYS 9 -0.831 -9.355 -12.500
75 2HZ LYS 9 2HZ LYS 9 -2.438 -8.834 -12.576
76 3HZ LYS 9 3HZ LYS 9 -2.079 -10.484 -12.678
77 H CYS 10 H CYS 10 -3.337 -6.365 -4.155
78 HA CYS 10 HA CYS 10 -0.523 -5.808 -3.479
79 1HB CYS 10 2HB CYS 10 -2.455 -3.946 -3.812
80 2HB CYS 10 1HB CYS 10 -2.651 -4.284 -2.097
81 H ALA 11 H ALA 11 -3.629 -6.946 -2.288
82 HA ALA 11 HA ALA 11 -2.599 -7.464 0.366
83 1HB ALA 11 1HB ALA 11 -5.186 -8.621 -0.499
84 2HB ALA 11 2HB ALA 11 -5.059 -6.862 -0.460
85 3HB ALA 11 3HB ALA 11 -4.754 -7.801 1.001
86 H ALA 12 H ALA 12 -0.898 -8.793 -1.066
87 HA ALA 12 HA ALA 12 -1.822 -11.589 -1.153
88 1HB ALA 12 1HB ALA 12 -0.712 -10.225 -3.189
89 2HB ALA 12 2HB ALA 12 -0.562 -11.970 -2.986
90 3HB ALA 12 3HB ALA 12 0.736 -10.904 -2.447
91 H ALA 13 H ALA 13 0.613 -9.394 0.069
92 HA ALA 13 HA ALA 13 2.040 -11.567 1.397
93 1HB ALA 13 1HB ALA 13 3.833 -10.198 1.512
94 2HB ALA 13 2HB ALA 13 2.859 -8.772 1.872
95 3HB ALA 13 3HB ALA 13 2.991 -9.353 0.212
96 H ALA 14 H ALA 14 -0.340 -9.178 2.063
97 HA ALA 14 HA ALA 14 -1.548 -8.702 3.932
98 1HB ALA 14 1HB ALA 14 -1.144 -11.310 4.177
99 2HB ALA 14 2HB ALA 14 -1.909 -10.361 5.453
100 3HB ALA 14 3HB ALA 14 -0.200 -10.780 5.570
101 H ASN 15 H ASN 15 1.049 -7.491 3.420
102 HA ASN 15 HA ASN 15 1.690 -6.661 6.171
103 1HB ASN 15 2HB ASN 15 3.469 -7.663 4.061
104 2HB ASN 15 1HB ASN 15 4.009 -6.153 4.786
105 1HD2 ASN 15 1HD2 ASN 15 5.747 -7.037 5.828
106 2HD2 ASN 15 2HD2 ASN 15 5.597 -8.117 7.168
107 H VAL 16 H VAL 16 1.699 -4.518 6.542
108 HA VAL 16 HA VAL 16 0.550 -2.734 4.724
109 HB VAL 16 HB VAL 16 0.529 -2.365 7.152
110 1HG1 VAL 16 1HG1 VAL 16 2.421 -1.722 8.396
111 2HG1 VAL 16 2HG1 VAL 16 3.391 -1.472 6.946
112 3HG1 VAL 16 3HG1 VAL 16 2.943 -3.106 7.435
113 1HG2 VAL 16 1HG2 VAL 16 0.355 -0.122 6.940
114 2HG2 VAL 16 2HG2 VAL 16 0.595 -0.483 5.231
115 3HG2 VAL 16 3HG2 VAL 16 1.957 0.044 6.220
116 H ALA 17 H ALA 17 3.941 -3.327 5.537
117 HA ALA 17 HA ALA 17 5.081 -1.213 4.105
118 1HB ALA 17 1HB ALA 17 6.585 -3.749 4.124
119 2HB ALA 17 2HB ALA 17 6.068 -3.145 5.699
120 3HB ALA 17 3HB ALA 17 7.065 -2.136 4.652
121 H ALA 18 H ALA 18 4.386 -4.549 3.088
122 HA ALA 18 HA ALA 18 5.406 -4.384 0.495
123 1HB ALA 18 1HB ALA 18 2.971 -6.016 1.024
124 2HB ALA 18 2HB ALA 18 4.465 -6.402 1.879
125 3HB ALA 18 3HB ALA 18 4.426 -6.424 0.117
126 H HIS 19 H HIS 19 2.597 -2.954 1.855
127 HA HIS 19 HA HIS 19 1.265 -2.607 -0.699
128 1HB HIS 19 2HB HIS 19 -0.335 -2.905 0.938
129 2HB HIS 19 1HB HIS 19 0.599 -2.050 2.158
130 HD2 HIS 19 2HD HIS 19 -0.581 0.242 2.811
131 HE1 HIS 19 1HE HIS 19 -2.368 1.062 -0.938
132 HE2 HIS 19 2HE HIS 19 -1.924 1.952 1.396
133 H ILE 20 H ILE 20 2.252 -0.331 1.869
134 HA ILE 20 HA ILE 20 2.152 1.954 0.251
135 HB ILE 20 HB ILE 20 2.139 2.039 2.706
136 1HG1 ILE 20 2HG1 ILE 20 4.569 3.597 1.950
137 2HG1 ILE 20 1HG1 ILE 20 3.080 3.903 1.061
138 1HG2 ILE 20 1HG2 ILE 20 5.054 1.304 2.473
139 2HG2 ILE 20 2HG2 ILE 20 3.774 0.317 3.181
140 3HG2 ILE 20 3HG2 ILE 20 4.249 1.830 3.951
141 1HD1 ILE 20 1HD1 ILE 20 2.656 3.847 3.926
142 2HD1 ILE 20 2HD1 ILE 20 2.218 5.073 2.737
143 3HD1 ILE 20 3HD1 ILE 20 3.836 5.062 3.437
144 H THR 21 H THR 21 4.555 -0.511 0.465
145 HA THR 21 HA THR 21 6.911 0.764 -0.125
146 HB THR 21 HB THR 21 6.823 -1.629 0.232
147 HG1 THR 21 1HG THR 21 8.610 -1.210 -0.889
148 1HG2 THR 21 1HG2 THR 21 5.768 -3.176 -1.054
149 2HG2 THR 21 2HG2 THR 21 5.830 -2.177 -2.507
150 3HG2 THR 21 3HG2 THR 21 4.655 -1.822 -1.240
151 H HIS 22 H HIS 22 4.416 -0.251 -2.446
152 HA HIS 22 HA HIS 22 5.733 1.415 -4.483
153 1HB HIS 22 2HB HIS 22 4.533 0.086 -6.151
154 2HB HIS 22 1HB HIS 22 5.485 -0.954 -5.097
155 HD1 HIS 22 1HD HIS 22 4.246 -2.707 -3.762
156 HD2 HIS 22 2HD HIS 22 1.707 -0.056 -5.707
157 HE1 HIS 22 1HE HIS 22 1.941 -3.680 -3.513
158 HE2 HIS 22 2HE HIS 22 0.433 -2.105 -4.777
159 H CYS 23 H CYS 23 2.795 0.889 -2.697
160 HA CYS 23 HA CYS 23 1.208 2.676 -4.306
161 1HB CYS 23 2HB CYS 23 0.745 1.253 -1.691
162 2HB CYS 23 1HB CYS 23 -0.408 2.421 -2.327
163 H TYR 24 H TYR 24 1.777 4.762 -4.304
164 HA TYR 24 HA TYR 24 1.875 6.144 -1.726
165 1HB TYR 24 2HB TYR 24 4.059 6.011 -3.744
166 2HB TYR 24 1HB TYR 24 3.774 7.560 -2.960
167 HD1 TYR 24 1HD TYR 24 3.183 6.973 -0.239
168 HD2 TYR 24 2HD TYR 24 5.908 4.984 -2.830
169 HE1 TYR 24 1HE TYR 24 4.483 6.227 1.711
170 HE2 TYR 24 2HE TYR 24 7.216 4.232 -0.888
171 HH TYR 24 HH TYR 24 6.940 3.857 1.485
172 H LYS 25 H LYS 25 2.212 8.668 -2.374
173 HA LYS 25 HA LYS 25 0.535 9.321 -4.674
174 1HB LYS 25 2HB LYS 25 -0.955 10.730 -3.362
175 2HB LYS 25 1HB LYS 25 -1.019 9.071 -2.781
176 1HG LYS 25 2HG LYS 25 0.439 9.650 -0.921
177 2HG LYS 25 1HG LYS 25 0.543 11.310 -1.510
178 1HD LYS 25 2HD LYS 25 -1.165 11.664 -0.085
179 2HD LYS 25 1HD LYS 25 -2.142 10.983 -1.387
180 1HE LYS 25 2HE LYS 25 -2.827 9.760 0.460
181 2HE LYS 25 1HE LYS 25 -1.619 8.710 -0.279
182 1HZ LYS 25 1HZ LYS 25 -1.568 9.200 2.264
183 2HZ LYS 25 2HZ LYS 25 -0.770 10.613 1.788
184 3HZ LYS 25 3HZ LYS 25 -0.124 9.102 1.388
Start of MODEL 11
1 1H PHE 1 1HT PHE 1 -2.696 2.858 4.483
2 2H PHE 1 2HT PHE 1 -3.291 2.264 2.987
3 3H PHE 1 3HT PHE 1 -1.648 2.017 3.418
4 HA PHE 1 HA PHE 1 -2.165 0.507 5.045
5 1HB PHE 1 2HB PHE 1 -4.286 2.106 5.543
6 2HB PHE 1 1HB PHE 1 -5.104 0.763 4.752
7 HD1 PHE 1 1HD PHE 1 -5.815 -0.996 6.045
8 HD2 PHE 1 2HD PHE 1 -2.571 1.393 7.415
9 HE1 PHE 1 1HE PHE 1 -5.778 -2.262 8.153
10 HE2 PHE 1 2HE PHE 1 -2.528 0.130 9.526
11 HZ PHE 1 HZ PHE 1 -4.132 -1.700 9.897
12 H VAL 2 H VAL 2 -1.906 -1.458 4.218
13 HA VAL 2 HA VAL 2 -2.517 -2.138 1.579
14 HB VAL 2 HB VAL 2 -0.777 -3.278 2.887
15 1HG1 VAL 2 1HG1 VAL 2 -1.541 -5.136 4.429
16 2HG1 VAL 2 2HG1 VAL 2 -3.127 -4.365 4.416
17 3HG1 VAL 2 3HG1 VAL 2 -1.727 -3.491 5.036
18 1HG2 VAL 2 1HG2 VAL 2 -0.933 -5.206 1.703
19 2HG2 VAL 2 2HG2 VAL 2 -2.258 -4.336 0.930
20 3HG2 VAL 2 3HG2 VAL 2 -2.597 -5.509 2.204
21 H SER 3 H SER 3 -4.371 -2.470 4.517
22 HA SER 3 HA SER 3 -6.298 -4.292 3.441
23 1HB SER 3 2HB SER 3 -5.657 -3.610 5.960
24 2HB SER 3 1HB SER 3 -7.042 -2.543 5.725
25 HG SER 3 HG SER 3 -8.298 -4.344 5.236
26 H THR 4 H THR 4 -5.926 -0.829 3.535
27 HA THR 4 HA THR 4 -8.625 -0.474 2.439
28 HB THR 4 HB THR 4 -6.813 1.791 3.198
29 HG1 THR 4 1HG THR 4 -8.305 0.142 4.944
30 1HG2 THR 4 1HG2 THR 4 -9.230 1.916 2.139
31 2HG2 THR 4 2HG2 THR 4 -8.675 3.068 3.354
32 3HG2 THR 4 3HG2 THR 4 -9.702 1.714 3.827
33 H CYS 5 H CYS 5 -6.001 -1.371 1.064
34 HA CYS 5 HA CYS 5 -5.265 0.661 -0.753
35 1HB CYS 5 2HB CYS 5 -3.891 -1.353 -0.287
36 2HB CYS 5 1HB CYS 5 -5.086 -2.336 -1.127
37 H TYR 6 H TYR 6 -6.185 1.375 -2.574
38 HA TYR 6 HA TYR 6 -8.749 0.264 -3.351
39 1HB TYR 6 2HB TYR 6 -8.890 2.230 -4.840
40 2HB TYR 6 1HB TYR 6 -8.549 2.684 -3.174
41 HD1 TYR 6 1HD TYR 6 -7.226 2.526 -6.581
42 HD2 TYR 6 2HD TYR 6 -6.384 3.607 -2.553
43 HE1 TYR 6 1HE TYR 6 -5.262 3.797 -7.339
44 HE2 TYR 6 2HE TYR 6 -4.419 4.882 -3.300
45 HH TYR 6 HH TYR 6 -3.631 6.000 -5.383
46 H LEU 7 H LEU 7 -5.548 0.762 -4.780
47 HA LEU 7 HA LEU 7 -6.281 -0.397 -7.297
48 1HB LEU 7 2HB LEU 7 -3.919 -0.227 -7.846
49 2HB LEU 7 1HB LEU 7 -4.507 1.270 -7.149
50 HG LEU 7 HG LEU 7 -3.282 -0.628 -5.245
51 1HD1 LEU 7 1HD1 LEU 7 -1.153 -0.589 -5.990
52 2HD1 LEU 7 2HD1 LEU 7 -1.329 0.993 -6.748
53 3HD1 LEU 7 3HD1 LEU 7 -1.943 -0.447 -7.560
54 1HD2 LEU 7 1HD2 LEU 7 -3.036 1.229 -4.030
55 2HD2 LEU 7 2HD2 LEU 7 -4.070 2.011 -5.226
56 3HD2 LEU 7 3HD2 LEU 7 -2.315 2.115 -5.375
57 HA PRO 8 HA PRO 8 -5.700 -4.652 -6.245
58 1HB PRO 8 2HB PRO 8 -5.249 -5.698 -8.694
59 2HB PRO 8 1HB PRO 8 -6.839 -5.104 -8.198
60 1HG PRO 8 2HG PRO 8 -4.750 -3.756 -9.867
61 2HG PRO 8 1HG PRO 8 -6.505 -3.827 -10.113
62 1HD PRO 8 2HD PRO 8 -5.248 -1.675 -9.026
63 2HD PRO 8 1HD PRO 8 -6.911 -2.136 -8.611
64 H LYS 9 H LYS 9 -4.105 -6.527 -7.279
65 HA LYS 9 HA LYS 9 -2.006 -7.395 -7.192
66 1HB LYS 9 2HB LYS 9 -1.886 -5.479 -9.062
67 2HB LYS 9 1HB LYS 9 -0.729 -4.811 -7.917
68 1HG LYS 9 2HG LYS 9 0.805 -6.421 -8.316
69 2HG LYS 9 1HG LYS 9 -0.413 -7.669 -8.587
70 1HD LYS 9 2HD LYS 9 -0.862 -6.046 -10.710
71 2HD LYS 9 1HD LYS 9 0.876 -5.833 -10.491
72 1HE LYS 9 2HE LYS 9 0.742 -7.642 -11.944
73 2HE LYS 9 1HE LYS 9 0.957 -8.403 -10.369
74 1HZ LYS 9 1HZ LYS 9 -0.854 -9.286 -11.942
75 2HZ LYS 9 2HZ LYS 9 -1.749 -7.942 -11.440
76 3HZ LYS 9 3HZ LYS 9 -1.234 -9.085 -10.306
77 H CYS 10 H CYS 10 -3.065 -6.332 -4.798
78 HA CYS 10 HA CYS 10 -0.564 -5.761 -3.388
79 1HB CYS 10 2HB CYS 10 -2.638 -3.852 -3.790
80 2HB CYS 10 1HB CYS 10 -2.647 -4.299 -2.088
81 H ALA 11 H ALA 11 -0.843 -6.022 -0.981
82 HA ALA 11 HA ALA 11 -1.355 -7.342 0.799
83 1HB ALA 11 1HB ALA 11 -4.075 -7.953 -0.204
84 2HB ALA 11 2HB ALA 11 -3.680 -6.259 0.084
85 3HB ALA 11 3HB ALA 11 -3.546 -7.430 1.395
86 H ALA 12 H ALA 12 0.123 -8.955 0.083
87 HA ALA 12 HA ALA 12 -1.137 -11.311 -1.154
88 1HB ALA 12 1HB ALA 12 1.666 -10.264 -1.215
89 2HB ALA 12 2HB ALA 12 0.617 -10.727 -2.555
90 3HB ALA 12 3HB ALA 12 1.336 -11.968 -1.529
91 H ALA 13 H ALA 13 0.696 -10.147 1.582
92 HA ALA 13 HA ALA 13 0.192 -12.697 2.941
93 1HB ALA 13 1HB ALA 13 2.363 -13.035 3.617
94 2HB ALA 13 2HB ALA 13 2.803 -11.338 3.424
95 3HB ALA 13 3HB ALA 13 2.616 -12.367 2.005
96 H ALA 14 H ALA 14 -1.087 -10.070 3.058
97 HA ALA 14 HA ALA 14 -1.928 -8.622 4.600
98 1HB ALA 14 1HB ALA 14 -2.057 -10.966 5.784
99 2HB ALA 14 2HB ALA 14 -2.425 -9.482 6.664
100 3HB ALA 14 3HB ALA 14 -0.847 -10.248 6.848
101 H ASN 15 H ASN 15 0.808 -8.267 3.644
102 HA ASN 15 HA ASN 15 2.137 -7.056 5.955
103 1HB ASN 15 2HB ASN 15 3.220 -8.583 4.047
104 2HB ASN 15 1HB ASN 15 3.392 -7.019 3.256
105 1HD2 ASN 15 1HD2 ASN 15 4.881 -9.179 5.215
106 2HD2 ASN 15 2HD2 ASN 15 6.008 -8.133 6.004
107 H VAL 16 H VAL 16 2.190 -4.922 6.269
108 HA VAL 16 HA VAL 16 0.685 -3.192 4.554
109 HB VAL 16 HB VAL 16 0.694 -2.876 6.989
110 1HG1 VAL 16 1HG1 VAL 16 3.576 -2.062 6.621
111 2HG1 VAL 16 2HG1 VAL 16 3.005 -3.518 7.437
112 3HG1 VAL 16 3HG1 VAL 16 2.646 -1.930 8.115
113 1HG2 VAL 16 1HG2 VAL 16 1.037 -0.435 7.002
114 2HG2 VAL 16 2HG2 VAL 16 0.137 -0.982 5.587
115 3HG2 VAL 16 3HG2 VAL 16 1.842 -0.558 5.438
116 H ALA 17 H ALA 17 4.112 -3.681 5.255
117 HA ALA 17 HA ALA 17 5.144 -1.472 3.890
118 1HB ALA 17 1HB ALA 17 6.275 -4.176 4.528
119 2HB ALA 17 2HB ALA 17 6.648 -2.617 5.263
120 3HB ALA 17 3HB ALA 17 7.203 -2.977 3.627
121 H ALA 18 H ALA 18 4.425 -4.748 2.733
122 HA ALA 18 HA ALA 18 5.391 -4.474 0.128
123 1HB ALA 18 1HB ALA 18 2.946 -6.097 0.554
124 2HB ALA 18 2HB ALA 18 4.386 -6.525 1.478
125 3HB ALA 18 3HB ALA 18 4.444 -6.501 -0.284
126 H HIS 19 H HIS 19 2.637 -3.070 1.616
127 HA HIS 19 HA HIS 19 1.246 -2.590 -0.884
128 1HB HIS 19 2HB HIS 19 -0.305 -2.943 0.797
129 2HB HIS 19 1HB HIS 19 0.667 -2.125 2.013
130 HD2 HIS 19 2HD HIS 19 -0.468 0.160 2.758
131 HE1 HIS 19 1HE HIS 19 -2.378 1.080 -0.905
132 HE2 HIS 19 2HE HIS 19 -1.849 1.909 1.432
133 H ILE 20 H ILE 20 2.293 -0.425 1.753
