Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
647492 | 6u7q RC | 30666 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -7.385 -0.216 4.488
2 HA2 GLY 1 2HA GLY 1 -6.073 -1.417 5.987
3 HA3 GLY 1 1HA GLY 1 -7.334 -2.644 6.081
4 H ARG 2 H ARG 2 -5.155 -1.254 3.673
5 HA ARG 2 HA ARG 2 -4.158 -3.868 2.956
6 HB2 ARG 2 2HB ARG 2 -6.237 -3.596 1.616
7 HB3 ARG 2 1HB ARG 2 -5.621 -2.085 0.985
8 HG2 ARG 2 2HG ARG 2 -3.773 -3.335 -0.088
9 HG3 ARG 2 1HG ARG 2 -4.497 -4.838 0.496
10 HD2 ARG 2 2HD ARG 2 -6.566 -4.299 -0.720
11 HD3 ARG 2 1HD ARG 2 -5.804 -2.824 -1.313
12 HE ARG 2 HE ARG 2 -4.357 -5.222 -1.918
13 HH11 ARG 2 1HH1 ARG 2 -6.872 -3.001 -3.047
14 HH12 ARG 2 2HH1 ARG 2 -6.760 -3.501 -4.681
15 HH21 ARG 2 1HH2 ARG 2 -4.216 -5.889 -4.158
16 HH22 ARG 2 2HH2 ARG 2 -5.239 -5.146 -5.314
17 H CYS 3 H CYS 3 -2.033 -3.596 2.240
18 HA CYS 3 HA CYS 3 -1.214 -0.859 1.594
19 HB2 CYS 3 2HB CYS 3 0.283 -2.752 3.429
20 HB3 CYS 3 1HB CYS 3 0.868 -1.190 2.879
21 H THR 4 H THR 4 0.369 -0.707 0.044
22 HA THR 4 HA THR 4 0.711 -2.949 -1.651
23 HB THR 4 HB THR 4 2.273 -1.424 -2.890
24 HG1 THR 4 1HG THR 4 3.107 0.196 -1.833
25 HG21 THR 4 1HG2 THR 4 -0.358 -0.182 -2.069
26 HG22 THR 4 2HG2 THR 4 -0.111 -1.322 -3.397
27 HG23 THR 4 3HG2 THR 4 0.595 0.289 -3.473
28 H LYS 5 H LYS 5 2.411 -4.397 -1.701
29 HA LYS 5 HA LYS 5 4.280 -4.195 0.497
30 HB2 LYS 5 2HB LYS 5 4.247 -6.317 -1.662
31 HB3 LYS 5 1HB LYS 5 5.048 -6.400 -0.103
32 HG2 LYS 5 2HG LYS 5 2.095 -6.504 -0.662
33 HG3 LYS 5 1HG LYS 5 3.116 -7.782 -0.029
34 HD2 LYS 5 2HD LYS 5 2.471 -5.195 1.399
35 HD3 LYS 5 1HD LYS 5 1.685 -6.734 1.707
36 HE2 LYS 5 2HE LYS 5 3.845 -7.680 2.415
37 HE3 LYS 5 1HE LYS 5 4.615 -6.121 2.120
38 HZ1 LYS 5 1HZ LYS 5 4.075 -6.381 4.464
39 HZ2 LYS 5 2HZ LYS 5 2.470 -6.666 4.099
40 HZ3 LYS 5 3HZ LYS 5 3.136 -5.146 3.799
41 H SER 6 H SER 6 4.199 -3.796 -2.943
42 HA SER 6 HA SER 6 6.968 -3.375 -3.296
43 HB2 SER 6 2HB SER 6 6.149 -2.211 -5.400
44 HB3 SER 6 1HB SER 6 5.626 -3.887 -5.229
45 HG SER 6 HG SER 6 4.135 -1.685 -4.336
46 H ILE 7 H ILE 7 8.084 -1.673 -2.593
47 HA ILE 7 HA ILE 7 6.786 0.422 -1.191
48 HB ILE 7 HB ILE 7 9.026 1.340 -0.780