134 HA ILE 20 HA ILE 20 2.200 1.922 0.238
135 HB ILE 20 HB ILE 20 2.256 1.900 2.694
136 1HG1 ILE 20 2HG1 ILE 20 4.687 3.469 2.068
137 2HG1 ILE 20 1HG1 ILE 20 3.289 3.784 1.045
138 1HG2 ILE 20 1HG2 ILE 20 4.294 0.153 2.497
139 2HG2 ILE 20 2HG2 ILE 20 3.945 1.093 3.947
140 3HG2 ILE 20 3HG2 ILE 20 5.188 1.639 2.821
141 1HD1 ILE 20 1HD1 ILE 20 2.710 3.710 3.914
142 2HD1 ILE 20 2HD1 ILE 20 2.189 4.850 2.673
143 3HD1 ILE 20 3HD1 ILE 20 3.787 5.010 3.403
144 H THR 21 H THR 21 4.589 -0.573 0.301
145 HA THR 21 HA THR 21 6.936 0.705 -0.314
146 HB THR 21 HB THR 21 6.834 -1.699 -0.033
147 HG1 THR 21 1HG THR 21 8.596 -1.167 -1.193
148 1HG2 THR 21 1HG2 THR 21 5.749 -3.196 -1.359
149 2HG2 THR 21 2HG2 THR 21 5.774 -2.135 -2.768
150 3HG2 THR 21 3HG2 THR 21 4.635 -1.833 -1.456
151 H HIS 22 H HIS 22 4.368 -0.215 -2.594
152 HA HIS 22 HA HIS 22 5.639 1.513 -4.610
153 1HB HIS 22 2HB HIS 22 4.391 0.244 -6.289
154 2HB HIS 22 1HB HIS 22 5.367 -0.833 -5.296
155 HD1 HIS 22 1HD HIS 22 4.152 -2.611 -3.960
156 HD2 HIS 22 2HD HIS 22 1.581 0.078 -5.810
157 HE1 HIS 22 1HE HIS 22 1.851 -3.589 -3.693
158 HE2 HIS 22 2HE HIS 22 0.323 -1.991 -4.903
159 H CYS 23 H CYS 23 2.742 0.924 -2.773
160 HA CYS 23 HA CYS 23 1.122 2.774 -4.272
161 1HB CYS 23 2HB CYS 23 0.723 1.241 -1.712
162 2HB CYS 23 1HB CYS 23 -0.438 2.448 -2.251
163 H TYR 24 H TYR 24 1.191 4.904 -4.079
164 HA TYR 24 HA TYR 24 1.895 6.077 -1.479
165 1HB TYR 24 2HB TYR 24 3.700 6.049 -3.482
166 2HB TYR 24 1HB TYR 24 2.834 7.527 -3.888
167 HD1 TYR 24 1HD TYR 24 3.945 5.971 -0.671
168 HD2 TYR 24 2HD TYR 24 4.000 9.390 -3.202
169 HE1 TYR 24 1HE TYR 24 5.253 7.191 1.017
170 HE2 TYR 24 2HE TYR 24 5.309 10.620 -1.522
171 HH TYR 24 HH TYR 24 5.566 10.390 1.140
172 H LYS 25 H LYS 25 0.944 8.073 -1.017
173 HA LYS 25 HA LYS 25 -0.708 9.634 -1.020
174 1HB LYS 25 2HB LYS 25 -0.214 9.358 -3.979
175 2HB LYS 25 1HB LYS 25 -1.403 10.483 -3.338
176 1HG LYS 25 2HG LYS 25 1.326 10.599 -2.195
177 2HG LYS 25 1HG LYS 25 1.106 11.183 -3.847
178 1HD LYS 25 2HD LYS 25 -0.701 12.662 -3.050
179 2HD LYS 25 1HD LYS 25 -0.400 12.112 -1.401
180 1HE LYS 25 2HE LYS 25 1.615 13.217 -1.257
181 2HE LYS 25 1HE LYS 25 1.860 13.218 -3.002
182 1HZ LYS 25 1HZ LYS 25 0.636 15.083 -3.268
183 2HZ LYS 25 2HZ LYS 25 1.124 15.367 -1.673
184 3HZ LYS 25 3HZ LYS 25 -0.413 14.735 -1.986
Start of MODEL 12
1 1H PHE 1 1HT PHE 1 -1.843 2.036 5.900
2 2H PHE 1 2HT PHE 1 -3.267 2.045 4.943
3 3H PHE 1 3HT PHE 1 -1.739 1.778 4.208
4 HA PHE 1 HA PHE 1 -1.546 -0.212 5.672
5 1HB PHE 1 2HB PHE 1 -4.485 0.451 5.951
6 2HB PHE 1 1HB PHE 1 -3.785 -1.110 6.369
7 HD1 PHE 1 1HD PHE 1 -4.397 2.260 7.440
8 HD2 PHE 1 2HD PHE 1 -2.069 -1.221 8.195
9 HE1 PHE 1 1HE PHE 1 -3.870 3.106 9.689
10 HE2 PHE 1 2HE PHE 1 -1.539 -0.382 10.447
11 HZ PHE 1 HZ PHE 1 -2.439 1.784 11.196
12 H VAL 2 H VAL 2 -2.033 -2.245 4.683
13 HA VAL 2 HA VAL 2 -2.364 -2.063 1.858
14 HB VAL 2 HB VAL 2 -0.897 -3.745 2.883
15 1HG1 VAL 2 1HG1 VAL 2 -3.278 -5.365 3.677
16 2HG1 VAL 2 2HG1 VAL 2 -2.636 -4.146 4.779
17 3HG1 VAL 2 3HG1 VAL 2 -1.609 -5.473 4.236
18 1HG2 VAL 2 1HG2 VAL 2 -1.193 -5.191 1.182
19 2HG2 VAL 2 2HG2 VAL 2 -2.439 -4.048 0.681
20 3HG2 VAL 2 3HG2 VAL 2 -2.882 -5.491 1.594
21 H SER 3 H SER 3 -4.397 -3.218 4.512
22 HA SER 3 HA SER 3 -6.462 -4.332 2.990
23 1HB SER 3 2HB SER 3 -6.443 -3.075 5.735
24 2HB SER 3 1HB SER 3 -7.882 -3.824 5.044
25 HG SER 3 HG SER 3 -6.522 -5.212 6.386
26 H THR 4 H THR 4 -5.747 -1.019 3.839
27 HA THR 4 HA THR 4 -8.285 0.029 3.027
28 HB THR 4 HB THR 4 -6.754 2.210 2.976
29 HG1 THR 4 1HG THR 4 -4.816 1.865 3.651
30 1HG2 THR 4 1HG2 THR 4 -8.371 2.223 4.611
31 2HG2 THR 4 2HG2 THR 4 -6.883 2.206 5.558
32 3HG2 THR 4 3HG2 THR 4 -7.803 0.718 5.333
33 H CYS 5 H CYS 5 -5.429 -0.920 1.388
34 HA CYS 5 HA CYS 5 -5.354 0.776 -0.802
35 1HB CYS 5 2HB CYS 5 -3.729 -1.086 -0.199
36 2HB CYS 5 1HB CYS 5 -4.857 -2.195 -0.970
37 H TYR 6 H TYR 6 -6.064 0.395 -3.022
38 HA TYR 6 HA TYR 6 -8.634 -1.038 -3.164
39 1HB TYR 6 2HB TYR 6 -9.390 0.768 -4.742
40 2HB TYR 6 1HB TYR 6 -9.174 1.293 -3.076
41 HD1 TYR 6 1HD TYR 6 -8.368 1.944 -6.469
42 HD2 TYR 6 2HD TYR 6 -6.904 2.406 -2.501
43 HE1 TYR 6 1HE TYR 6 -6.869 3.736 -7.237
44 HE2 TYR 6 2HE TYR 6 -5.401 4.200 -3.257
45 HH TYR 6 HH TYR 6 -4.359 5.001 -5.273
46 H LEU 7 H LEU 7 -5.835 0.184 -4.951
47 HA LEU 7 HA LEU 7 -6.516 -1.169 -7.376
48 1HB LEU 7 2HB LEU 7 -4.376 -0.444 -8.187
49 2HB LEU 7 1HB LEU 7 -5.126 0.874 -7.305
50 HG LEU 7 HG LEU 7 -3.300 -0.833 -5.732
51 1HD1 LEU 7 1HD1 LEU 7 -1.752 -0.813 -7.386
52 2HD1 LEU 7 2HD1 LEU 7 -1.449 0.800 -6.740
53 3HD1 LEU 7 3HD1 LEU 7 -2.451 0.598 -8.178
54 1HD2 LEU 7 1HD2 LEU 7 -4.047 0.968 -4.524
55 2HD2 LEU 7 2HD2 LEU 7 -4.091 2.033 -5.928
56 3HD2 LEU 7 3HD2 LEU 7 -2.546 1.619 -5.183
57 HA PRO 8 HA PRO 8 -5.118 -5.278 -6.584
58 1HB PRO 8 2HB PRO 8 -3.894 -5.167 -9.290
59 2HB PRO 8 1HB PRO 8 -5.053 -6.322 -8.626
60 1HG PRO 8 2HG PRO 8 -5.826 -4.465 -10.374
61 2HG PRO 8 1HG PRO 8 -6.864 -4.928 -9.013
62 1HD PRO 8 2HD PRO 8 -5.166 -2.494 -9.363
63 2HD PRO 8 1HD PRO 8 -6.767 -2.655 -8.615
64 H LYS 9 H LYS 9 -2.922 -6.581 -7.485
65 HA LYS 9 HA LYS 9 -0.725 -6.935 -7.010
66 1HB LYS 9 2HB LYS 9 -0.776 -4.112 -7.988
67 2HB LYS 9 1HB LYS 9 0.717 -4.743 -7.307
68 1HG LYS 9 2HG LYS 9 0.784 -5.018 -9.677
69 2HG LYS 9 1HG LYS 9 0.609 -6.611 -8.937
70 1HD LYS 9 2HD LYS 9 -1.915 -5.253 -9.602
71 2HD LYS 9 1HD LYS 9 -0.914 -5.698 -10.986
72 1HE LYS 9 2HE LYS 9 -0.846 -8.001 -10.233
73 2HE LYS 9 1HE LYS 9 -1.757 -7.578 -8.784
74 1HZ LYS 9 1HZ LYS 9 -2.694 -7.663 -11.584
75 2HZ LYS 9 2HZ LYS 9 -3.531 -6.782 -10.407
76 3HZ LYS 9 3HZ LYS 9 -3.334 -8.452 -10.231
77 H CYS 10 H CYS 10 -2.527 -6.205 -4.841
78 HA CYS 10 HA CYS 10 -0.504 -5.600 -2.853
79 1HB CYS 10 2HB CYS 10 -2.656 -3.721 -3.608
80 2HB CYS 10 1HB CYS 10 -2.462 -3.987 -1.879
81 H ALA 11 H ALA 11 -1.234 -6.045 -0.659
82 HA ALA 11 HA ALA 11 -2.239 -7.353 0.907
83 1HB ALA 11 1HB ALA 11 -4.550 -7.347 1.023
84 2HB ALA 11 2HB ALA 11 -4.741 -7.434 -0.728
85 3HB ALA 11 3HB ALA 11 -4.220 -5.929 0.027
86 H ALA 12 H ALA 12 -0.698 -8.979 -0.006
87 HA ALA 12 HA ALA 12 -2.119 -11.203 -1.313
88 1HB ALA 12 1HB ALA 12 -0.033 -10.108 -2.381
89 2HB ALA 12 2HB ALA 12 -0.142 -11.868 -2.330
90 3HB ALA 12 3HB ALA 12 0.865 -11.013 -1.162
91 H ALA 13 H ALA 13 -0.172 -10.259 1.431
92 HA ALA 13 HA ALA 13 -0.939 -12.705 2.803
93 1HB ALA 13 1HB ALA 13 1.510 -12.917 3.604
94 2HB ALA 13 2HB ALA 13 1.894 -11.994 2.151
95 3HB ALA 13 3HB ALA 13 1.073 -13.549 2.017
96 H ALA 14 H ALA 14 -1.569 -9.865 3.040
97 HA ALA 14 HA ALA 14 -1.885 -8.296 4.658
98 1HB ALA 14 1HB ALA 14 -2.357 -10.561 5.894
99 2HB ALA 14 2HB ALA 14 -2.257 -9.048 6.795
100 3HB ALA 14 3HB ALA 14 -0.880 -10.149 6.765
101 H ASN 15 H ASN 15 -0.074 -7.138 3.706
102 HA ASN 15 HA ASN 15 2.032 -6.711 5.676
103 1HB ASN 15 2HB ASN 15 2.627 -8.329 3.603
104 2HB ASN 15 1HB ASN 15 2.980 -6.770 2.866
105 1HD2 ASN 15 1HD2 ASN 15 5.099 -6.545 2.882
106 2HD2 ASN 15 2HD2 ASN 15 6.134 -6.792 4.243
107 H VAL 16 H VAL 16 2.099 -4.612 6.088
108 HA VAL 16 HA VAL 16 0.794 -2.697 4.423
109 HB VAL 16 HB VAL 16 0.871 -2.452 6.869
110 1HG1 VAL 16 1HG1 VAL 16 2.791 -2.099 8.100
111 2HG1 VAL 16 2HG1 VAL 16 3.717 -1.557 6.699
112 3HG1 VAL 16 3HG1 VAL 16 3.342 -3.269 6.901
113 1HG2 VAL 16 1HG2 VAL 16 0.382 -0.379 6.158
114 2HG2 VAL 16 2HG2 VAL 16 1.693 -0.365 4.978
115 3HG2 VAL 16 3HG2 VAL 16 2.025 0.002 6.670
116 H ALA 17 H ALA 17 4.172 -3.503 5.097
117 HA ALA 17 HA ALA 17 5.382 -1.382 3.736
118 1HB ALA 17 1HB ALA 17 6.368 -4.201 4.154
119 2HB ALA 17 2HB ALA 17 6.652 -2.814 5.205
120 3HB ALA 17 3HB ALA 17 7.362 -2.857 3.591
121 H ALA 18 H ALA 18 4.556 -4.644 2.570
122 HA ALA 18 HA ALA 18 5.477 -4.344 -0.049
123 1HB ALA 18 1HB ALA 18 3.189 -6.031 0.957
124 2HB ALA 18 2HB ALA 18 4.885 -6.507 0.885
125 3HB ALA 18 3HB ALA 18 3.988 -6.213 -0.605
126 H HIS 19 H HIS 19 2.741 -2.962 1.497
127 HA HIS 19 HA HIS 19 1.324 -2.451 -0.984
128 1HB HIS 19 2HB HIS 19 -0.234 -2.825 0.672
129 2HB HIS 19 1HB HIS 19 0.758 -2.089 1.923
130 HD2 HIS 19 2HD HIS 19 -0.306 0.191 2.783
131 HE1 HIS 19 1HE HIS 19 -2.261 1.305 -0.801
132 HE2 HIS 19 2HE HIS 19 -1.956 1.846 1.658
133 H ILE 20 H ILE 20 2.464 -0.364 1.681
134 HA ILE 20 HA ILE 20 2.317 2.027 0.224
135 HB ILE 20 HB ILE 20 2.415 1.961 2.673
136 1HG1 ILE 20 2HG1 ILE 20 4.822 3.502 1.734
137 2HG1 ILE 20 1HG1 ILE 20 3.199 3.955 1.224
138 1HG2 ILE 20 1HG2 ILE 20 4.947 0.603 2.134
139 2HG2 ILE 20 2HG2 ILE 20 3.890 0.521 3.542
140 3HG2 ILE 20 3HG2 ILE 20 5.045 1.844 3.384
141 1HD1 ILE 20 1HD1 ILE 20 3.589 3.576 4.118
142 2HD1 ILE 20 2HD1 ILE 20 2.658 4.791 3.241
143 3HD1 ILE 20 3HD1 ILE 20 4.407 4.957 3.387
144 H THR 21 H THR 21 4.639 -0.495 0.086
145 HA THR 21 HA THR 21 7.009 0.769 -0.496
146 HB THR 21 HB THR 21 6.822 -1.656 -0.334
147 HG1 THR 21 1HG THR 21 8.605 -1.406 -1.421
148 1HG2 THR 21 1HG2 THR 21 5.747 -3.043 -1.797
149 2HG2 THR 21 2HG2 THR 21 5.768 -1.861 -3.105
150 3HG2 THR 21 3HG2 THR 21 4.641 -1.669 -1.762
151 H HIS 22 H HIS 22 4.365 0.035 -2.754
152 HA HIS 22 HA HIS 22 5.630 1.838 -4.707
153 1HB HIS 22 2HB HIS 22 4.327 0.676 -6.425
154 2HB HIS 22 1HB HIS 22 5.314 -0.462 -5.514
155 HD1 HIS 22 1HD HIS 22 4.121 -2.355 -4.372
156 HD2 HIS 22 2HD HIS 22 1.518 0.570 -5.760
157 HE1 HIS 22 1HE HIS 22 1.815 -3.310 -4.070
158 HE2 HIS 22 2HE HIS 22 0.261 -1.559 -5.004
159 H CYS 23 H CYS 23 2.735 1.165 -2.881
160 HA CYS 23 HA CYS 23 1.102 3.091 -4.244
161 1HB CYS 23 2HB CYS 23 0.787 1.482 -1.720
162 2HB CYS 23 1HB CYS 23 -0.374 2.731 -2.154
163 H TYR 24 H TYR 24 1.074 5.214 -3.950
164 HA TYR 24 HA TYR 24 1.706 6.360 -1.355
165 1HB TYR 24 2HB TYR 24 3.460 6.590 -3.742
166 2HB TYR 24 1HB TYR 24 3.205 8.053 -2.798
167 HD1 TYR 24 1HD TYR 24 3.368 7.536 -0.121
168 HD2 TYR 24 2HD TYR 24 5.353 5.398 -3.218
169 HE1 TYR 24 1HE TYR 24 5.073 6.799 1.490
170 HE2 TYR 24 2HE TYR 24 7.064 4.654 -1.615
171 HH TYR 24 HH TYR 24 7.353 4.350 0.762
172 H LYS 25 H LYS 25 1.727 8.957 -1.798
173 HA LYS 25 HA LYS 25 -0.410 9.657 -3.656
174 1HB LYS 25 2HB LYS 25 -1.728 10.785 -1.946
175 2HB LYS 25 1HB LYS 25 -1.558 9.078 -1.559
176 1HG LYS 25 2HG LYS 25 -1.071 9.866 0.485
177 2HG LYS 25 1HG LYS 25 0.540 10.073 -0.202
178 1HD LYS 25 2HD LYS 25 -0.231 12.403 -0.890
179 2HD LYS 25 1HD LYS 25 -1.609 12.142 0.180
180 1HE LYS 25 2HE LYS 25 -0.091 13.240 1.549
181 2HE LYS 25 1HE LYS 25 0.171 11.543 1.950
182 1HZ LYS 25 1HZ LYS 25 1.850 13.284 0.240
183 2HZ LYS 25 2HZ LYS 25 2.019 11.601 0.269
184 3HZ LYS 25 3HZ LYS 25 2.288 12.501 1.675
Start of MODEL 13
1 1H PHE 1 1HT PHE 1 -2.229 2.290 5.835
2 2H PHE 1 2HT PHE 1 -3.243 2.160 4.456
3 3H PHE 1 3HT PHE 1 -1.555 1.886 4.311
4 HA PHE 1 HA PHE 1 -1.720 -0.020 5.718
5 1HB PHE 1 2HB PHE 1 -4.561 0.937 5.852
6 2HB PHE 1 1HB PHE 1 -4.209 -0.776 6.053
7 HD1 PHE 1 1HD PHE 1 -3.062 -1.592 8.007
8 HD2 PHE 1 2HD PHE 1 -3.832 2.563 7.498
9 HE1 PHE 1 1HE PHE 1 -2.533 -1.207 10.379
10 HE2 PHE 1 2HE PHE 1 -3.303 2.956 9.869
11 HZ PHE 1 HZ PHE 1 -2.652 1.070 11.312
12 H VAL 2 H VAL 2 -2.046 -2.070 4.775
13 HA VAL 2 HA VAL 2 -2.216 -2.049 1.934
14 HB VAL 2 HB VAL 2 -0.780 -3.639 3.134
15 1HG1 VAL 2 1HG1 VAL 2 -1.683 -5.520 4.335
16 2HG1 VAL 2 2HG1 VAL 2 -3.332 -5.008 3.976
17 3HG1 VAL 2 3HG1 VAL 2 -2.316 -4.032 5.038
18 1HG2 VAL 2 1HG2 VAL 2 -1.882 -4.077 0.833
19 2HG2 VAL 2 2HG2 VAL 2 -2.824 -5.290 1.701
20 3HG2 VAL 2 3HG2 VAL 2 -1.065 -5.404 1.657
21 H SER 3 H SER 3 -4.367 -3.200 4.508
22 HA SER 3 HA SER 3 -6.313 -4.389 2.890
23 1HB SER 3 2HB SER 3 -6.551 -3.062 5.597
24 2HB SER 3 1HB SER 3 -7.850 -3.982 4.841
25 HG SER 3 HG SER 3 -6.852 -5.500 5.985
26 H THR 4 H THR 4 -5.988 -1.054 4.032
27 HA THR 4 HA THR 4 -8.422 -0.092 3.003
28 HB THR 4 HB THR 4 -7.480 2.126 3.293
29 HG1 THR 4 1HG THR 4 -5.279 2.371 3.770
30 1HG2 THR 4 1HG2 THR 4 -8.095 1.001 5.355
31 2HG2 THR 4 2HG2 THR 4 -6.694 2.046 5.592
32 3HG2 THR 4 3HG2 THR 4 -6.481 0.300 5.463
33 H CYS 5 H CYS 5 -5.492 -0.959 1.445
34 HA CYS 5 HA CYS 5 -5.444 0.714 -0.767
35 1HB CYS 5 2HB CYS 5 -3.721 -1.015 -0.120
36 2HB CYS 5 1HB CYS 5 -4.778 -2.231 -0.827
37 H TYR 6 H TYR 6 -6.207 0.464 -2.915
38 HA TYR 6 HA TYR 6 -8.644 -1.181 -3.129
39 1HB TYR 6 2HB TYR 6 -9.379 0.617 -4.802
40 2HB TYR 6 1HB TYR 6 -9.405 1.047 -3.095
41 HD1 TYR 6 1HD TYR 6 -7.296 1.313 -6.152
42 HD2 TYR 6 2HD TYR 6 -8.285 2.954 -2.354
43 HE1 TYR 6 1HE TYR 6 -5.869 3.258 -6.628
44 HE2 TYR 6 2HE TYR 6 -6.862 4.905 -2.820
45 HH TYR 6 HH TYR 6 -5.909 6.085 -4.693
46 H LEU 7 H LEU 7 -5.812 0.092 -4.793
47 HA LEU 7 HA LEU 7 -6.391 -1.199 -7.278
48 1HB LEU 7 2HB LEU 7 -4.129 -0.533 -7.918
49 2HB LEU 7 1HB LEU 7 -5.016 0.803 -7.208
50 HG LEU 7 HG LEU 7 -3.793 0.051 -5.005
51 1HD1 LEU 7 1HD1 LEU 7 -2.493 -1.739 -5.382
52 2HD1 LEU 7 2HD1 LEU 7 -1.364 -0.555 -6.039
53 3HD1 LEU 7 3HD1 LEU 7 -2.427 -1.455 -7.121
54 1HD2 LEU 7 1HD2 LEU 7 -3.272 2.181 -5.574
55 2HD2 LEU 7 2HD2 LEU 7 -2.938 1.768 -7.256
56 3HD2 LEU 7 3HD2 LEU 7 -1.737 1.431 -6.009
57 HA PRO 8 HA PRO 8 -5.086 -5.340 -6.456
58 1HB PRO 8 2HB PRO 8 -3.848 -5.240 -9.157
59 2HB PRO 8 1HB PRO 8 -5.026 -6.381 -8.500
60 1HG PRO 8 2HG PRO 8 -5.766 -4.511 -10.248
61 2HG PRO 8 1HG PRO 8 -6.817 -4.963 -8.892
62 1HD PRO 8 2HD PRO 8 -5.087 -2.550 -9.230
63 2HD PRO 8 1HD PRO 8 -6.694 -2.695 -8.486
64 H LYS 9 H LYS 9 -2.912 -6.681 -7.311
65 HA LYS 9 HA LYS 9 -0.724 -7.065 -6.818
66 1HB LYS 9 2HB LYS 9 -0.663 -4.212 -7.754
67 2HB LYS 9 1HB LYS 9 0.805 -5.007 -7.201
68 1HG LYS 9 2HG LYS 9 0.556 -5.090 -9.636
69 2HG LYS 9 1HG LYS 9 0.575 -6.700 -8.912
70 1HD LYS 9 2HD LYS 9 -1.846 -6.823 -9.068
71 2HD LYS 9 1HD LYS 9 -1.906 -5.184 -9.718
72 1HE LYS 9 2HE LYS 9 -0.999 -5.817 -11.752
73 2HE LYS 9 1HE LYS 9 -0.265 -7.275 -11.085
74 1HZ LYS 9 1HZ LYS 9 -2.297 -7.569 -12.545
75 2HZ LYS 9 2HZ LYS 9 -3.199 -6.947 -11.256
76 3HZ LYS 9 3HZ LYS 9 -2.313 -8.373 -11.056
77 H CYS 10 H CYS 10 -2.517 -6.274 -4.669
78 HA CYS 10 HA CYS 10 -0.490 -5.644 -2.689
79 1HB CYS 10 2HB CYS 10 -2.687 -3.799 -3.442
80 2HB CYS 10 1HB CYS 10 -2.401 -4.010 -1.718
81 H ALA 11 H ALA 11 -1.356 -5.894 -0.447
82 HA ALA 11 HA ALA 11 -2.376 -7.158 1.146
83 1HB ALA 11 1HB ALA 11 -4.556 -6.596 -0.784
84 2HB ALA 11 2HB ALA 11 -4.428 -6.201 0.930
85 3HB ALA 11 3HB ALA 11 -4.845 -7.841 0.432
86 H ALA 12 H ALA 12 -0.697 -8.490 -0.688
87 HA ALA 12 HA ALA 12 -1.950 -10.934 -1.536
88 1HB ALA 12 1HB ALA 12 0.175 -9.680 -2.470
89 2HB ALA 12 2HB ALA 12 0.024 -11.434 -2.575
90 3HB ALA 12 3HB ALA 12 1.006 -10.708 -1.302
91 H ALA 13 H ALA 13 -0.146 -9.838 1.247
92 HA ALA 13 HA ALA 13 -0.786 -12.331 2.614
93 1HB ALA 13 1HB ALA 13 1.699 -12.109 3.550
94 2HB ALA 13 2HB ALA 13 1.958 -11.442 1.939
95 3HB ALA 13 3HB ALA 13 1.305 -13.070 2.124
96 H ALA 14 H ALA 14 -1.700 -9.563 2.783
97 HA ALA 14 HA ALA 14 -2.247 -8.015 4.359
98 1HB ALA 14 1HB ALA 14 -2.473 -10.387 5.593
99 2HB ALA 14 2HB ALA 14 -2.813 -8.848 6.384
100 3HB ALA 14 3HB ALA 14 -1.252 -9.633 6.619
101 H ASN 15 H ASN 15 0.438 -8.013 3.219
102 HA ASN 15 HA ASN 15 2.114 -7.049 5.406
103 1HB ASN 15 2HB ASN 15 2.918 -8.580 3.487
104 2HB ASN 15 1HB ASN 15 2.908 -7.118 2.505
105 1HD2 ASN 15 1HD2 ASN 15 5.243 -8.108 2.557
106 2HD2 ASN 15 2HD2 ASN 15 6.306 -7.351 3.689
107 H VAL 16 H VAL 16 2.065 -4.983 5.961
108 HA VAL 16 HA VAL 16 0.752 -3.000 4.400
109 HB VAL 16 HB VAL 16 0.809 -2.906 6.859
110 1HG1 VAL 16 1HG1 VAL 16 3.694 -2.085 6.611
111 2HG1 VAL 16 2HG1 VAL 16 3.179 -3.716 7.043
112 3HG1 VAL 16 3HG1 VAL 16 2.767 -2.355 8.087
113 1HG2 VAL 16 1HG2 VAL 16 0.262 -0.810 6.251
114 2HG2 VAL 16 2HG2 VAL 16 1.601 -0.680 5.112
115 3HG2 VAL 16 3HG2 VAL 16 1.879 -0.415 6.833
116 H ALA 17 H ALA 17 4.155 -3.695 5.113
117 HA ALA 17 HA ALA 17 5.291 -1.481 3.843
118 1HB ALA 17 1HB ALA 17 6.275 -4.218 4.520
119 2HB ALA 17 2HB ALA 17 6.796 -2.650 5.138
120 3HB ALA 17 3HB ALA 17 7.267 -3.158 3.516
121 H ALA 18 H ALA 18 4.539 -4.708 2.559
122 HA ALA 18 HA ALA 18 5.534 -4.319 -0.028
123 1HB ALA 18 1HB ALA 18 3.151 -6.033 0.625
124 2HB ALA 18 2HB ALA 18 4.801 -6.493 1.047
125 3HB ALA 18 3HB ALA 18 4.354 -6.267 -0.644
126 H HIS 19 H HIS 19 2.758 -3.006 1.497
127 HA HIS 19 HA HIS 19 1.352 -2.479 -0.982
128 1HB HIS 19 2HB HIS 19 -0.209 -2.850 0.668
129 2HB HIS 19 1HB HIS 19 0.787 -2.128 1.924
130 HD2 HIS 19 2HD HIS 19 -0.236 0.170 2.790
131 HE1 HIS 19 1HE HIS 19 -2.239 1.287 -0.767
132 HE2 HIS 19 2HE HIS 19 -1.896 1.829 1.686
133 H ILE 20 H ILE 20 2.481 -0.387 1.683
134 HA ILE 20 HA ILE 20 2.338 2.000 0.216
135 HB ILE 20 HB ILE 20 2.409 1.934 2.670
136 1HG1 ILE 20 2HG1 ILE 20 4.831 3.521 2.075
137 2HG1 ILE 20 1HG1 ILE 20 3.441 3.845 1.043
138 1HG2 ILE 20 1HG2 ILE 20 4.348 0.156 2.530
139 2HG2 ILE 20 2HG2 ILE 20 4.187 1.230 3.919
140 3HG2 ILE 20 3HG2 ILE 20 5.362 1.594 2.655
141 1HD1 ILE 20 1HD1 ILE 20 2.090 4.368 2.971
142 2HD1 ILE 20 2HD1 ILE 20 3.560 5.341 2.981
143 3HD1 ILE 20 3HD1 ILE 20 3.420 3.945 4.049
144 H THR 21 H THR 21 4.656 -0.519 0.091
145 HA THR 21 HA THR 21 7.031 0.770 -0.467
146 HB THR 21 HB THR 21 6.827 -1.667 -0.261
147 HG1 THR 21 1HG THR 21 8.611 -1.699 -1.330
148 1HG2 THR 21 1HG2 THR 21 5.942 -1.910 -3.086
149 2HG2 THR 21 2HG2 THR 21 4.730 -1.691 -1.824
150 3HG2 THR 21 3HG2 THR 21 5.830 -3.068 -1.760
151 H HIS 22 H HIS 22 4.362 0.050 -2.687
152 HA HIS 22 HA HIS 22 5.648 1.794 -4.683
153 1HB HIS 22 2HB HIS 22 4.372 0.600 -6.389
154 2HB HIS 22 1HB HIS 22 5.333 -0.529 -5.441
155 HD1 HIS 22 1HD HIS 22 4.110 -2.434 -4.384
156 HD2 HIS 22 2HD HIS 22 1.547 0.577 -5.662
157 HE1 HIS 22 1HE HIS 22 1.789 -3.350 -4.073
158 HE2 HIS 22 2HE HIS 22 0.259 -1.547 -4.942
159 H CYS 23 H CYS 23 2.713 1.105 -2.910
160 HA CYS 23 HA CYS 23 1.084 2.999 -4.295
161 1HB CYS 23 2HB CYS 23 0.796 1.436 -1.747
162 2HB CYS 23 1HB CYS 23 -0.360 2.699 -2.154
163 H TYR 24 H TYR 24 0.772 5.114 -3.921
164 HA TYR 24 HA TYR 24 1.463 6.353 -1.422
165 1HB TYR 24 2HB TYR 24 3.292 6.483 -3.747
166 2HB TYR 24 1HB TYR 24 2.969 8.012 -2.936
167 HD1 TYR 24 1HD TYR 24 3.215 7.956 -0.317
168 HD2 TYR 24 2HD TYR 24 5.003 5.141 -2.959
169 HE1 TYR 24 1HE TYR 24 4.869 7.392 1.414
170 HE2 TYR 24 2HE TYR 24 6.662 4.568 -1.236
171 HH TYR 24 HH TYR 24 7.082 6.429 1.603
172 H LYS 25 H LYS 25 1.485 8.941 -1.971
173 HA LYS 25 HA LYS 25 -1.069 9.370 -3.359
174 1HB LYS 25 2HB LYS 25 -1.305 11.383 -2.011
175 2HB LYS 25 1HB LYS 25 -1.010 9.993 -0.976
176 1HG LYS 25 2HG LYS 25 1.448 10.709 -1.038
177 2HG LYS 25 1HG LYS 25 0.842 12.241 -1.669
178 1HD LYS 25 2HD LYS 25 0.861 12.692 0.582
179 2HD LYS 25 1HD LYS 25 -0.781 12.076 0.392
180 1HE LYS 25 2HE LYS 25 0.136 11.014 2.307
181 2HE LYS 25 1HE LYS 25 0.106 9.811 1.019
182 1HZ LYS 25 1HZ LYS 25 2.375 11.060 2.340
183 2HZ LYS 25 2HZ LYS 25 2.535 10.813 0.673
184 3HZ LYS 25 3HZ LYS 25 2.218 9.503 1.696
Start of MODEL 14
1 1H PHE 1 1HT PHE 1 -2.796 2.330 4.579
2 2H PHE 1 2HT PHE 1 -3.310 1.855 3.012
3 3H PHE 1 3HT PHE 1 -1.678 1.622 3.490
4 HA PHE 1 HA PHE 1 -2.203 -0.046 4.949
5 1HB PHE 1 2HB PHE 1 -4.984 1.066 4.670
6 2HB PHE 1 1HB PHE 1 -4.725 -0.565 5.281
7 HD1 PHE 1 1HD PHE 1 -5.575 2.448 6.401
8 HD2 PHE 1 2HD PHE 1 -2.454 -0.383 6.995
9 HE1 PHE 1 1HE PHE 1 -5.181 3.361 8.651
10 HE2 PHE 1 2HE PHE 1 -2.054 0.524 9.247
11 HZ PHE 1 HZ PHE 1 -3.419 2.398 10.078
12 H VAL 2 H VAL 2 -1.843 -1.914 3.956
13 HA VAL 2 HA VAL 2 -2.350 -2.369 1.244
14 HB VAL 2 HB VAL 2 -0.598 -3.553 2.495
15 1HG1 VAL 2 1HG1 VAL 2 -2.735 -5.304 3.669
16 2HG1 VAL 2 2HG1 VAL 2 -2.095 -3.902 4.527
17 3HG1 VAL 2 3HG1 VAL 2 -1.022 -5.230 4.081
18 1HG2 VAL 2 1HG2 VAL 2 -1.473 -4.462 0.370
19 2HG2 VAL 2 2HG2 VAL 2 -2.594 -5.465 1.290
20 3HG2 VAL 2 3HG2 VAL 2 -0.856 -5.713 1.449
21 H SER 3 H SER 3 -4.077 -3.509 4.126
22 HA SER 3 HA SER 3 -5.948 -5.126 2.792
23 1HB SER 3 2HB SER 3 -5.464 -5.085 5.282
24 2HB SER 3 1HB SER 3 -6.456 -3.629 5.368
25 HG SER 3 HG SER 3 -7.233 -6.193 5.296
26 H THR 4 H THR 4 -5.804 -1.685 3.342
27 HA THR 4 HA THR 4 -8.446 -1.387 2.076
28 HB THR 4 HB THR 4 -6.991 0.714 3.680
29 HG1 THR 4 1HG THR 4 -7.407 -0.633 5.260
30 1HG2 THR 4 1HG2 THR 4 -8.679 1.765 2.455
31 2HG2 THR 4 2HG2 THR 4 -9.379 1.490 4.050
32 3HG2 THR 4 3HG2 THR 4 -9.809 0.434 2.704
33 H CYS 5 H CYS 5 -5.904 -1.844 0.691
34 HA CYS 5 HA CYS 5 -4.909 0.562 -0.399
35 1HB CYS 5 2HB CYS 5 -3.652 -1.530 -0.521
36 2HB CYS 5 1HB CYS 5 -4.893 -2.237 -1.547
37 H TYR 6 H TYR 6 -5.279 1.524 -2.429
38 HA TYR 6 HA TYR 6 -8.032 1.470 -3.247
39 1HB TYR 6 2HB TYR 6 -7.361 3.262 -4.812
40 2HB TYR 6 1HB TYR 6 -6.852 3.593 -3.160
41 HD1 TYR 6 1HD TYR 6 -5.732 2.772 -6.546
42 HD2 TYR 6 2HD TYR 6 -4.498 3.574 -2.555
43 HE1 TYR 6 1HE TYR 6 -3.423 3.093 -7.330
44 HE2 TYR 6 2HE TYR 6 -2.186 3.897 -3.328
45 HH TYR 6 HH TYR 6 -1.172 3.051 -6.496
46 H LEU 7 H LEU 7 -4.930 0.697 -4.813
47 HA LEU 7 HA LEU 7 -6.319 -0.390 -7.121
48 1HB LEU 7 2HB LEU 7 -4.110 -0.721 -8.068
49 2HB LEU 7 1HB LEU 7 -4.278 0.914 -7.455
50 HG LEU 7 HG LEU 7 -3.121 -0.073 -5.319
51 1HD1 LEU 7 1HD1 LEU 7 -2.839 -2.304 -5.624
52 2HD1 LEU 7 2HD1 LEU 7 -1.339 -1.745 -6.365
53 3HD1 LEU 7 3HD1 LEU 7 -2.721 -2.164 -7.378
54 1HD2 LEU 7 1HD2 LEU 7 -2.297 1.449 -7.430
55 2HD2 LEU 7 2HD2 LEU 7 -1.122 0.136 -7.443
56 3HD2 LEU 7 3HD2 LEU 7 -1.341 1.108 -5.989
57 HA PRO 8 HA PRO 8 -6.300 -4.572 -5.703
58 1HB PRO 8 2HB PRO 8 -6.385 -5.898 -8.053
59 2HB PRO 8 1HB PRO 8 -7.762 -4.977 -7.438
60 1HG PRO 8 2HG PRO 8 -5.728 -4.198 -9.492
61 2HG PRO 8 1HG PRO 8 -7.485 -3.963 -9.513
62 1HD PRO 8 2HD PRO 8 -5.732 -1.994 -8.839
63 2HD PRO 8 1HD PRO 8 -7.375 -2.094 -8.178
64 H LYS 9 H LYS 9 -5.194 -6.782 -6.469
65 HA LYS 9 HA LYS 9 -3.275 -8.003 -6.464
66 1HB LYS 9 2HB LYS 9 -2.638 -5.796 -8.389
67 2HB LYS 9 1HB LYS 9 -1.390 -6.952 -7.945
68 1HG LYS 9 2HG LYS 9 -3.000 -8.769 -8.637
69 2HG LYS 9 1HG LYS 9 -4.002 -7.490 -9.325
70 1HD LYS 9 2HD LYS 9 -2.478 -7.001 -10.981