49 HG12 ILE 7 2HG1 ILE 7 10.019 -0.815 -2.677
50 HG13 ILE 7 1HG1 ILE 7 10.047 0.915 -2.984
51 HG21 ILE 7 1HG2 ILE 7 10.000 -0.613 0.361
52 HG22 ILE 7 2HG2 ILE 7 8.868 -1.654 -0.505
53 HG23 ILE 7 3HG2 ILE 7 8.264 -0.453 0.638
54 HD11 ILE 7 1HD1 ILE 7 11.581 -0.526 -0.832
55 HD12 ILE 7 2HD1 ILE 7 11.617 1.211 -1.134
56 HD13 ILE 7 3HD1 ILE 7 12.243 0.092 -2.345
57 HA PRO 8 HA PRO 8 7.390 2.693 -0.569
58 HB2 PRO 8 2HB PRO 8 5.293 4.628 -1.230
59 HB3 PRO 8 1HB PRO 8 6.879 4.917 -0.513
60 HG2 PRO 8 2HG PRO 8 6.304 5.684 -3.024
61 HG3 PRO 8 1HG PRO 8 7.918 5.111 -2.564
62 HD2 PRO 8 2HD PRO 8 5.711 3.631 -3.957
63 HD3 PRO 8 1HD PRO 8 7.447 3.676 -4.336
64 HA PRO 9 HA PRO 9 3.796 0.361 0.569
65 HB2 PRO 9 2HB PRO 9 3.804 0.858 3.256
66 HB3 PRO 9 1HB PRO 9 4.917 -0.278 2.488
67 HG2 PRO 9 2HG PRO 9 5.390 2.530 3.378
68 HG3 PRO 9 1HG PRO 9 6.471 1.131 3.467
69 HD2 PRO 9 2HD PRO 9 6.670 3.085 1.566
70 HD3 PRO 9 1HD PRO 9 7.208 1.413 1.314
71 H ARG 10 H ARG 10 2.116 1.354 -0.296
72 HA ARG 10 HA ARG 10 1.051 3.787 0.921
73 HB2 ARG 10 2HB ARG 10 0.374 2.404 -1.686
74 HB3 ARG 10 1HB ARG 10 -0.294 3.935 -1.137
75 HG2 ARG 10 2HG ARG 10 1.888 4.979 -1.271
76 HG3 ARG 10 1HG ARG 10 2.624 3.435 -1.695
77 HD2 ARG 10 2HD ARG 10 0.614 4.983 -3.324
78 HD3 ARG 10 1HD ARG 10 2.331 4.800 -3.674
79 HE ARG 10 HE ARG 10 0.257 2.757 -3.885
80 HH11 ARG 10 1HH1 ARG 10 3.614 3.716 -4.545
81 HH12 ARG 10 2HH1 ARG 10 3.923 2.407 -5.581
82 HH21 ARG 10 1HH2 ARG 10 0.688 0.996 -5.325
83 HH22 ARG 10 2HH2 ARG 10 2.217 0.812 -6.048
84 H CYS 11 H CYS 11 -0.570 3.517 2.290
85 HA CYS 11 HA CYS 11 -1.930 0.956 2.217
86 HB2 CYS 11 2HB CYS 11 -1.572 2.893 4.495
87 HB3 CYS 11 1HB CYS 11 -2.504 1.397 4.571
88 H PHE 12 H PHE 12 -3.970 0.787 2.052
89 HA PHE 12 HA PHE 12 -5.470 3.145 1.272
90 HB2 PHE 12 2HB PHE 12 -6.162 0.210 0.971
91 HB3 PHE 12 1HB PHE 12 -6.982 1.565 0.203
92 HD1 PHE 12 1HD PHE 12 -4.246 -0.756 0.018
93 HD2 PHE 12 2HD PHE 12 -5.748 2.916 -1.506
94 HE1 PHE 12 1HE PHE 12 -2.700 -0.922 -1.870
95 HE2 PHE 12 2HE PHE 12 -4.196 2.752 -3.407
96 HZ PHE 12 HZ PHE 12 -2.669 0.827 -3.583
97 HA PRO 13 HA PRO 13 -7.680 3.151 5.099