71 2HD LYS 9 1HD LYS 9 -1.110 -7.610 -10.046
72 1HE LYS 9 2HE LYS 9 -1.312 -9.290 -11.581
73 2HE LYS 9 1HE LYS 9 -2.385 -9.901 -10.322
74 1HZ LYS 9 1HZ LYS 9 -3.019 -8.899 -12.974
75 2HZ LYS 9 2HZ LYS 9 -4.088 -8.445 -11.745
76 3HZ LYS 9 3HZ LYS 9 -3.797 -10.083 -12.048
77 H CYS 10 H CYS 10 -3.682 -6.109 -4.338
78 HA CYS 10 HA CYS 10 -0.879 -5.714 -3.544
79 1HB CYS 10 2HB CYS 10 -2.456 -3.614 -4.174
80 2HB CYS 10 1HB CYS 10 -2.859 -3.790 -2.470
81 H ALA 11 H ALA 11 -1.638 -7.944 -2.700
82 HA ALA 11 HA ALA 11 -1.842 -7.793 0.096
83 1HB ALA 11 1HB ALA 11 -4.076 -8.790 0.423
84 2HB ALA 11 2HB ALA 11 -4.397 -8.584 -1.299
85 3HB ALA 11 3HB ALA 11 -4.148 -7.172 -0.272
86 H ALA 12 H ALA 12 -0.168 -9.262 0.032
87 HA ALA 12 HA ALA 12 -0.783 -11.922 -1.071
88 1HB ALA 12 1HB ALA 12 1.727 -10.353 -0.853
89 2HB ALA 12 2HB ALA 12 1.145 -11.388 -2.157
90 3HB ALA 12 3HB ALA 12 1.836 -12.107 -0.703
91 H ALA 13 H ALA 13 0.217 -10.162 1.777
92 HA ALA 13 HA ALA 13 -0.483 -12.415 3.444
93 1HB ALA 13 1HB ALA 13 1.850 -11.988 4.658
94 2HB ALA 13 2HB ALA 13 2.333 -11.605 3.005
95 3HB ALA 13 3HB ALA 13 1.651 -13.187 3.380
96 H ALA 14 H ALA 14 -1.390 -9.672 2.995
97 HA ALA 14 HA ALA 14 -2.137 -7.881 4.183
98 1HB ALA 14 1HB ALA 14 -2.685 -9.935 5.722
99 2HB ALA 14 2HB ALA 14 -2.893 -8.286 6.311
100 3HB ALA 14 3HB ALA 14 -1.460 -9.208 6.763
101 H ASN 15 H ASN 15 0.653 -7.984 3.423
102 HA ASN 15 HA ASN 15 2.129 -6.800 5.615
103 1HB ASN 15 2HB ASN 15 2.767 -7.653 2.826
104 2HB ASN 15 1HB ASN 15 3.811 -6.460 3.593
105 1HD2 ASN 15 1HD2 ASN 15 4.736 -7.042 5.681
106 2HD2 ASN 15 2HD2 ASN 15 5.130 -8.696 5.984
107 H VAL 16 H VAL 16 2.029 -4.719 6.105
108 HA VAL 16 HA VAL 16 0.700 -2.826 4.435
109 HB VAL 16 HB VAL 16 0.627 -2.673 6.891
110 1HG1 VAL 16 1HG1 VAL 16 3.508 -1.803 6.735
111 2HG1 VAL 16 2HG1 VAL 16 2.976 -3.398 7.267
112 3HG1 VAL 16 3HG1 VAL 16 2.517 -1.963 8.185
113 1HG2 VAL 16 1HG2 VAL 16 0.038 -0.612 6.215
114 2HG2 VAL 16 2HG2 VAL 16 1.418 -0.464 5.126
115 3HG2 VAL 16 3HG2 VAL 16 1.617 -0.144 6.849
116 H ALA 17 H ALA 17 4.088 -3.341 5.365
117 HA ALA 17 HA ALA 17 5.194 -1.126 4.077
118 1HB ALA 17 1HB ALA 17 6.256 -2.902 5.671
119 2HB ALA 17 2HB ALA 17 7.256 -2.076 4.475
120 3HB ALA 17 3HB ALA 17 6.680 -3.715 4.165
121 H ALA 18 H ALA 18 4.677 -4.429 2.869
122 HA ALA 18 HA ALA 18 5.791 -4.078 0.328
123 1HB ALA 18 1HB ALA 18 3.612 -5.926 1.281
124 2HB ALA 18 2HB ALA 18 5.332 -6.281 1.108
125 3HB ALA 18 3HB ALA 18 4.339 -6.011 -0.324
126 H HIS 19 H HIS 19 2.872 -2.856 1.653
127 HA HIS 19 HA HIS 19 1.596 -2.461 -0.921
128 1HB HIS 19 2HB HIS 19 -0.055 -2.874 0.620
129 2HB HIS 19 1HB HIS 19 0.830 -2.112 1.934
130 HD2 HIS 19 2HD HIS 19 -0.312 0.160 2.722
131 HE1 HIS 19 1HE HIS 19 -2.197 1.151 -0.935
132 HE2 HIS 19 2HE HIS 19 -1.987 1.737 1.523
133 H ILE 20 H ILE 20 2.427 -0.255 1.761
134 HA ILE 20 HA ILE 20 2.249 2.091 0.240
135 HB ILE 20 HB ILE 20 2.183 2.084 2.690
136 1HG1 ILE 20 2HG1 ILE 20 4.571 3.741 1.938
137 2HG1 ILE 20 1HG1 ILE 20 3.002 4.074 1.213
138 1HG2 ILE 20 1HG2 ILE 20 4.821 0.862 2.356
139 2HG2 ILE 20 2HG2 ILE 20 3.673 0.744 3.689
140 3HG2 ILE 20 3HG2 ILE 20 4.759 2.129 3.582
141 1HD1 ILE 20 1HD1 ILE 20 2.904 3.805 4.112
142 2HD1 ILE 20 2HD1 ILE 20 2.242 5.057 3.060
143 3HD1 ILE 20 3HD1 ILE 20 3.934 5.122 3.553
144 H THR 21 H THR 21 4.785 -0.253 0.455
145 HA THR 21 HA THR 21 7.073 1.163 -0.067
146 HB THR 21 HB THR 21 7.087 -1.248 0.246
147 HG1 THR 21 1HG THR 21 8.824 -1.392 -0.906
148 1HG2 THR 21 1HG2 THR 21 6.200 -2.817 -1.151
149 2HG2 THR 21 2HG2 THR 21 6.229 -1.747 -2.553
150 3HG2 THR 21 3HG2 THR 21 5.001 -1.533 -1.304
151 H HIS 22 H HIS 22 4.677 0.064 -2.448
152 HA HIS 22 HA HIS 22 5.951 1.810 -4.444
153 1HB HIS 22 2HB HIS 22 4.767 0.468 -6.135
154 2HB HIS 22 1HB HIS 22 5.799 -0.535 -5.121
155 HD1 HIS 22 1HD HIS 22 4.670 -2.307 -3.674
156 HD2 HIS 22 2HD HIS 22 1.986 0.086 -5.755
157 HE1 HIS 22 1HE HIS 22 2.435 -3.431 -3.424
158 HE2 HIS 22 2HE HIS 22 0.842 -2.012 -4.764
159 H CYS 23 H CYS 23 3.018 1.168 -2.688
160 HA CYS 23 HA CYS 23 1.399 2.943 -4.286
161 1HB CYS 23 2HB CYS 23 0.919 1.448 -1.712
162 2HB CYS 23 1HB CYS 23 -0.263 2.564 -2.385
163 H TYR 24 H TYR 24 1.790 5.059 -4.190
164 HA TYR 24 HA TYR 24 1.924 6.322 -1.549
165 1HB TYR 24 2HB TYR 24 3.971 6.443 -3.703
166 2HB TYR 24 1HB TYR 24 3.616 7.942 -2.850
167 HD1 TYR 24 1HD TYR 24 3.549 7.668 -0.195
168 HD2 TYR 24 2HD TYR 24 5.652 5.109 -2.864
169 HE1 TYR 24 1HE TYR 24 5.029 6.978 1.644
170 HE2 TYR 24 2HE TYR 24 7.138 4.410 -1.033
171 HH TYR 24 HH TYR 24 7.180 4.322 1.373
172 H LYS 25 H LYS 25 0.597 8.010 -1.372
173 HA LYS 25 HA LYS 25 -1.186 8.730 -3.409
174 1HB LYS 25 2HB LYS 25 -1.905 10.525 -1.924
175 2HB LYS 25 1HB LYS 25 -1.664 9.038 -1.017
176 1HG LYS 25 2HG LYS 25 0.761 10.138 -0.714
177 2HG LYS 25 1HG LYS 25 -0.213 11.600 -0.881
178 1HD LYS 25 2HD LYS 25 -0.525 11.353 1.336
179 2HD LYS 25 1HD LYS 25 -1.738 10.170 0.840
180 1HE LYS 25 2HE LYS 25 -0.212 9.318 2.589
181 2HE LYS 25 1HE LYS 25 -0.157 8.371 1.103
182 1HZ LYS 25 1HZ LYS 25 1.772 10.553 1.486
183 2HZ LYS 25 2HZ LYS 25 1.929 9.127 0.590
184 3HZ LYS 25 3HZ LYS 25 2.029 9.080 2.277
Start of MODEL 15
1 1H PHE 1 1HT PHE 1 -0.885 1.356 4.285
2 2H PHE 1 2HT PHE 1 -1.736 2.292 5.445
3 3H PHE 1 3HT PHE 1 -2.359 2.119 3.856
4 HA PHE 1 HA PHE 1 -1.910 -0.172 5.628
5 1HB PHE 1 2HB PHE 1 -4.025 1.903 5.657
6 2HB PHE 1 1HB PHE 1 -4.584 0.236 5.744
7 HD1 PHE 1 1HD PHE 1 -3.708 -1.239 7.582
8 HD2 PHE 1 2HD PHE 1 -3.109 2.974 7.527
9 HE1 PHE 1 1HE PHE 1 -3.212 -1.282 9.992
10 HE2 PHE 1 2HE PHE 1 -2.611 2.939 9.936
11 HZ PHE 1 HZ PHE 1 -2.662 0.810 11.172
12 H VAL 2 H VAL 2 -1.868 -1.862 4.302
13 HA VAL 2 HA VAL 2 -2.726 -1.870 1.639
14 HB VAL 2 HB VAL 2 -1.091 -3.478 2.520
15 1HG1 VAL 2 1HG1 VAL 2 -1.765 -5.374 3.855
16 2HG1 VAL 2 2HG1 VAL 2 -3.441 -4.824 3.847
17 3HG1 VAL 2 3HG1 VAL 2 -2.209 -3.883 4.686
18 1HG2 VAL 2 1HG2 VAL 2 -2.137 -4.035 0.439
19 2HG2 VAL 2 2HG2 VAL 2 -3.555 -4.680 1.265
20 3HG2 VAL 2 3HG2 VAL 2 -2.004 -5.510 1.395
21 H SER 3 H SER 3 -4.413 -2.599 4.606
22 HA SER 3 HA SER 3 -6.602 -4.003 3.548
23 1HB SER 3 2HB SER 3 -5.870 -3.544 6.032
24 2HB SER 3 1HB SER 3 -6.946 -2.155 5.880
25 HG SER 3 HG SER 3 -8.602 -3.634 5.265
26 H THR 4 H THR 4 -5.842 -0.603 3.630
27 HA THR 4 HA THR 4 -8.519 0.074 2.649
28 HB THR 4 HB THR 4 -7.369 2.470 2.853
29 HG1 THR 4 1HG THR 4 -5.695 2.523 4.145
30 1HG2 THR 4 1HG2 THR 4 -9.217 1.157 4.331
31 2HG2 THR 4 2HG2 THR 4 -8.655 2.799 4.649
32 3HG2 THR 4 3HG2 THR 4 -7.953 1.440 5.528
33 H CYS 5 H CYS 5 -5.989 -1.122 1.196
34 HA CYS 5 HA CYS 5 -5.235 0.771 -0.756
35 1HB CYS 5 2HB CYS 5 -3.968 -1.311 -0.233
36 2HB CYS 5 1HB CYS 5 -5.242 -2.243 -1.013
37 H TYR 6 H TYR 6 -5.819 0.861 -2.991
38 HA TYR 6 HA TYR 6 -8.583 -0.027 -3.492
39 1HB TYR 6 2HB TYR 6 -8.599 1.916 -5.156
40 2HB TYR 6 1HB TYR 6 -8.630 2.330 -3.445
41 HD1 TYR 6 1HD TYR 6 -6.627 2.359 -6.512
42 HD2 TYR 6 2HD TYR 6 -6.723 3.395 -2.387
43 HE1 TYR 6 1HE TYR 6 -4.647 3.783 -6.829
44 HE2 TYR 6 2HE TYR 6 -4.745 4.821 -2.693
45 HH TYR 6 HH TYR 6 -2.882 5.089 -4.199
46 H LEU 7 H LEU 7 -5.433 0.555 -5.012
47 HA LEU 7 HA LEU 7 -6.174 -0.683 -7.483
48 1HB LEU 7 2HB LEU 7 -3.750 -0.540 -7.998
49 2HB LEU 7 1HB LEU 7 -4.467 0.988 -7.526
50 HG LEU 7 HG LEU 7 -3.526 0.034 -5.129
51 1HD1 LEU 7 1HD1 LEU 7 -1.668 -1.203 -5.329
52 2HD1 LEU 7 2HD1 LEU 7 -1.138 -0.358 -6.784
53 3HD1 LEU 7 3HD1 LEU 7 -2.339 -1.645 -6.899
54 1HD2 LEU 7 1HD2 LEU 7 -2.379 1.966 -5.138
55 2HD2 LEU 7 2HD2 LEU 7 -3.226 2.258 -6.656
56 3HD2 LEU 7 3HD2 LEU 7 -1.587 1.607 -6.672
57 HA PRO 8 HA PRO 8 -5.486 -4.916 -6.429
58 1HB PRO 8 2HB PRO 8 -4.830 -5.931 -8.856
59 2HB PRO 8 1HB PRO 8 -6.476 -5.443 -8.437
60 1HG PRO 8 2HG PRO 8 -4.396 -3.954 -9.995
61 2HG PRO 8 1HG PRO 8 -6.129 -4.133 -10.329
62 1HD PRO 8 2HD PRO 8 -5.086 -1.909 -9.188
63 2HD PRO 8 1HD PRO 8 -6.718 -2.499 -8.814
64 H LYS 9 H LYS 9 -3.762 -6.730 -7.368
65 HA LYS 9 HA LYS 9 -1.642 -7.521 -7.149
66 1HB LYS 9 2HB LYS 9 -1.273 -4.861 -8.427
67 2HB LYS 9 1HB LYS 9 0.159 -5.650 -7.779
68 1HG LYS 9 2HG LYS 9 0.029 -6.258 -10.053
69 2HG LYS 9 1HG LYS 9 -0.480 -7.674 -9.131
70 1HD LYS 9 2HD LYS 9 -2.857 -6.437 -9.499
71 2HD LYS 9 1HD LYS 9 -2.011 -5.957 -10.971
72 1HE LYS 9 2HE LYS 9 -1.383 -8.521 -11.024
73 2HE LYS 9 1HE LYS 9 -2.843 -8.660 -10.047
74 1HZ LYS 9 1HZ LYS 9 -4.111 -7.626 -11.773
75 2HZ LYS 9 2HZ LYS 9 -3.236 -8.903 -12.456
76 3HZ LYS 9 3HZ LYS 9 -2.724 -7.308 -12.687
77 H CYS 10 H CYS 10 -2.951 -6.287 -4.864
78 HA CYS 10 HA CYS 10 -0.548 -5.729 -3.272
79 1HB CYS 10 2HB CYS 10 -2.673 -3.881 -3.829
80 2HB CYS 10 1HB CYS 10 -2.675 -4.263 -2.111
81 H ALA 11 H ALA 11 -0.904 -6.055 -0.930
82 HA ALA 11 HA ALA 11 -1.519 -7.364 0.827
83 1HB ALA 11 1HB ALA 11 -3.717 -7.341 1.361
84 2HB ALA 11 2HB ALA 11 -4.222 -7.912 -0.229
85 3HB ALA 11 3HB ALA 11 -3.797 -6.216 0.005
86 H ALA 12 H ALA 12 -0.037 -8.981 0.023
87 HA ALA 12 HA ALA 12 -1.366 -11.318 -1.180
88 1HB ALA 12 1HB ALA 12 0.435 -10.528 -2.553
89 2HB ALA 12 2HB ALA 12 0.927 -12.047 -1.808
90 3HB ALA 12 3HB ALA 12 1.540 -10.518 -1.179
91 H ALA 13 H ALA 13 0.553 -10.187 1.512
92 HA ALA 13 HA ALA 13 0.021 -12.715 2.894
93 1HB ALA 13 1HB ALA 13 2.455 -12.228 3.894
94 2HB ALA 13 2HB ALA 13 2.676 -11.575 2.270
95 3HB ALA 13 3HB ALA 13 2.182 -13.254 2.486
96 H ALA 14 H ALA 14 -1.173 -10.060 3.047
97 HA ALA 14 HA ALA 14 -1.915 -8.584 4.610
98 1HB ALA 14 1HB ALA 14 -2.021 -10.921 5.827
99 2HB ALA 14 2HB ALA 14 -2.355 -9.420 6.690
100 3HB ALA 14 3HB ALA 14 -0.775 -10.189 6.837
101 H ASN 15 H ASN 15 0.784 -8.301 3.530
102 HA ASN 15 HA ASN 15 2.256 -7.115 5.764
103 1HB ASN 15 2HB ASN 15 3.174 -8.635 3.737
104 2HB ASN 15 1HB ASN 15 3.381 -7.040 3.019
105 1HD2 ASN 15 1HD2 ASN 15 5.410 -6.447 3.209
106 2HD2 ASN 15 2HD2 ASN 15 6.395 -6.618 4.617
107 H VAL 16 H VAL 16 2.117 -5.016 6.167
108 HA VAL 16 HA VAL 16 0.654 -3.249 4.480
109 HB VAL 16 HB VAL 16 0.678 -2.986 6.923
110 1HG1 VAL 16 1HG1 VAL 16 3.415 -1.806 6.802
111 2HG1 VAL 16 2HG1 VAL 16 3.227 -3.551 6.969
112 3HG1 VAL 16 3HG1 VAL 16 2.536 -2.470 8.178
113 1HG2 VAL 16 1HG2 VAL 16 0.083 -1.063 5.601
114 2HG2 VAL 16 2HG2 VAL 16 1.782 -0.641 5.381
115 3HG2 VAL 16 3HG2 VAL 16 1.046 -0.534 6.982
116 H ALA 17 H ALA 17 4.089 -3.721 5.162
117 HA ALA 17 HA ALA 17 5.099 -1.483 3.834
118 1HB ALA 17 1HB ALA 17 6.751 -2.488 5.026
119 2HB ALA 17 2HB ALA 17 7.100 -3.199 3.450
120 3HB ALA 17 3HB ALA 17 6.186 -4.116 4.649
121 H ALA 18 H ALA 18 4.404 -4.742 2.615
122 HA ALA 18 HA ALA 18 5.355 -4.402 0.010
123 1HB ALA 18 1HB ALA 18 2.934 -6.066 0.399
124 2HB ALA 18 2HB ALA 18 4.370 -6.491 1.330
125 3HB ALA 18 3HB ALA 18 4.445 -6.436 -0.431
126 H HIS 19 H HIS 19 2.596 -3.060 1.543
127 HA HIS 19 HA HIS 19 1.187 -2.544 -0.940
128 1HB HIS 19 2HB HIS 19 -0.357 -2.957 0.732
129 2HB HIS 19 1HB HIS 19 0.610 -2.164 1.968
130 HD2 HIS 19 2HD HIS 19 -0.523 0.102 2.773
131 HE1 HIS 19 1HE HIS 19 -2.494 1.079 -0.842
132 HE2 HIS 19 2HE HIS 19 -2.217 1.681 1.605
133 H ILE 20 H ILE 20 2.211 -0.430 1.747
134 HA ILE 20 HA ILE 20 2.080 1.953 0.296
135 HB ILE 20 HB ILE 20 2.155 1.866 2.750
136 1HG1 ILE 20 2HG1 ILE 20 4.558 3.485 2.126
137 2HG1 ILE 20 1HG1 ILE 20 3.128 3.813 1.153
138 1HG2 ILE 20 1HG2 ILE 20 3.766 0.146 3.130
139 2HG2 ILE 20 2HG2 ILE 20 4.379 1.630 3.860
140 3HG2 ILE 20 3HG2 ILE 20 5.028 1.073 2.318
141 1HD1 ILE 20 1HD1 ILE 20 2.068 4.819 2.843
142 2HD1 ILE 20 2HD1 ILE 20 3.681 4.963 3.541
143 3HD1 ILE 20 3HD1 ILE 20 2.623 3.639 4.029
144 H THR 21 H THR 21 4.487 -0.518 0.252
145 HA THR 21 HA THR 21 6.817 0.812 -0.340
146 HB THR 21 HB THR 21 6.757 -1.598 -0.116
147 HG1 THR 21 1HG THR 21 8.348 -1.858 -1.467
148 1HG2 THR 21 1HG2 THR 21 5.669 -3.079 -1.454
149 2HG2 THR 21 2HG2 THR 21 5.670 -1.996 -2.847
150 3HG2 THR 21 3HG2 THR 21 4.539 -1.727 -1.520
151 H HIS 22 H HIS 22 4.244 -0.089 -2.622
152 HA HIS 22 HA HIS 22 5.475 1.707 -4.603
153 1HB HIS 22 2HB HIS 22 4.246 0.460 -6.308
154 2HB HIS 22 1HB HIS 22 5.233 -0.630 -5.341
155 HD1 HIS 22 1HD HIS 22 4.048 -2.496 -4.134
156 HD2 HIS 22 2HD HIS 22 1.428 0.295 -5.749
157 HE1 HIS 22 1HE HIS 22 1.756 -3.496 -3.872
158 HE2 HIS 22 2HE HIS 22 0.197 -1.833 -4.943
159 H CYS 23 H CYS 23 2.584 1.011 -2.784
160 HA CYS 23 HA CYS 23 0.925 2.865 -4.223
161 1HB CYS 23 2HB CYS 23 0.590 1.269 -1.695
162 2HB CYS 23 1HB CYS 23 -0.587 2.492 -2.157
163 H TYR 24 H TYR 24 0.532 4.962 -3.787
164 HA TYR 24 HA TYR 24 1.384 6.116 -1.255
165 1HB TYR 24 2HB TYR 24 2.694 6.640 -3.872
166 2HB TYR 24 1HB TYR 24 2.413 8.026 -2.825
167 HD1 TYR 24 1HD TYR 24 2.996 7.281 -0.197
168 HD2 TYR 24 2HD TYR 24 4.852 5.858 -3.750
169 HE1 TYR 24 1HE TYR 24 5.015 6.722 1.090
170 HE2 TYR 24 2HE TYR 24 6.876 5.294 -2.475
171 HH TYR 24 HH TYR 24 6.949 5.300 0.956
172 H LYS 25 H LYS 25 0.379 7.201 -4.504
173 HA LYS 25 HA LYS 25 -2.212 7.972 -3.741
174 1HB LYS 25 2HB LYS 25 -1.932 10.440 -3.797
175 2HB LYS 25 1HB LYS 25 -1.158 9.686 -2.410
176 1HG LYS 25 2HG LYS 25 1.006 9.839 -3.534
177 2HG LYS 25 1HG LYS 25 0.227 10.597 -4.924
178 1HD LYS 25 2HD LYS 25 -0.120 12.576 -3.823
179 2HD LYS 25 1HD LYS 25 -0.190 11.805 -2.237
180 1HE LYS 25 2HE LYS 25 2.338 12.011 -3.858
181 2HE LYS 25 1HE LYS 25 1.844 13.233 -2.688
182 1HZ LYS 25 1HZ LYS 25 1.982 11.663 -0.936
183 2HZ LYS 25 2HZ LYS 25 3.414 11.520 -1.825
184 3HZ LYS 25 3HZ LYS 25 2.188 10.368 -2.005
Start of MODEL 16
1 1H PHE 1 1HT PHE 1 -2.891 2.601 5.212
2 2H PHE 1 2HT PHE 1 -4.361 1.896 4.673
3 3H PHE 1 3HT PHE 1 -3.119 2.265 3.546
4 HA PHE 1 HA PHE 1 -1.679 0.690 4.706
5 1HB PHE 1 2HB PHE 1 -4.270 -0.137 6.031
6 2HB PHE 1 1HB PHE 1 -2.675 -0.836 6.291
7 HD1 PHE 1 1HD PHE 1 -5.043 1.523 7.437
8 HD2 PHE 1 2HD PHE 1 -0.862 0.761 7.219
9 HE1 PHE 1 1HE PHE 1 -4.663 3.096 9.290
10 HE2 PHE 1 2HE PHE 1 -0.475 2.332 9.072
11 HZ PHE 1 HZ PHE 1 -2.378 3.503 10.110
12 H VAL 2 H VAL 2 -1.879 -1.716 4.224
13 HA VAL 2 HA VAL 2 -2.678 -2.086 1.576
14 HB VAL 2 HB VAL 2 -0.993 -3.493 2.679
15 1HG1 VAL 2 1HG1 VAL 2 -1.604 -5.251 4.208
16 2HG1 VAL 2 2HG1 VAL 2 -3.309 -4.814 4.086
17 3HG1 VAL 2 3HG1 VAL 2 -2.166 -3.706 4.847
18 1HG2 VAL 2 1HG2 VAL 2 -2.048 -4.292 0.636
19 2HG2 VAL 2 2HG2 VAL 2 -3.335 -5.044 1.578
20 3HG2 VAL 2 3HG2 VAL 2 -1.680 -5.640 1.712
21 H SER 3 H SER 3 -4.379 -2.682 4.588
22 HA SER 3 HA SER 3 -6.495 -4.222 3.538
23 1HB SER 3 2HB SER 3 -5.763 -3.631 6.032
24 2HB SER 3 1HB SER 3 -7.007 -2.396 5.839
25 HG SER 3 HG SER 3 -7.551 -4.682 6.615
26 H THR 4 H THR 4 -5.883 -0.791 3.618
27 HA THR 4 HA THR 4 -8.554 -0.277 2.501
28 HB THR 4 HB THR 4 -6.634 1.826 3.478
29 HG1 THR 4 1HG THR 4 -7.551 1.651 5.486
30 1HG2 THR 4 1HG2 THR 4 -9.449 1.773 2.653
31 2HG2 THR 4 2HG2 THR 4 -8.274 3.088 2.624
32 3HG2 THR 4 3HG2 THR 4 -9.104 2.679 4.126
33 H CYS 5 H CYS 5 -6.114 -1.330 1.085
34 HA CYS 5 HA CYS 5 -5.058 0.696 -0.574
35 1HB CYS 5 2HB CYS 5 -3.974 -1.493 -0.284
36 2HB CYS 5 1HB CYS 5 -5.317 -2.270 -1.117
37 H TYR 6 H TYR 6 -5.453 1.030 -2.854
38 HA TYR 6 HA TYR 6 -8.288 0.628 -3.541
39 1HB TYR 6 2HB TYR 6 -7.907 2.597 -5.097
40 2HB TYR 6 1HB TYR 6 -7.858 2.959 -3.375
41 HD1 TYR 6 1HD TYR 6 -6.001 2.930 -6.483
42 HD2 TYR 6 2HD TYR 6 -5.665 3.355 -2.263
43 HE1 TYR 6 1HE TYR 6 -3.781 3.948 -6.768
44 HE2 TYR 6 2HE TYR 6 -3.445 4.376 -2.537
45 HH TYR 6 HH TYR 6 -1.558 4.152 -4.602
46 H LEU 7 H LEU 7 -5.040 0.791 -4.988
47 HA LEU 7 HA LEU 7 -5.937 -0.357 -7.461
48 1HB LEU 7 2HB LEU 7 -3.553 -0.365 -8.065
49 2HB LEU 7 1HB LEU 7 -4.099 1.200 -7.493
50 HG LEU 7 HG LEU 7 -3.154 0.165 -5.182
51 1HD1 LEU 7 1HD1 LEU 7 -2.074 -1.745 -5.635
52 2HD1 LEU 7 2HD1 LEU 7 -0.801 -0.687 -6.242
53 3HD1 LEU 7 3HD1 LEU 7 -1.966 -1.396 -7.360
54 1HD2 LEU 7 1HD2 LEU 7 -2.295 2.210 -5.558
55 2HD2 LEU 7 2HD2 LEU 7 -2.100 1.928 -7.287
56 3HD2 LEU 7 3HD2 LEU 7 -0.902 1.307 -6.151
57 HA PRO 8 HA PRO 8 -5.883 -4.609 -6.086
58 1HB PRO 8 2HB PRO 8 -5.470 -5.121 -8.986
59 2HB PRO 8 1HB PRO 8 -6.690 -5.777 -7.889
60 1HG PRO 8 2HG PRO 8 -7.333 -3.915 -9.681
61 2HG PRO 8 1HG PRO 8 -8.041 -3.901 -8.054
62 1HD PRO 8 2HD PRO 8 -5.868 -2.194 -9.192
63 2HD PRO 8 1HD PRO 8 -7.172 -1.762 -8.067
64 H LYS 9 H LYS 9 -4.510 -6.637 -7.196
65 HA LYS 9 HA LYS 9 -2.477 -7.655 -7.215
66 1HB LYS 9 2HB LYS 9 -2.359 -5.843 -9.169
67 2HB LYS 9 1HB LYS 9 -1.102 -5.180 -8.134
68 1HG LYS 9 2HG LYS 9 0.325 -6.882 -8.541
69 2HG LYS 9 1HG LYS 9 -0.965 -8.079 -8.675
70 1HD LYS 9 2HD LYS 9 -1.468 -6.538 -10.846
71 2HD LYS 9 1HD LYS 9 0.289 -6.401 -10.743
72 1HE LYS 9 2HE LYS 9 0.622 -8.570 -11.282
73 2HE LYS 9 1HE LYS 9 -0.808 -9.115 -10.406
74 1HZ LYS 9 1HZ LYS 9 -2.123 -8.867 -12.212
75 2HZ LYS 9 2HZ LYS 9 -0.668 -9.117 -13.036
76 3HZ LYS 9 3HZ LYS 9 -1.259 -7.548 -12.822
77 H CYS 10 H CYS 10 -3.318 -6.216 -4.833
78 HA CYS 10 HA CYS 10 -0.666 -5.746 -3.644
79 1HB CYS 10 2HB CYS 10 -2.678 -3.839 -3.924
80 2HB CYS 10 1HB CYS 10 -2.813 -4.364 -2.250
81 H ALA 11 H ALA 11 -0.739 -5.969 -1.201
82 HA ALA 11 HA ALA 11 -1.045 -7.287 0.629
83 1HB ALA 11 1HB ALA 11 -3.785 -8.094 -0.124
84 2HB ALA 11 2HB ALA 11 -3.491 -6.363 0.037
85 3HB ALA 11 3HB ALA 11 -3.168 -7.442 1.394
86 H ALA 12 H ALA 12 0.397 -8.909 0.081
87 HA ALA 12 HA ALA 12 -0.740 -11.279 -1.246
88 1HB ALA 12 1HB ALA 12 1.449 -9.951 -2.021
89 2HB ALA 12 2HB ALA 12 1.254 -11.691 -2.240
90 3HB ALA 12 3HB ALA 12 2.186 -11.073 -0.877
91 H ALA 13 H ALA 13 0.900 -10.102 1.605
92 HA ALA 13 HA ALA 13 0.350 -12.662 2.921
93 1HB ALA 13 1HB ALA 13 2.573 -12.479 4.088
94 2HB ALA 13 2HB ALA 13 3.006 -11.245 2.905
95 3HB ALA 13 3HB ALA 13 2.648 -12.888 2.374
96 H ALA 14 H ALA 14 -0.949 -10.046 2.984
97 HA ALA 14 HA ALA 14 -1.879 -8.614 4.487
98 1HB ALA 14 1HB ALA 14 -0.851 -10.430 6.652
99 2HB ALA 14 2HB ALA 14 -2.243 -10.838 5.647
100 3HB ALA 14 3HB ALA 14 -2.285 -9.403 6.673
101 H ASN 15 H ASN 15 0.891 -8.226 3.656
102 HA ASN 15 HA ASN 15 2.091 -6.990 6.028
103 1HB ASN 15 2HB ASN 15 3.136 -7.974 3.422
104 2HB ASN 15 1HB ASN 15 3.964 -6.603 4.154
105 1HD2 ASN 15 1HD2 ASN 15 5.716 -7.279 5.141
106 2HD2 ASN 15 2HD2 ASN 15 5.848 -8.684 6.138
107 H VAL 16 H VAL 16 2.019 -4.865 6.345
108 HA VAL 16 HA VAL 16 0.594 -3.158 4.577
109 HB VAL 16 HB VAL 16 0.615 -2.806 7.013
110 1HG1 VAL 16 1HG1 VAL 16 3.339 -1.606 6.853
111 2HG1 VAL 16 2HG1 VAL 16 3.175 -3.349 7.067
112 3HG1 VAL 16 3HG1 VAL 16 2.469 -2.244 8.247
113 1HG2 VAL 16 1HG2 VAL 16 -0.077 -0.828 6.201
114 2HG2 VAL 16 2HG2 VAL 16 1.248 -0.725 5.042
115 3HG2 VAL 16 3HG2 VAL 16 1.508 -0.257 6.722
116 H ALA 17 H ALA 17 4.022 -3.634 5.280
117 HA ALA 17 HA ALA 17 5.054 -1.449 3.879
118 1HB ALA 17 1HB ALA 17 6.147 -3.409 5.368
119 2HB ALA 17 2HB ALA 17 7.081 -2.337 4.324
120 3HB ALA 17 3HB ALA 17 6.623 -3.942 3.756
121 H ALA 18 H ALA 18 4.334 -4.742 2.770
122 HA ALA 18 HA ALA 18 5.291 -4.504 0.159
123 1HB ALA 18 1HB ALA 18 2.853 -6.123 0.536
124 2HB ALA 18 2HB ALA 18 4.221 -6.517 1.576
125 3HB ALA 18 3HB ALA 18 4.406 -6.556 -0.177
126 H HIS 19 H HIS 19 2.540 -3.080 1.635
127 HA HIS 19 HA HIS 19 1.142 -2.636 -0.867
128 1HB HIS 19 2HB HIS 19 -0.405 -2.966 0.819
129 2HB HIS 19 1HB HIS 19 0.570 -2.136 2.023
130 HD2 HIS 19 2HD HIS 19 -0.556 0.161 2.745
131 HE1 HIS 19 1HE HIS 19 -2.480 1.039 -0.921
132 HE2 HIS 19 2HE HIS 19 -2.221 1.719 1.508
133 H ILE 20 H ILE 20 2.196 -0.435 1.738
134 HA ILE 20 HA ILE 20 2.096 1.891 0.194
135 HB ILE 20 HB ILE 20 2.157 1.913 2.644
136 1HG1 ILE 20 2HG1 ILE 20 4.606 3.431 1.854
137 2HG1 ILE 20 1HG1 ILE 20 3.090 3.806 1.039
138 1HG2 ILE 20 1HG2 ILE 20 4.704 0.544 2.192
139 2HG2 ILE 20 2HG2 ILE 20 3.618 0.498 3.581
140 3HG2 ILE 20 3HG2 ILE 20 4.770 1.821 3.406
141 1HD1 ILE 20 1HD1 ILE 20 2.946 3.668 3.970
142 2HD1 ILE 20 2HD1 ILE 20 2.226 4.819 2.844
143 3HD1 ILE 20 3HD1 ILE 20 3.919 4.981 3.309
144 H THR 21 H THR 21 4.487 -0.602 0.280
145 HA THR 21 HA THR 21 6.830 0.671 -0.360
146 HB THR 21 HB THR 21 6.731 -1.731 -0.045
147 HG1 THR 21 1HG THR 21 8.443 -0.961 -1.319
148 1HG2 THR 21 1HG2 THR 21 5.644 -3.246 -1.348
149 2HG2 THR 21 2HG2 THR 21 5.663 -2.205 -2.771
150 3HG2 THR 21 3HG2 THR 21 4.528 -1.885 -1.460
151 H HIS 22 H HIS 22 4.256 -0.284 -2.619
152 HA HIS 22 HA HIS 22 5.518 1.416 -4.664
153 1HB HIS 22 2HB HIS 22 4.265 0.123 -6.320
154 2HB HIS 22 1HB HIS 22 5.242 -0.941 -5.314
155 HD1 HIS 22 1HD HIS 22 4.032 -2.701 -3.953
156 HD2 HIS 22 2HD HIS 22 1.455 -0.031 -5.823
157 HE1 HIS 22 1HE HIS 22 1.731 -3.673 -3.664
158 HE2 HIS 22 2HE HIS 22 0.199 -2.088 -4.885
159 H CYS 23 H CYS 23 2.629 0.854 -2.807
160 HA CYS 23 HA CYS 23 1.002 2.683 -4.325
161 1HB CYS 23 2HB CYS 23 0.614 1.185 -1.743
162 2HB CYS 23 1HB CYS 23 -0.548 2.386 -2.292
163 H TYR 24 H TYR 24 0.581 4.788 -3.908
164 HA TYR 24 HA TYR 24 1.359 6.008 -1.407
165 1HB TYR 24 2HB TYR 24 2.910 6.376 -3.920
166 2HB TYR 24 1HB TYR 24 2.631 7.801 -2.924
167 HD1 TYR 24 1HD TYR 24 3.086 7.324 -0.304
168 HD2 TYR 24 2HD TYR 24 4.869 5.229 -3.550
169 HE1 TYR 24 1HE TYR 24 4.960 6.677 1.150
170 HE2 TYR 24 2HE TYR 24 6.748 4.576 -2.104
171 HH TYR 24 HH TYR 24 7.152 4.275 0.368
172 H LYS 25 H LYS 25 0.434 6.696 -4.776
173 HA LYS 25 HA LYS 25 -2.041 7.835 -4.107
174 1HB LYS 25 2HB LYS 25 -1.614 10.200 -4.534
175 2HB LYS 25 1HB LYS 25 -0.668 9.640 -3.162
176 1HG LYS 25 2HG LYS 25 1.251 9.343 -4.799
177 2HG LYS 25 1HG LYS 25 0.274 10.272 -5.939
178 1HD LYS 25 2HD LYS 25 1.368 12.020 -5.010
179 2HD LYS 25 1HD LYS 25 0.107 11.870 -3.783
180 1HE LYS 25 2HE LYS 25 2.557 10.223 -3.463
181 2HE LYS 25 1HE LYS 25 2.691 11.955 -3.164
182 1HZ LYS 25 1HZ LYS 25 1.100 9.944 -1.722
183 2HZ LYS 25 2HZ LYS 25 0.601 11.560 -1.718
184 3HZ LYS 25 3HZ LYS 25 2.122 11.144 -1.107
Start of MODEL 17
1 1H PHE 1 1HT PHE 1 -2.818 2.129 4.636
2 2H PHE 1 2HT PHE 1 -1.422 1.533 3.835
3 3H PHE 1 3HT PHE 1 -1.360 1.904 5.510
4 HA PHE 1 HA PHE 1 -1.493 -0.377 5.392
5 1HB PHE 1 2HB PHE 1 -4.326 0.605 5.784