98 HB2 PRO 13 2HB PRO 13 -10.161 3.766 3.679
99 HB3 PRO 13 1HB PRO 13 -9.275 4.750 4.846
100 HG2 PRO 13 2HG PRO 13 -9.333 5.369 2.239
101 HG3 PRO 13 1HG PRO 13 -7.888 5.646 3.227
102 HD2 PRO 13 2HD PRO 13 -8.463 3.467 1.267
103 HD3 PRO 13 1HD PRO 13 -6.962 4.369 1.562
104 H ASP 14 H ASP 14 -8.528 0.940 2.707
105 HA ASP 14 HA ASP 14 -10.616 -0.287 4.316
106 HB2 ASP 14 2HB ASP 14 -10.854 -1.956 2.537
107 HB3 ASP 14 1HB ASP 14 -10.921 -0.335 1.874
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -7.410 -0.235 4.407
2 HA2 GLY 1 2HA GLY 1 -6.043 -1.353 5.905
3 HA3 GLY 1 1HA GLY 1 -7.223 -2.660 5.964
4 H ARG 2 H ARG 2 -5.279 -1.186 3.472
5 HA ARG 2 HA ARG 2 -4.022 -3.741 2.924
6 HB2 ARG 2 2HB ARG 2 -5.936 -3.776 1.506
7 HB3 ARG 2 1HB ARG 2 -5.688 -2.115 1.022
8 HG2 ARG 2 2HG ARG 2 -3.750 -2.757 -0.275
9 HG3 ARG 2 1HG ARG 2 -3.902 -4.422 0.298
10 HD2 ARG 2 2HD ARG 2 -4.877 -3.912 -2.007
11 HD3 ARG 2 1HD ARG 2 -5.928 -4.758 -0.870
12 HE ARG 2 HE ARG 2 -6.966 -2.583 -0.399
13 HH11 ARG 2 1HH1 ARG 2 -5.403 -3.016 -3.569
14 HH12 ARG 2 2HH1 ARG 2 -6.246 -1.706 -4.267
15 HH21 ARG 2 1HH2 ARG 2 -8.032 -0.880 -1.344
16 HH22 ARG 2 2HH2 ARG 2 -7.793 -0.447 -2.987
17 H CYS 3 H CYS 3 -1.967 -3.258 3.104
18 HA CYS 3 HA CYS 3 -1.044 -0.655 2.110
19 HB2 CYS 3 2HB CYS 3 0.363 -2.605 3.958
20 HB3 CYS 3 1HB CYS 3 0.923 -0.994 3.521
21 H THR 4 H THR 4 0.516 -0.553 0.571
22 HA THR 4 HA THR 4 0.569 -2.767 -1.132
23 HB THR 4 HB THR 4 2.153 -1.395 -2.511
24 HG1 THR 4 1HG THR 4 3.194 0.012 -1.438
25 HG21 THR 4 1HG2 THR 4 0.519 0.365 -3.053
26 HG22 THR 4 2HG2 THR 4 -0.344 0.008 -1.557
27 HG23 THR 4 3HG2 THR 4 -0.256 -1.204 -2.836
28 H LYS 5 H LYS 5 2.017 -4.252 -1.463
29 HA LYS 5 HA LYS 5 4.152 -4.629 0.441
30 HB2 LYS 5 2HB LYS 5 3.373 -6.260 -1.983
31 HB3 LYS 5 1HB LYS 5 4.422 -6.793 -0.681
32 HG2 LYS 5 2HG LYS 5 1.480 -6.142 -0.416
33 HG3 LYS 5 1HG LYS 5 2.160 -7.761 -0.511
34 HD2 LYS 5 2HD LYS 5 2.733 -5.746 1.674
35 HD3 LYS 5 1HD LYS 5 1.601 -7.091 1.800
36 HE2 LYS 5 2HE LYS 5 3.439 -8.664 1.422
37 HE3 LYS 5 1HE LYS 5 4.568 -7.318 1.312
38 HZ1 LYS 5 1HZ LYS 5 4.621 -8.312 3.471
39 HZ2 LYS 5 2HZ LYS 5 2.981 -8.051 3.718