6 2HB PHE 1 1HB PHE 1 -3.567 -0.792 6.540
7 HD1 PHE 1 1HD PHE 1 -4.292 2.678 6.826
8 HD2 PHE 1 2HD PHE 1 -1.597 -0.357 8.106
9 HE1 PHE 1 1HE PHE 1 -3.621 4.083 8.732
10 HE2 PHE 1 2HE PHE 1 -0.921 1.042 10.015
11 HZ PHE 1 HZ PHE 1 -1.934 3.265 10.329
12 H VAL 2 H VAL 2 -1.815 -2.149 4.183
13 HA VAL 2 HA VAL 2 -2.720 -1.990 1.545
14 HB VAL 2 HB VAL 2 -1.190 -3.743 2.327
15 1HG1 VAL 2 1HG1 VAL 2 -3.466 -5.290 3.471
16 2HG1 VAL 2 2HG1 VAL 2 -2.666 -4.072 4.466
17 3HG1 VAL 2 3HG1 VAL 2 -1.738 -5.416 3.801
18 1HG2 VAL 2 1HG2 VAL 2 -1.946 -5.430 0.898
19 2HG2 VAL 2 2HG2 VAL 2 -2.729 -3.972 0.287
20 3HG2 VAL 2 3HG2 VAL 2 -3.641 -5.115 1.274
21 H SER 3 H SER 3 -4.413 -2.720 4.509
22 HA SER 3 HA SER 3 -6.704 -3.937 3.453
23 1HB SER 3 2HB SER 3 -6.055 -2.481 5.974
24 2HB SER 3 1HB SER 3 -7.755 -2.756 5.595
25 HG SER 3 HG SER 3 -7.084 -5.024 5.279
26 H THR 4 H THR 4 -5.714 -0.600 3.578
27 HA THR 4 HA THR 4 -8.348 0.286 2.656
28 HB THR 4 HB THR 4 -5.976 2.036 3.292
29 HG1 THR 4 1HG THR 4 -6.359 1.788 5.334
30 1HG2 THR 4 1HG2 THR 4 -8.665 2.560 2.465
31 2HG2 THR 4 2HG2 THR 4 -7.333 3.684 2.730
32 3HG2 THR 4 3HG2 THR 4 -8.380 3.225 4.073
33 H CYS 5 H CYS 5 -5.950 -1.093 1.137
34 HA CYS 5 HA CYS 5 -5.111 0.744 -0.835
35 1HB CYS 5 2HB CYS 5 -4.012 -1.453 -0.320
36 2HB CYS 5 1HB CYS 5 -5.353 -2.255 -1.131
37 H TYR 6 H TYR 6 -5.872 1.176 -2.888
38 HA TYR 6 HA TYR 6 -8.576 0.169 -3.489
39 1HB TYR 6 2HB TYR 6 -9.013 2.342 -4.593
40 2HB TYR 6 1HB TYR 6 -8.678 2.517 -2.873
41 HD1 TYR 6 1HD TYR 6 -7.583 3.315 -6.239
42 HD2 TYR 6 2HD TYR 6 -6.497 3.430 -2.128
43 HE1 TYR 6 1HE TYR 6 -5.816 4.944 -6.758
44 HE2 TYR 6 2HE TYR 6 -4.727 5.060 -2.634
45 HH TYR 6 HH TYR 6 -3.349 5.550 -5.171
46 H LEU 7 H LEU 7 -5.968 -0.901 -4.340
47 HA LEU 7 HA LEU 7 -6.546 -1.017 -7.178
48 1HB LEU 7 2HB LEU 7 -4.191 -0.567 -7.799
49 2HB LEU 7 1HB LEU 7 -5.025 0.832 -7.152
50 HG LEU 7 HG LEU 7 -3.395 -0.825 -5.287
51 1HD1 LEU 7 1HD1 LEU 7 -1.387 -0.259 -6.098
52 2HD1 LEU 7 2HD1 LEU 7 -1.925 1.353 -6.572
53 3HD1 LEU 7 3HD1 LEU 7 -2.243 -0.028 -7.623
54 1HD2 LEU 7 1HD2 LEU 7 -3.466 2.150 -5.403
55 2HD2 LEU 7 2HD2 LEU 7 -3.327 1.077 -4.010
56 3HD2 LEU 7 3HD2 LEU 7 -4.884 1.283 -4.813
57 HA PRO 8 HA PRO 8 -5.290 -5.208 -6.645
58 1HB PRO 8 2HB PRO 8 -4.342 -5.828 -9.111
59 2HB PRO 8 1HB PRO 8 -6.062 -5.608 -8.773
60 1HG PRO 8 2HG PRO 8 -4.108 -3.687 -9.980
61 2HG PRO 8 1HG PRO 8 -5.776 -4.042 -10.469
62 1HD PRO 8 2HD PRO 8 -5.120 -1.861 -9.006
63 2HD PRO 8 1HD PRO 8 -6.676 -2.696 -8.829
64 H LYS 9 H LYS 9 -3.313 -6.705 -7.468
65 HA LYS 9 HA LYS 9 -1.128 -7.249 -7.155
66 1HB LYS 9 2HB LYS 9 -1.087 -5.176 -8.879
67 2HB LYS 9 1HB LYS 9 -0.157 -4.479 -7.559
68 1HG LYS 9 2HG LYS 9 1.562 -5.436 -8.645
69 2HG LYS 9 1HG LYS 9 1.051 -6.868 -7.749
70 1HD LYS 9 2HD LYS 9 0.017 -6.193 -10.496
71 2HD LYS 9 1HD LYS 9 1.446 -7.193 -10.225
72 1HE LYS 9 2HE LYS 9 -0.045 -8.880 -10.254
73 2HE LYS 9 1HE LYS 9 -0.312 -8.404 -8.576
74 1HZ LYS 9 1HZ LYS 9 -2.264 -8.618 -10.356
75 2HZ LYS 9 2HZ LYS 9 -1.876 -6.987 -10.576
76 3HZ LYS 9 3HZ LYS 9 -2.327 -7.549 -9.045
77 H CYS 10 H CYS 10 -2.655 -6.486 -4.885
78 HA CYS 10 HA CYS 10 -0.472 -5.814 -3.083
79 1HB CYS 10 2HB CYS 10 -2.708 -4.021 -3.679
80 2HB CYS 10 1HB CYS 10 -2.525 -4.352 -1.960
81 H ALA 11 H ALA 11 -1.118 -6.149 -0.772
82 HA ALA 11 HA ALA 11 -1.909 -7.504 0.876
83 1HB ALA 11 1HB ALA 11 -4.439 -8.093 -0.541
84 2HB ALA 11 2HB ALA 11 -4.094 -6.399 -0.190
85 3HB ALA 11 3HB ALA 11 -4.162 -7.576 1.122
86 H ALA 12 H ALA 12 -0.236 -9.010 0.080
87 HA ALA 12 HA ALA 12 -1.396 -11.416 -1.163
88 1HB ALA 12 1HB ALA 12 0.713 -10.046 -2.076
89 2HB ALA 12 2HB ALA 12 0.539 -11.790 -2.276
90 3HB ALA 12 3HB ALA 12 1.541 -11.147 -0.975
91 H ALA 13 H ALA 13 0.388 -10.176 1.572
92 HA ALA 13 HA ALA 13 -0.100 -12.680 2.989
93 1HB ALA 13 1HB ALA 13 2.278 -12.520 3.924
94 2HB ALA 13 2HB ALA 13 2.614 -11.483 2.538
95 3HB ALA 13 3HB ALA 13 2.081 -13.146 2.288
96 H ALA 14 H ALA 14 -1.218 -9.989 3.113
97 HA ALA 14 HA ALA 14 -1.887 -8.465 4.665
98 1HB ALA 14 1HB ALA 14 -2.495 -10.341 6.011
99 2HB ALA 14 2HB ALA 14 -1.719 -9.154 7.060
100 3HB ALA 14 3HB ALA 14 -0.826 -10.580 6.530
101 H ASN 15 H ASN 15 0.786 -8.268 3.510
102 HA ASN 15 HA ASN 15 2.354 -7.087 5.678
103 1HB ASN 15 2HB ASN 15 3.272 -8.669 3.808
104 2HB ASN 15 1HB ASN 15 3.268 -7.209 2.823
105 1HD2 ASN 15 1HD2 ASN 15 5.131 -9.083 4.727
106 2HD2 ASN 15 2HD2 ASN 15 6.302 -7.922 5.241
107 H VAL 16 H VAL 16 1.967 -5.027 6.129
108 HA VAL 16 HA VAL 16 0.606 -3.244 4.418
109 HB VAL 16 HB VAL 16 0.608 -2.988 6.862
110 1HG1 VAL 16 1HG1 VAL 16 2.545 -2.066 8.021
111 2HG1 VAL 16 2HG1 VAL 16 3.480 -2.130 6.527
112 3HG1 VAL 16 3HG1 VAL 16 2.930 -3.622 7.287
113 1HG2 VAL 16 1HG2 VAL 16 0.454 -0.692 6.847
114 2HG2 VAL 16 2HG2 VAL 16 0.373 -1.047 5.121
115 3HG2 VAL 16 3HG2 VAL 16 1.886 -0.494 5.838
116 H ALA 17 H ALA 17 4.036 -3.712 5.130
117 HA ALA 17 HA ALA 17 5.054 -1.469 3.815
118 1HB ALA 17 1HB ALA 17 6.298 -3.083 5.315
119 2HB ALA 17 2HB ALA 17 7.163 -2.532 3.881
120 3HB ALA 17 3HB ALA 17 6.436 -4.138 3.908
121 H ALA 18 H ALA 18 4.411 -4.737 2.582
122 HA ALA 18 HA ALA 18 5.373 -4.383 -0.012
123 1HB ALA 18 1HB ALA 18 3.707 -6.214 -0.591
124 2HB ALA 18 2HB ALA 18 3.232 -6.169 1.107
125 3HB ALA 18 3HB ALA 18 4.889 -6.581 0.665
126 H HIS 19 H HIS 19 2.579 -3.080 1.499
127 HA HIS 19 HA HIS 19 1.194 -2.558 -0.996
128 1HB HIS 19 2HB HIS 19 -0.363 -2.996 0.657
129 2HB HIS 19 1HB HIS 19 0.584 -2.206 1.909
130 HD2 HIS 19 2HD HIS 19 -0.562 0.056 2.714
131 HE1 HIS 19 1HE HIS 19 -2.530 1.025 -0.905
132 HE2 HIS 19 2HE HIS 19 -2.265 1.624 1.544
133 H ILE 20 H ILE 20 2.161 -0.450 1.717
134 HA ILE 20 HA ILE 20 2.020 1.944 0.296
135 HB ILE 20 HB ILE 20 2.103 1.818 2.751
136 1HG1 ILE 20 2HG1 ILE 20 3.703 3.733 3.093
137 2HG1 ILE 20 1HG1 ILE 20 4.231 3.510 1.429
138 1HG2 ILE 20 1HG2 ILE 20 4.144 0.121 2.499
139 2HG2 ILE 20 2HG2 ILE 20 3.863 1.064 3.963
140 3HG2 ILE 20 3HG2 ILE 20 5.053 1.606 2.779
141 1HD1 ILE 20 1HD1 ILE 20 1.848 3.878 0.736
142 2HD1 ILE 20 2HD1 ILE 20 2.663 5.276 1.438
143 3HD1 ILE 20 3HD1 ILE 20 1.518 4.345 2.404
144 H THR 21 H THR 21 4.490 -0.484 0.293
145 HA THR 21 HA THR 21 6.789 0.869 -0.313
146 HB THR 21 HB THR 21 6.749 -1.545 -0.088
147 HG1 THR 21 1HG THR 21 8.475 -1.454 -1.248
148 1HG2 THR 21 1HG2 THR 21 5.702 -3.035 -1.449
149 2HG2 THR 21 2HG2 THR 21 5.706 -1.944 -2.835
150 3HG2 THR 21 3HG2 THR 21 4.554 -1.698 -1.522
151 H HIS 22 H HIS 22 4.233 -0.055 -2.608
152 HA HIS 22 HA HIS 22 5.458 1.757 -4.578
153 1HB HIS 22 2HB HIS 22 4.278 0.490 -6.299
154 2HB HIS 22 1HB HIS 22 5.263 -0.587 -5.315
155 HD1 HIS 22 1HD HIS 22 4.085 -2.475 -4.141
156 HD2 HIS 22 2HD HIS 22 1.452 0.294 -5.773
157 HE1 HIS 22 1HE HIS 22 1.803 -3.505 -3.915
158 HE2 HIS 22 2HE HIS 22 0.238 -1.855 -5.002
159 H CYS 23 H CYS 23 2.557 1.014 -2.793
160 HA CYS 23 HA CYS 23 0.884 2.835 -4.256
161 1HB CYS 23 2HB CYS 23 0.555 1.229 -1.740
162 2HB CYS 23 1HB CYS 23 -0.628 2.453 -2.181
163 H TYR 24 H TYR 24 0.365 4.909 -3.781
164 HA TYR 24 HA TYR 24 1.272 6.094 -1.279
165 1HB TYR 24 2HB TYR 24 2.416 6.697 -3.957
166 2HB TYR 24 1HB TYR 24 2.121 8.062 -2.884
167 HD1 TYR 24 1HD TYR 24 2.814 7.125 -0.265
168 HD2 TYR 24 2HD TYR 24 4.675 6.230 -3.985
169 HE1 TYR 24 1HE TYR 24 4.925 6.660 0.909
170 HE2 TYR 24 2HE TYR 24 6.791 5.761 -2.821
171 HH TYR 24 HH TYR 24 7.693 6.724 -0.186
172 H LYS 25 H LYS 25 0.121 7.243 -4.455
173 HA LYS 25 HA LYS 25 -2.496 7.827 -3.596
174 1HB LYS 25 2HB LYS 25 -2.302 10.338 -3.645
175 2HB LYS 25 1HB LYS 25 -1.586 9.561 -2.240
176 1HG LYS 25 2HG LYS 25 0.564 9.655 -3.837
177 2HG LYS 25 1HG LYS 25 -0.313 11.066 -4.431
178 1HD LYS 25 2HD LYS 25 -0.092 12.203 -2.465
179 2HD LYS 25 1HD LYS 25 -0.072 10.731 -1.491
180 1HE LYS 25 2HE LYS 25 2.188 10.306 -1.995
181 2HE LYS 25 1HE LYS 25 2.193 11.466 -3.323
182 1HZ LYS 25 1HZ LYS 25 1.569 12.513 -0.678
183 2HZ LYS 25 2HZ LYS 25 2.477 13.201 -1.928
184 3HZ LYS 25 3HZ LYS 25 3.168 12.020 -0.934
Start of MODEL 18
1 1H PHE 1 1HT PHE 1 -2.862 3.026 4.805
2 2H PHE 1 2HT PHE 1 -3.719 2.427 3.444
3 3H PHE 1 3HT PHE 1 -2.002 2.436 3.444
4 HA PHE 1 HA PHE 1 -1.859 0.767 4.987
5 1HB PHE 1 2HB PHE 1 -4.610 1.686 5.615
6 2HB PHE 1 1HB PHE 1 -4.290 -0.031 5.844
7 HD1 PHE 1 1HD PHE 1 -2.326 -0.689 7.316
8 HD2 PHE 1 2HD PHE 1 -3.942 3.247 7.208
9 HE1 PHE 1 1HE PHE 1 -1.286 -0.206 9.493
10 HE2 PHE 1 2HE PHE 1 -2.904 3.737 9.385
11 HZ PHE 1 HZ PHE 1 -1.574 2.009 10.529
12 H VAL 2 H VAL 2 -1.879 -1.345 4.333
13 HA VAL 2 HA VAL 2 -2.644 -1.953 1.714
14 HB VAL 2 HB VAL 2 -0.882 -3.178 2.906
15 1HG1 VAL 2 1HG1 VAL 2 -1.466 -4.914 4.537
16 2HG1 VAL 2 2HG1 VAL 2 -3.150 -4.391 4.481
17 3HG1 VAL 2 3HG1 VAL 2 -1.909 -3.304 5.104
18 1HG2 VAL 2 1HG2 VAL 2 -1.445 -5.423 2.116
19 2HG2 VAL 2 2HG2 VAL 2 -1.925 -4.194 0.947
20 3HG2 VAL 2 3HG2 VAL 2 -3.139 -4.953 1.977
21 H SER 3 H SER 3 -4.350 -2.277 4.743
22 HA SER 3 HA SER 3 -6.371 -4.049 3.829
23 1HB SER 3 2HB SER 3 -6.916 -2.080 6.011
24 2HB SER 3 1HB SER 3 -7.334 -3.791 5.914
25 HG SER 3 HG SER 3 -5.477 -2.963 7.340
26 H THR 4 H THR 4 -5.912 -0.604 3.631
27 HA THR 4 HA THR 4 -8.603 -0.316 2.473
28 HB THR 4 HB THR 4 -6.813 1.886 3.511
29 HG1 THR 4 1HG THR 4 -9.029 0.688 4.806
30 1HG2 THR 4 1HG2 THR 4 -8.350 2.955 2.168
31 2HG2 THR 4 2HG2 THR 4 -9.131 2.992 3.749
32 3HG2 THR 4 3HG2 THR 4 -9.634 1.806 2.544
33 H CYS 5 H CYS 5 -6.117 -1.288 1.134
34 HA CYS 5 HA CYS 5 -5.111 0.723 -0.574
35 1HB CYS 5 2HB CYS 5 -3.935 -1.399 -0.208
36 2HB CYS 5 1HB CYS 5 -5.243 -2.271 -1.000
37 H TYR 6 H TYR 6 -5.482 0.969 -2.867
38 HA TYR 6 HA TYR 6 -8.297 0.487 -3.569
39 1HB TYR 6 2HB TYR 6 -7.884 2.348 -5.256
40 2HB TYR 6 1HB TYR 6 -7.885 2.818 -3.560
41 HD1 TYR 6 1HD TYR 6 -5.786 3.423 -2.437
42 HD2 TYR 6 2HD TYR 6 -5.880 2.474 -6.583
43 HE1 TYR 6 1HE TYR 6 -3.562 4.434 -2.712
44 HE2 TYR 6 2HE TYR 6 -3.656 3.482 -6.870
45 HH TYR 6 HH TYR 6 -1.678 4.360 -4.212
46 H LEU 7 H LEU 7 -5.033 0.538 -4.983
47 HA LEU 7 HA LEU 7 -5.914 -0.767 -7.391
48 1HB LEU 7 2HB LEU 7 -3.557 -0.769 -8.013
49 2HB LEU 7 1HB LEU 7 -4.068 0.814 -7.459
50 HG LEU 7 HG LEU 7 -3.094 0.015 -5.162
51 1HD1 LEU 7 1HD1 LEU 7 -2.415 -2.138 -5.366
52 2HD1 LEU 7 2HD1 LEU 7 -0.938 -1.354 -5.925
53 3HD1 LEU 7 3HD1 LEU 7 -2.095 -1.991 -7.093
54 1HD2 LEU 7 1HD2 LEU 7 -2.007 1.841 -5.948
55 2HD2 LEU 7 2HD2 LEU 7 -1.785 1.154 -7.557
56 3HD2 LEU 7 3HD2 LEU 7 -0.734 0.655 -6.232
57 HA PRO 8 HA PRO 8 -5.473 -4.952 -6.054
58 1HB PRO 8 2HB PRO 8 -4.989 -6.184 -8.411
59 2HB PRO 8 1HB PRO 8 -6.572 -5.514 -8.001
60 1HG PRO 8 2HG PRO 8 -4.403 -4.346 -9.703
61 2HG PRO 8 1HG PRO 8 -6.152 -4.385 -9.992
62 1HD PRO 8 2HD PRO 8 -4.864 -2.196 -9.028
63 2HD PRO 8 1HD PRO 8 -6.547 -2.584 -8.617
64 H LYS 9 H LYS 9 -3.912 -6.946 -6.920
65 HA LYS 9 HA LYS 9 -1.846 -7.872 -6.697
66 1HB LYS 9 2HB LYS 9 -1.343 -5.352 -8.195
67 2HB LYS 9 1HB LYS 9 0.056 -6.184 -7.528
68 1HG LYS 9 2HG LYS 9 -0.126 -7.027 -9.685
69 2HG LYS 9 1HG LYS 9 -0.873 -8.273 -8.682
70 1HD LYS 9 2HD LYS 9 -3.070 -6.955 -9.182
71 2HD LYS 9 1HD LYS 9 -2.150 -6.316 -10.545
72 1HE LYS 9 2HE LYS 9 -1.607 -8.762 -11.080
73 2HE LYS 9 1HE LYS 9 -2.911 -9.161 -9.961
74 1HZ LYS 9 1HZ LYS 9 -3.040 -7.997 -12.623
75 2HZ LYS 9 2HZ LYS 9 -4.130 -7.371 -11.490
76 3HZ LYS 9 3HZ LYS 9 -4.128 -9.027 -11.835
77 H CYS 10 H CYS 10 -2.983 -6.360 -4.482
78 HA CYS 10 HA CYS 10 -0.485 -5.774 -3.044
79 1HB CYS 10 2HB CYS 10 -2.717 -4.008 -3.534
80 2HB CYS 10 1HB CYS 10 -2.507 -4.264 -1.806
81 H ALA 11 H ALA 11 -0.680 -6.007 -0.679
82 HA ALA 11 HA ALA 11 -1.171 -7.235 1.173
83 1HB ALA 11 1HB ALA 11 -3.323 -7.168 1.849
84 2HB ALA 11 2HB ALA 11 -3.930 -7.863 0.345
85 3HB ALA 11 3HB ALA 11 -3.518 -6.149 0.422
86 H ALA 12 H ALA 12 -0.012 -8.586 -1.011
87 HA ALA 12 HA ALA 12 -1.266 -11.001 -1.689
88 1HB ALA 12 1HB ALA 12 0.779 -9.940 -2.758
89 2HB ALA 12 2HB ALA 12 0.807 -11.692 -2.559
90 3HB ALA 12 3HB ALA 12 1.709 -10.664 -1.446
91 H ALA 13 H ALA 13 0.572 -10.047 1.123
92 HA ALA 13 HA ALA 13 -0.079 -12.622 2.364
93 1HB ALA 13 1HB ALA 13 2.138 -12.815 3.341
94 2HB ALA 13 2HB ALA 13 2.647 -11.340 2.520
95 3HB ALA 13 3HB ALA 13 2.241 -12.777 1.581
96 H ALA 14 H ALA 14 -1.223 -9.945 2.586
97 HA ALA 14 HA ALA 14 -2.005 -8.526 4.182
98 1HB ALA 14 1HB ALA 14 -2.423 -10.788 5.270
99 2HB ALA 14 2HB ALA 14 -2.387 -9.383 6.336
100 3HB ALA 14 3HB ALA 14 -0.992 -10.459 6.246
101 H ASN 15 H ASN 15 0.748 -8.262 3.246
102 HA ASN 15 HA ASN 15 2.138 -7.222 5.603
103 1HB ASN 15 2HB ASN 15 3.122 -8.671 3.562
104 2HB ASN 15 1HB ASN 15 3.389 -7.055 2.915
105 1HD2 ASN 15 1HD2 ASN 15 5.647 -7.646 3.060
106 2HD2 ASN 15 2HD2 ASN 15 6.479 -7.448 4.562
107 H VAL 16 H VAL 16 1.966 -5.151 6.111
108 HA VAL 16 HA VAL 16 0.623 -3.266 4.485
109 HB VAL 16 HB VAL 16 0.652 -3.102 6.935
110 1HG1 VAL 16 1HG1 VAL 16 3.441 -2.030 6.829
111 2HG1 VAL 16 2HG1 VAL 16 3.157 -3.763 6.999
112 3HG1 VAL 16 3HG1 VAL 16 2.528 -2.643 8.208
113 1HG2 VAL 16 1HG2 VAL 16 0.555 -0.808 7.002
114 2HG2 VAL 16 2HG2 VAL 16 0.479 -1.088 5.262
115 3HG2 VAL 16 3HG2 VAL 16 2.002 -0.611 6.012
116 H ALA 17 H ALA 17 4.049 -3.811 5.198
117 HA ALA 17 HA ALA 17 5.099 -1.565 3.913
118 1HB ALA 17 1HB ALA 17 6.270 -4.305 4.347
119 2HB ALA 17 2HB ALA 17 6.509 -2.860 5.329
120 3HB ALA 17 3HB ALA 17 7.185 -2.943 3.702
121 H ALA 18 H ALA 18 4.422 -4.811 2.646
122 HA ALA 18 HA ALA 18 5.409 -4.440 0.061
123 1HB ALA 18 1HB ALA 18 3.161 -6.195 1.035
124 2HB ALA 18 2HB ALA 18 4.859 -6.637 0.858
125 3HB ALA 18 3HB ALA 18 3.882 -6.296 -0.571
126 H HIS 19 H HIS 19 2.606 -3.144 1.565
127 HA HIS 19 HA HIS 19 1.228 -2.608 -0.925
128 1HB HIS 19 2HB HIS 19 -0.334 -3.006 0.728
129 2HB HIS 19 1HB HIS 19 0.636 -2.240 1.979
130 HD2 HIS 19 2HD HIS 19 -0.456 0.041 2.799
131 HE1 HIS 19 1HE HIS 19 -2.436 1.060 -0.801
132 HE2 HIS 19 2HE HIS 19 -1.860 1.828 1.546
133 H ILE 20 H ILE 20 2.272 -0.501 1.760
134 HA ILE 20 HA ILE 20 2.133 1.894 0.344
135 HB ILE 20 HB ILE 20 2.295 1.776 2.793
136 1HG1 ILE 20 2HG1 ILE 20 4.688 3.372 2.004
137 2HG1 ILE 20 1HG1 ILE 20 3.151 3.760 1.238
138 1HG2 ILE 20 1HG2 ILE 20 4.266 0.018 2.499
139 2HG2 ILE 20 2HG2 ILE 20 4.086 1.000 3.953
140 3HG2 ILE 20 3HG2 ILE 20 5.241 1.473 2.708
141 1HD1 ILE 20 1HD1 ILE 20 3.114 3.486 4.172
142 2HD1 ILE 20 2HD1 ILE 20 2.283 4.635 3.122
143 3HD1 ILE 20 3HD1 ILE 20 3.986 4.872 3.516
144 H THR 21 H THR 21 4.507 -0.598 0.182
145 HA THR 21 HA THR 21 6.799 0.799 -0.519
146 HB THR 21 HB THR 21 6.715 -1.638 -0.109
147 HG1 THR 21 1HG THR 21 8.547 -1.410 -1.095
148 1HG2 THR 21 1HG2 THR 21 5.727 -3.167 -1.430
149 2HG2 THR 21 2HG2 THR 21 5.987 -2.229 -2.901
150 3HG2 THR 21 3HG2 THR 21 4.664 -1.812 -1.811
151 H HIS 22 H HIS 22 3.989 -0.010 -2.477
152 HA HIS 22 HA HIS 22 5.100 1.680 -4.614
153 1HB HIS 22 2HB HIS 22 4.191 0.195 -6.306
154 2HB HIS 22 1HB HIS 22 5.274 -0.705 -5.249
155 HD1 HIS 22 1HD HIS 22 4.273 -2.610 -3.886
156 HD2 HIS 22 2HD HIS 22 1.441 -0.453 -6.028
157 HE1 HIS 22 1HE HIS 22 2.151 -3.950 -3.732
158 HE2 HIS 22 2HE HIS 22 0.485 -2.684 -5.135
159 H CYS 23 H CYS 23 2.926 1.796 -2.351
160 HA CYS 23 HA CYS 23 0.832 2.916 -4.091
161 1HB CYS 23 2HB CYS 23 0.624 1.233 -1.627
162 2HB CYS 23 1HB CYS 23 -0.633 2.412 -1.969
163 H TYR 24 H TYR 24 1.748 4.988 -4.003
164 HA TYR 24 HA TYR 24 1.786 6.261 -1.352
165 1HB TYR 24 2HB TYR 24 3.106 7.096 -3.942
166 2HB TYR 24 1HB TYR 24 3.150 8.033 -2.453
167 HD1 TYR 24 1HD TYR 24 4.162 6.870 -0.377
168 HD2 TYR 24 2HD TYR 24 4.744 5.494 -4.361
169 HE1 TYR 24 1HE TYR 24 6.153 5.625 0.350
170 HE2 TYR 24 2HE TYR 24 6.737 4.244 -3.644
171 HH TYR 24 HH TYR 24 7.430 3.511 -0.538
172 H LYS 25 H LYS 25 1.200 7.367 -4.692
173 HA LYS 25 HA LYS 25 -1.487 8.080 -4.300
174 1HB LYS 25 2HB LYS 25 -1.252 10.549 -4.230
175 2HB LYS 25 1HB LYS 25 -0.663 9.761 -2.773
176 1HG LYS 25 2HG LYS 25 1.564 10.185 -3.293
177 2HG LYS 25 1HG LYS 25 1.208 10.474 -4.997
178 1HD LYS 25 2HD LYS 25 1.688 12.574 -3.896
179 2HD LYS 25 1HD LYS 25 -0.013 12.524 -4.364
180 1HE LYS 25 2HE LYS 25 -0.305 13.241 -2.238
181 2HE LYS 25 1HE LYS 25 -0.210 11.515 -1.892
182 1HZ LYS 25 1HZ LYS 25 1.232 13.126 -0.537
183 2HZ LYS 25 2HZ LYS 25 2.228 13.171 -1.902
184 3HZ LYS 25 3HZ LYS 25 1.943 11.703 -1.113
Start of MODEL 19
1 1H PHE 1 1HT PHE 1 -2.160 2.256 5.293
2 2H PHE 1 2HT PHE 1 -3.594 2.010 4.381
3 3H PHE 1 3HT PHE 1 -2.059 1.868 3.627
4 HA PHE 1 HA PHE 1 -1.556 0.021 5.117
5 1HB PHE 1 2HB PHE 1 -4.516 0.165 5.722
6 2HB PHE 1 1HB PHE 1 -3.343 -0.958 6.403
7 HD1 PHE 1 1HD PHE 1 -5.005 2.153 6.807
8 HD2 PHE 1 2HD PHE 1 -1.449 0.044 7.811
9 HE1 PHE 1 1HE PHE 1 -4.619 3.704 8.677
10 HE2 PHE 1 2HE PHE 1 -1.054 1.590 9.683
11 HZ PHE 1 HZ PHE 1 -2.642 3.423 10.119
12 H VAL 2 H VAL 2 -1.705 -1.995 4.168
13 HA VAL 2 HA VAL 2 -2.518 -2.136 1.499
14 HB VAL 2 HB VAL 2 -0.816 -3.625 2.463
15 1HG1 VAL 2 1HG1 VAL 2 -1.371 -5.473 3.871
16 2HG1 VAL 2 2HG1 VAL 2 -3.093 -5.119 3.749
17 3HG1 VAL 2 3HG1 VAL 2 -2.025 -4.013 4.612
18 1HG2 VAL 2 1HG2 VAL 2 -1.656 -4.363 0.399
19 2HG2 VAL 2 2HG2 VAL 2 -3.187 -4.877 1.108
20 3HG2 VAL 2 3HG2 VAL 2 -1.711 -5.784 1.442
21 H SER 3 H SER 3 -4.218 -2.883 4.459
22 HA SER 3 HA SER 3 -6.316 -4.409 3.363
23 1HB SER 3 2HB SER 3 -5.876 -2.903 5.894
24 2HB SER 3 1HB SER 3 -7.536 -3.330 5.481
25 HG SER 3 HG SER 3 -5.365 -5.155 5.603
26 H THR 4 H THR 4 -5.738 -0.972 3.531
27 HA THR 4 HA THR 4 -8.391 -0.467 2.364
28 HB THR 4 HB THR 4 -7.644 1.995 2.942
29 HG1 THR 4 1HG THR 4 -5.781 1.984 3.897
30 1HG2 THR 4 1HG2 THR 4 -9.311 0.219 4.176
31 2HG2 THR 4 2HG2 THR 4 -9.117 1.919 4.604
32 3HG2 THR 4 3HG2 THR 4 -8.211 0.680 5.474
33 H CYS 5 H CYS 5 -5.951 -1.443 0.957
34 HA CYS 5 HA CYS 5 -4.826 0.649 -0.570
35 1HB CYS 5 2HB CYS 5 -3.760 -1.547 -0.386
36 2HB CYS 5 1HB CYS 5 -5.111 -2.290 -1.236
37 H TYR 6 H TYR 6 -5.163 1.111 -2.833
38 HA TYR 6 HA TYR 6 -8.001 0.969 -3.541
39 1HB TYR 6 2HB TYR 6 -7.394 2.760 -5.202
40 2HB TYR 6 1HB TYR 6 -7.170 3.210 -3.515
41 HD1 TYR 6 1HD TYR 6 -5.505 2.504 -6.688
42 HD2 TYR 6 2HD TYR 6 -4.924 3.484 -2.589
43 HE1 TYR 6 1HE TYR 6 -3.174 3.120 -7.171
44 HE2 TYR 6 2HE TYR 6 -2.592 4.102 -3.061
45 HH TYR 6 HH TYR 6 -0.874 3.222 -5.312
46 H LEU 7 H LEU 7 -4.787 0.479 -4.977
47 HA LEU 7 HA LEU 7 -5.917 -0.704 -7.356
48 1HB LEU 7 2HB LEU 7 -3.589 -1.030 -8.045
49 2HB LEU 7 1HB LEU 7 -3.900 0.623 -7.550
50 HG LEU 7 HG LEU 7 -2.975 -0.295 -5.226
51 1HD1 LEU 7 1HD1 LEU 7 -1.677 -2.127 -5.287
52 2HD1 LEU 7 2HD1 LEU 7 -1.086 -1.783 -6.913
53 3HD1 LEU 7 3HD1 LEU 7 -2.659 -2.546 -6.690
54 1HD2 LEU 7 1HD2 LEU 7 -1.768 1.477 -5.904
55 2HD2 LEU 7 2HD2 LEU 7 -1.737 0.947 -7.585
56 3HD2 LEU 7 3HD2 LEU 7 -0.609 0.252 -6.420
57 HA PRO 8 HA PRO 8 -5.957 -4.850 -5.784
58 1HB PRO 8 2HB PRO 8 -6.195 -6.207 -8.097
59 2HB PRO 8 1HB PRO 8 -7.517 -5.233 -7.443
60 1HG PRO 8 2HG PRO 8 -5.557 -4.558 -9.602
61 2HG PRO 8 1HG PRO 8 -7.306 -4.269 -9.549
62 1HD PRO 8 2HD PRO 8 -5.449 -2.350 -8.989
63 2HD PRO 8 1HD PRO 8 -7.077 -2.368 -8.282
64 H LYS 9 H LYS 9 -4.852 -7.001 -6.189
65 HA LYS 9 HA LYS 9 -2.952 -8.247 -6.261
66 1HB LYS 9 2HB LYS 9 -3.114 -7.602 -8.692
67 2HB LYS 9 1HB LYS 9 -1.991 -6.293 -8.352
68 1HG LYS 9 2HG LYS 9 -0.541 -8.273 -7.370
69 2HG LYS 9 1HG LYS 9 -1.514 -9.216 -8.501
70 1HD LYS 9 2HD LYS 9 -0.831 -7.169 -10.097
71 2HD LYS 9 1HD LYS 9 0.566 -7.176 -9.017
72 1HE LYS 9 2HE LYS 9 1.355 -8.712 -10.464
73 2HE LYS 9 1HE LYS 9 0.336 -9.814 -9.538
74 1HZ LYS 9 1HZ LYS 9 -0.144 -10.168 -11.808
75 2HZ LYS 9 2HZ LYS 9 -0.293 -8.514 -12.126
76 3HZ LYS 9 3HZ LYS 9 -1.458 -9.301 -11.188
77 H CYS 10 H CYS 10 -3.061 -6.410 -4.231
78 HA CYS 10 HA CYS 10 -0.264 -5.502 -4.028
79 1HB CYS 10 2HB CYS 10 -2.327 -3.809 -4.024
80 2HB CYS 10 1HB CYS 10 -2.358 -4.250 -2.321
81 H ALA 11 H ALA 11 -3.065 -6.709 -2.215
82 HA ALA 11 HA ALA 11 -1.465 -7.322 0.106
83 1HB ALA 11 1HB ALA 11 -3.770 -8.564 0.638
84 2HB ALA 11 2HB ALA 11 -4.334 -7.441 -0.600
85 3HB ALA 11 3HB ALA 11 -3.546 -6.828 0.853
86 H ALA 12 H ALA 12 -0.074 -8.966 -0.029
87 HA ALA 12 HA ALA 12 -0.938 -11.429 -1.392
88 1HB ALA 12 1HB ALA 12 1.679 -10.069 -1.135
89 2HB ALA 12 2HB ALA 12 0.987 -10.954 -2.495
90 3HB ALA 12 3HB ALA 12 1.685 -11.833 -1.134
91 H ALA 13 H ALA 13 0.296 -10.094 1.591
92 HA ALA 13 HA ALA 13 -0.483 -12.504 2.999
93 1HB ALA 13 1HB ALA 13 1.877 -12.287 4.208
94 2HB ALA 13 2HB ALA 13 2.346 -11.716 2.607
95 3HB ALA 13 3HB ALA 13 1.628 -13.316 2.799
96 H ALA 14 H ALA 14 -1.427 -9.791 2.940
97 HA ALA 14 HA ALA 14 -2.141 -8.163 4.361
98 1HB ALA 14 1HB ALA 14 -2.410 -10.423 5.745
99 2HB ALA 14 2HB ALA 14 -2.777 -8.841 6.432
100 3HB ALA 14 3HB ALA 14 -1.231 -9.615 6.777
101 H ASN 15 H ASN 15 0.615 -8.142 3.398
102 HA ASN 15 HA ASN 15 2.137 -6.996 5.599
103 1HB ASN 15 2HB ASN 15 2.761 -7.864 2.811
104 2HB ASN 15 1HB ASN 15 3.803 -6.660 3.564
105 1HD2 ASN 15 1HD2 ASN 15 5.539 -7.532 4.402
106 2HD2 ASN 15 2HD2 ASN 15 5.638 -9.064 5.195
107 H VAL 16 H VAL 16 1.943 -4.921 6.089
108 HA VAL 16 HA VAL 16 0.616 -3.052 4.406
109 HB VAL 16 HB VAL 16 0.543 -2.876 6.855
110 1HG1 VAL 16 1HG1 VAL 16 3.342 -1.817 6.845
111 2HG1 VAL 16 2HG1 VAL 16 3.033 -3.541 7.041
112 3HG1 VAL 16 3HG1 VAL 16 2.370 -2.390 8.200
113 1HG2 VAL 16 1HG2 VAL 16 0.299 -0.632 6.808
114 2HG2 VAL 16 2HG2 VAL 16 0.600 -0.847 5.084
115 3HG2 VAL 16 3HG2 VAL 16 1.914 -0.363 6.154
116 H ALA 17 H ALA 17 4.007 -3.622 5.241
117 HA ALA 17 HA ALA 17 5.120 -1.375 4.009
118 1HB ALA 17 1HB ALA 17 6.146 -4.069 4.756
119 2HB ALA 17 2HB ALA 17 6.638 -2.475 5.327
120 3HB ALA 17 3HB ALA 17 7.140 -3.034 3.731
121 H ALA 18 H ALA 18 4.567 -4.637 2.702
122 HA ALA 18 HA ALA 18 5.614 -4.217 0.153
123 1HB ALA 18 1HB ALA 18 3.246 -5.986 0.686
124 2HB ALA 18 2HB ALA 18 4.872 -6.402 1.229
125 3HB ALA 18 3HB ALA 18 4.540 -6.203 -0.492
126 H HIS 19 H HIS 19 2.714 -3.031 1.569
127 HA HIS 19 HA HIS 19 1.411 -2.509 -0.966
128 1HB HIS 19 2HB HIS 19 -0.204 -2.973 0.610
129 2HB HIS 19 1HB HIS 19 0.699 -2.219 1.916
130 HD2 HIS 19 2HD HIS 19 -0.467 0.021 2.751
131 HE1 HIS 19 1HE HIS 19 -2.358 1.076 -0.884
132 HE2 HIS 19 2HE HIS 19 -2.151 1.612 1.585
133 H ILE 20 H ILE 20 2.316 -0.413 1.780
134 HA ILE 20 HA ILE 20 2.136 1.997 0.386
135 HB ILE 20 HB ILE 20 2.201 1.869 2.831
136 1HG1 ILE 20 2HG1 ILE 20 4.589 3.519 2.097
137 2HG1 ILE 20 1HG1 ILE 20 3.029 3.902 1.373
138 1HG2 ILE 20 1HG2 ILE 20 4.798 0.627 2.294
139 2HG2 ILE 20 2HG2 ILE 20 3.713 0.446 3.673
140 3HG2 ILE 20 3HG2 ILE 20 4.814 1.821 3.592
141 1HD1 ILE 20 1HD1 ILE 20 2.798 3.539 4.224
142 2HD1 ILE 20 2HD1 ILE 20 2.346 4.915 3.218
143 3HD1 ILE 20 3HD1 ILE 20 3.997 4.767 3.820
144 H THR 21 H THR 21 4.585 -0.418 0.269
145 HA THR 21 HA THR 21 6.857 1.068 -0.322
146 HB THR 21 HB THR 21 6.838 -1.375 0.067
147 HG1 THR 21 1HG THR 21 8.005 -0.474 -2.350
148 1HG2 THR 21 1HG2 THR 21 5.959 -2.922 -1.308
149 2HG2 THR 21 2HG2 THR 21 6.255 -1.965 -2.758
150 3HG2 THR 21 3HG2 THR 21 4.871 -1.601 -1.728
151 H HIS 22 H HIS 22 4.113 0.268 -2.350
152 HA HIS 22 HA HIS 22 5.256 1.988 -4.441
153 1HB HIS 22 2HB HIS 22 4.470 0.492 -6.185
154 2HB HIS 22 1HB HIS 22 5.545 -0.380 -5.099
155 HD1 HIS 22 1HD HIS 22 4.574 -2.349 -3.815
156 HD2 HIS 22 2HD HIS 22 1.731 -0.254 -6.003
157 HE1 HIS 22 1HE HIS 22 2.500 -3.769 -3.754
158 HE2 HIS 22 2HE HIS 22 0.834 -2.539 -5.189
159 H CYS 23 H CYS 23 3.020 2.041 -2.264
160 HA CYS 23 HA CYS 23 0.941 3.079 -4.069
161 1HB CYS 23 2HB CYS 23 0.711 1.361 -1.634
162 2HB CYS 23 1HB CYS 23 -0.574 2.505 -1.992
163 H TYR 24 H TYR 24 0.793 5.208 -3.911
164 HA TYR 24 HA TYR 24 0.995 6.452 -1.262
165 1HB TYR 24 2HB TYR 24 2.466 7.307 -3.756
166 2HB TYR 24 1HB TYR 24 2.239 8.366 -2.368
167 HD1 TYR 24 1HD TYR 24 3.459 8.000 -0.311
168 HD2 TYR 24 2HD TYR 24 3.942 5.367 -3.617
169 HE1 TYR 24 1HE TYR 24 5.466 7.050 0.747
170 HE2 TYR 24 2HE TYR 24 5.950 4.409 -2.568
171 HH TYR 24 HH TYR 24 6.721 4.321 0.190
172 H LYS 25 H LYS 25 0.173 6.983 -4.682
173 HA LYS 25 HA LYS 25 -2.445 7.842 -4.153
174 1HB LYS 25 2HB LYS 25 -2.137 10.263 -4.829
175 2HB LYS 25 1HB LYS 25 -1.583 9.841 -3.214
176 1HG LYS 25 2HG LYS 25 0.703 9.479 -4.535
177 2HG LYS 25 1HG LYS 25 -0.043 10.680 -5.592
178 1HD LYS 25 2HD LYS 25 0.146 12.330 -4.063
179 2HD LYS 25 1HD LYS 25 -0.212 11.255 -2.709
180 1HE LYS 25 2HE LYS 25 2.205 10.312 -3.469
181 2HE LYS 25 1HE LYS 25 2.374 12.013 -3.901
182 1HZ LYS 25 1HZ LYS 25 1.332 12.248 -1.478
183 2HZ LYS 25 2HZ LYS 25 2.998 12.163 -1.755
184 3HZ LYS 25 3HZ LYS 25 2.149 10.780 -1.277
Start of MODEL 20
1 1H PHE 1 1HT PHE 1 -2.589 2.570 4.851
2 2H PHE 1 2HT PHE 1 -4.014 2.135 3.999
3 3H PHE 1 3HT PHE 1 -2.497 2.126 3.197
4 HA PHE 1 HA PHE 1 -1.761 0.420 4.784
5 1HB PHE 1 2HB PHE 1 -4.727 0.397 5.394
6 2HB PHE 1 1HB PHE 1 -3.558 -0.783 5.978
7 HD1 PHE 1 1HD PHE 1 -5.079 2.415 6.525
8 HD2 PHE 1 2HD PHE 1 -1.715 -0.001 7.506
9 HE1 PHE 1 1HE PHE 1 -4.638 3.834 8.486
10 HE2 PHE 1 2HE PHE 1 -1.268 1.412 9.470
11 HZ PHE 1 HZ PHE 1 -2.731 3.332 9.962
12 H VAL 2 H VAL 2 -1.822 -1.743 4.045
13 HA VAL 2 HA VAL 2 -2.417 -2.077 1.332
14 HB VAL 2 HB VAL 2 -0.744 -3.435 2.511
15 1HG1 VAL 2 1HG1 VAL 2 -2.862 -5.198 3.635
16 2HG1 VAL 2 2HG1 VAL 2 -2.430 -3.729 4.511
17 3HG1 VAL 2 3HG1 VAL 2 -1.200 -4.946 4.168
18 1HG2 VAL 2 1HG2 VAL 2 -0.953 -5.156 1.067
19 2HG2 VAL 2 2HG2 VAL 2 -2.303 -4.204 0.449
20 3HG2 VAL 2 3HG2 VAL 2 -2.600 -5.526 1.580
21 H SER 3 H SER 3 -4.316 -2.683 4.198
22 HA SER 3 HA SER 3 -6.282 -4.334 2.997
23 1HB SER 3 2HB SER 3 -6.713 -2.518 5.373
24 2HB SER 3 1HB SER 3 -7.545 -4.028 5.000
25 HG SER 3 HG SER 3 -5.371 -5.003 5.202
26 H THR 4 H THR 4 -5.821 -0.880 3.185
27 HA THR 4 HA THR 4 -8.421 -0.456 1.876
28 HB THR 4 HB THR 4 -6.694 1.727 3.015
29 HG1 THR 4 1HG THR 4 -6.990 0.372 4.734
30 1HG2 THR 4 1HG2 THR 4 -8.714 2.259 1.606
31 2HG2 THR 4 2HG2 THR 4 -8.677 2.972 3.219
32 3HG2 THR 4 3HG2 THR 4 -9.686 1.562 2.901
33 H CYS 5 H CYS 5 -5.865 -1.379 0.613
34 HA CYS 5 HA CYS 5 -4.749 0.723 -0.901
35 1HB CYS 5 2HB CYS 5 -3.609 -1.424 -0.612
36 2HB CYS 5 1HB CYS 5 -4.881 -2.236 -1.517
37 H TYR 6 H TYR 6 -5.316 1.637 -2.800
38 HA TYR 6 HA TYR 6 -7.965 1.533 -3.690
39 1HB TYR 6 2HB TYR 6 -7.181 2.853 -5.618
40 2HB TYR 6 1HB TYR 6 -6.528 3.463 -4.101
41 HD1 TYR 6 1HD TYR 6 -5.753 1.978 -7.321
42 HD2 TYR 6 2HD TYR 6 -4.146 3.081 -3.539
43 HE1 TYR 6 1HE TYR 6 -3.480 1.816 -8.247
44 HE2 TYR 6 2HE TYR 6 -1.869 2.923 -4.455
45 HH TYR 6 HH TYR 6 -0.704 1.785 -6.310
46 H LEU 7 H LEU 7 -5.074 -0.127 -4.842
47 HA LEU 7 HA LEU 7 -6.711 -1.562 -6.813
48 1HB LEU 7 2HB LEU 7 -4.579 -2.239 -7.833
49 2HB LEU 7 1HB LEU 7 -4.766 -0.496 -7.764
50 HG LEU 7 HG LEU 7 -3.348 -0.640 -5.606
51 1HD1 LEU 7 1HD1 LEU 7 -2.979 -2.765 -4.983
52 2HD1 LEU 7 2HD1 LEU 7 -1.687 -2.694 -6.180
53 3HD1 LEU 7 3HD1 LEU 7 -3.246 -3.399 -6.606
54 1HD2 LEU 7 1HD2 LEU 7 -2.760 -0.046 -8.173
55 2HD2 LEU 7 2HD2 LEU 7 -1.636 -1.374 -7.884
56 3HD2 LEU 7 3HD2 LEU 7 -1.601 0.052 -6.846
57 HA PRO 8 HA PRO 8 -6.517 -5.243 -4.380
58 1HB PRO 8 2HB PRO 8 -6.891 -7.123 -6.277
59 2HB PRO 8 1HB PRO 8 -8.181 -6.024 -5.772
60 1HG PRO 8 2HG PRO 8 -6.400 -5.878 -8.174
61 2HG PRO 8 1HG PRO 8 -8.146 -5.591 -8.058
62 1HD PRO 8 2HD PRO 8 -6.307 -3.584 -8.121
63 2HD PRO 8 1HD PRO 8 -7.867 -3.445 -7.286
64 H LYS 9 H LYS 9 -4.444 -4.995 -7.217
65 HA LYS 9 HA LYS 9 -2.802 -7.229 -6.621
66 1HB LYS 9 2HB LYS 9 -3.082 -5.706 -8.799
67 2HB LYS 9 1HB LYS 9 -1.669 -4.917 -8.112
68 1HG LYS 9 2HG LYS 9 -0.310 -6.663 -8.549
69 2HG LYS 9 1HG LYS 9 -1.571 -7.861 -8.248
70 1HD LYS 9 2HD LYS 9 -2.565 -7.411 -10.406
71 2HD LYS 9 1HD LYS 9 -1.410 -6.109 -10.700
72 1HE LYS 9 2HE LYS 9 0.257 -7.533 -11.242
73 2HE LYS 9 1HE LYS 9 -0.244 -8.737 -10.055
74 1HZ LYS 9 1HZ LYS 9 -1.557 -9.781 -11.536
75 2HZ LYS 9 2HZ LYS 9 -0.528 -9.063 -12.670
76 3HZ LYS 9 3HZ LYS 9 -2.024 -8.355 -12.321
77 H CYS 10 H CYS 10 -2.619 -6.724 -4.271
78 HA CYS 10 HA CYS 10 -0.046 -5.547 -3.755
79 1HB CYS 10 2HB CYS 10 -2.319 -3.898 -3.478
80 2HB CYS 10 1HB CYS 10 -1.825 -4.328 -1.844
81 H ALA 11 H ALA 11 -3.016 -6.304 -1.921
82 HA ALA 11 HA ALA 11 -1.715 -7.419 0.290
83 1HB ALA 11 1HB ALA 11 -4.022 -8.629 0.540
84 2HB ALA 11 2HB ALA 11 -4.492 -7.565 -0.786
85 3HB ALA 11 3HB ALA 11 -3.905 -6.879 0.729
86 H ALA 12 H ALA 12 -0.162 -8.920 -0.184
87 HA ALA 12 HA ALA 12 -1.033 -11.349 -1.602
88 1HB ALA 12 1HB ALA 12 0.936 -9.943 -2.472
89 2HB ALA 12 2HB ALA 12 1.148 -11.689 -2.346
90 3HB ALA 12 3HB ALA 12 1.835 -10.628 -1.118
91 H ALA 13 H ALA 13 0.399 -10.097 1.328
92 HA ALA 13 HA ALA 13 -0.096 -12.646 2.641
93 1HB ALA 13 1HB ALA 13 2.302 -12.203 3.739
94 2HB ALA 13 2HB ALA 13 2.601 -11.546 2.131
95 3HB ALA 13 3HB ALA 13 2.072 -13.218 2.315
96 H ALA 14 H ALA 14 -1.250 -9.970 2.753
97 HA ALA 14 HA ALA 14 -2.033 -8.489 4.293
98 1HB ALA 14 1HB ALA 14 -2.248 -10.813 5.495
99 2HB ALA 14 2HB ALA 14 -2.538 -9.311 6.374
100 3HB ALA 14 3HB ALA 14 -0.993 -10.146 6.540
101 H ASN 15 H ASN 15 0.701 -8.234 3.313
102 HA ASN 15 HA ASN 15 2.129 -7.102 5.599
103 1HB ASN 15 2HB ASN 15 3.071 -8.569 3.544
104 2HB ASN 15 1HB ASN 15 3.305 -6.954 2.881
105 1HD2 ASN 15 1HD2 ASN 15 5.117 -9.134 3.974
106 2HD2 ASN 15 2HD2 ASN 15 6.159 -8.294 5.066
107 H VAL 16 H VAL 16 1.847 -5.037 6.087
108 HA VAL 16 HA VAL 16 0.523 -3.213 4.342
109 HB VAL 16 HB VAL 16 0.294 -3.061 6.782
110 1HG1 VAL 16 1HG1 VAL 16 3.163 -2.131 6.775
111 2HG1 VAL 16 2HG1 VAL 16 2.598 -3.695 7.363
112 3HG1 VAL 16 3HG1 VAL 16 2.088 -2.213 8.172
113 1HG2 VAL 16 1HG2 VAL 16 0.115 -1.061 5.165
114 2HG2 VAL 16 2HG2 VAL 16 1.633 -0.533 5.890
115 3HG2 VAL 16 3HG2 VAL 16 0.200 -0.738 6.897
116 H ALA 17 H ALA 17 3.878 -3.639 5.386
117 HA ALA 17 HA ALA 17 4.965 -1.339 4.228
118 1HB ALA 17 1HB ALA 17 6.056 -3.984 5.048
119 2HB ALA 17 2HB ALA 17 6.453 -2.368 5.630
120 3HB ALA 17 3HB ALA 17 7.067 -2.919 4.071
121 H ALA 18 H ALA 18 4.536 -4.595 2.879
122 HA ALA 18 HA ALA 18 5.762 -4.159 0.407
123 1HB ALA 18 1HB ALA 18 3.391 -5.929 0.469
124 2HB ALA 18 2HB ALA 18 4.707 -6.312 1.578
125 3HB ALA 18 3HB ALA 18 5.014 -6.224 -0.156
126 H HIS 19 H HIS 19 2.776 -2.990 1.637
127 HA HIS 19 HA HIS 19 1.616 -2.490 -0.969
128 1HB HIS 19 2HB HIS 19 -0.089 -2.928 0.511
129 2HB HIS 19 1HB HIS 19 0.750 -2.189 1.866
130 HD2 HIS 19 2HD HIS 19 -0.407 0.079 2.641
131 HE1 HIS 19 1HE HIS 19 -2.146 1.134 -1.069
132 HE2 HIS 19 2HE HIS 19 -1.744 1.869 1.324
133 H ILE 20 H ILE 20 2.338 -0.355 1.800
134 HA ILE 20 HA ILE 20 2.243 2.038 0.377
135 HB ILE 20 HB ILE 20 2.183 1.932 2.825
136 1HG1 ILE 20 2HG1 ILE 20 4.597 3.587 2.390
137 2HG1 ILE 20 1HG1 ILE 20 3.248 3.904 1.304
138 1HG2 ILE 20 1HG2 ILE 20 4.800 0.683 2.432
139 2HG2 ILE 20 2HG2 ILE 20 3.652 0.524 3.761
140 3HG2 ILE 20 3HG2 ILE 20 4.759 1.896 3.712
141 1HD1 ILE 20 1HD1 ILE 20 1.796 4.310 3.211
142 2HD1 ILE 20 2HD1 ILE 20 3.209 5.365 3.252
143 3HD1 ILE 20 3HD1 ILE 20 3.128 3.956 4.310
144 H THR 21 H THR 21 4.711 -0.365 0.434
145 HA THR 21 HA THR 21 7.001 1.123 -0.067
146 HB THR 21 HB THR 21 6.961 -1.320 0.359
147 HG1 THR 21 1HG THR 21 8.879 -1.048 -0.425
148 1HG2 THR 21 1HG2 THR 21 6.177 -2.885 -1.049
149 2HG2 THR 21 2HG2 THR 21 6.576 -1.949 -2.490
150 3HG2 THR 21 3HG2 THR 21 5.121 -1.572 -1.567
151 H HIS 22 H HIS 22 4.396 0.222 -2.242
152 HA HIS 22 HA HIS 22 5.628 1.930 -4.294
153 1HB HIS 22 2HB HIS 22 4.930 0.396 -6.047
154 2HB HIS 22 1HB HIS 22 5.963 -0.444 -4.896
155 HD1 HIS 22 1HD HIS 22 4.958 -2.407 -3.635
156 HD2 HIS 22 2HD HIS 22 2.185 -0.361 -5.955
157 HE1 HIS 22 1HE HIS 22 2.893 -3.840 -3.632
158 HE2 HIS 22 2HE HIS 22 1.274 -2.642 -5.146
159 H CYS 23 H CYS 23 3.318 2.081 -2.239
160 HA CYS 23 HA CYS 23 1.316 3.049 -4.165
161 1HB CYS 23 2HB CYS 23 0.975 1.371 -1.717
162 2HB CYS 23 1HB CYS 23 -0.288 2.520 -2.135
163 H TYR 24 H TYR 24 1.355 5.195 -4.090
164 HA TYR 24 HA TYR 24 1.129 6.514 -1.496
165 1HB TYR 24 2HB TYR 24 3.410 6.787 -3.372
166 2HB TYR 24 1HB TYR 24 2.796 8.276 -2.663
167 HD1 TYR 24 1HD TYR 24 2.335 8.017 -0.005
168 HD2 TYR 24 2HD TYR 24 5.157 5.777 -2.268
169 HE1 TYR 24 1HE TYR 24 3.618 7.573 2.045
170 HE2 TYR 24 2HE TYR 24 6.446 5.325 -0.224
171 HH TYR 24 HH TYR 24 5.577 5.317 2.537
172 H LYS 25 H LYS 25 1.245 6.976 -5.018
173 HA LYS 25 HA LYS 25 -1.112 8.710 -4.787
174 1HB LYS 25 2HB LYS 25 1.519 9.358 -6.026
175 2HB LYS 25 1HB LYS 25 0.069 9.941 -6.830
176 1HG LYS 25 2HG LYS 25 0.442 10.419 -3.908
177 2HG LYS 25 1HG LYS 25 1.273 11.436 -5.087
178 1HD LYS 25 2HD LYS 25 -0.619 12.657 -4.995
179 2HD LYS 25 1HD LYS 25 -1.233 11.431 -6.108
180 1HE LYS 25 2HE LYS 25 -2.318 10.257 -4.365
181 2HE LYS 25 1HE LYS 25 -1.464 11.169 -3.122
182 1HZ LYS 25 1HZ LYS 25 -3.697 12.032 -4.843
183 2HZ LYS 25 2HZ LYS 25 -2.656 13.178 -4.159
184 3HZ LYS 25 3HZ LYS 25 -3.545 12.141 -3.161
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