40 HZ3 LYS 5 3HZ LYS 5 4.034 -6.743 3.600
41 H SER 6 H SER 6 3.636 -3.284 -2.615
42 HA SER 6 HA SER 6 6.351 -3.378 -3.496
43 HB2 SER 6 2HB SER 6 5.131 -1.956 -5.325
44 HB3 SER 6 1HB SER 6 4.808 -3.686 -5.215
45 HG SER 6 HG SER 6 3.065 -1.686 -4.983
46 H ILE 7 H ILE 7 7.619 -1.491 -3.615
47 HA ILE 7 HA ILE 7 6.975 0.450 -1.562
48 HB ILE 7 HB ILE 7 9.311 1.265 -1.858
49 HG12 ILE 7 2HG1 ILE 7 9.563 -1.021 -3.841
50 HG13 ILE 7 1HG1 ILE 7 9.572 0.688 -4.254
51 HG21 ILE 7 1HG2 ILE 7 10.422 -0.726 -0.929
52 HG22 ILE 7 2HG2 ILE 7 9.037 -1.706 -1.410
53 HG23 ILE 7 3HG2 ILE 7 8.843 -0.443 -0.198
54 HD11 ILE 7 1HD1 ILE 7 11.815 -0.248 -4.260
55 HD12 ILE 7 2HD1 ILE 7 11.627 -0.741 -2.576
56 HD13 ILE 7 3HD1 ILE 7 11.650 0.971 -2.997
57 HA PRO 8 HA PRO 8 7.538 2.461 -0.919
58 HB2 PRO 8 2HB PRO 8 5.707 4.701 -0.891
59 HB3 PRO 8 1HB PRO 8 7.455 4.720 -0.656
60 HG2 PRO 8 2HG PRO 8 6.215 5.799 -2.840
61 HG3 PRO 8 1HG PRO 8 7.872 5.179 -2.857
62 HD2 PRO 8 2HD PRO 8 5.354 3.878 -3.812
63 HD3 PRO 8 1HD PRO 8 6.975 3.897 -4.543
64 HA PRO 9 HA PRO 9 3.837 0.367 0.326
65 HB2 PRO 9 2HB PRO 9 4.268 0.409 3.032
66 HB3 PRO 9 1HB PRO 9 5.039 -0.740 1.938
67 HG2 PRO 9 2HG PRO 9 6.135 1.745 3.158
68 HG3 PRO 9 1HG PRO 9 6.950 0.211 2.815
69 HD2 PRO 9 2HD PRO 9 7.203 2.453 1.281
70 HD3 PRO 9 1HD PRO 9 7.403 0.806 0.652
71 H ARG 10 H ARG 10 2.046 1.406 0.132
72 HA ARG 10 HA ARG 10 1.400 3.644 1.942
73 HB2 ARG 10 2HB ARG 10 0.454 3.146 -0.888
74 HB3 ARG 10 1HB ARG 10 -0.158 4.415 0.160
75 HG2 ARG 10 2HG ARG 10 2.051 5.428 0.234
76 HG3 ARG 10 1HG ARG 10 2.676 4.144 -0.801
77 HD2 ARG 10 2HD ARG 10 1.183 4.826 -2.586
78 HD3 ARG 10 1HD ARG 10 0.486 6.074 -1.550
79 HE ARG 10 HE ARG 10 3.068 6.676 -1.493
80 HH11 ARG 10 1HH1 ARG 10 0.852 6.094 -4.212
81 HH12 ARG 10 2HH1 ARG 10 1.707 7.100 -5.290
82 HH21 ARG 10 1HH2 ARG 10 4.218 8.104 -3.028
83 HH22 ARG 10 2HH2 ARG 10 3.610 8.239 -4.613
84 H CYS 11 H CYS 11 -0.699 3.596 2.842
85 HA CYS 11 HA CYS 11 -1.920 0.957 2.623
86 HB2 CYS 11 2HB CYS 11 -1.951 2.878 4.947
87 HB3 CYS 11 1HB CYS 11 -2.752 1.311 4.897
88 H PHE 12 H PHE 12 -3.741 0.823 1.718
89 HA PHE 12 HA PHE 12 -5.306 3.115 1.056
90 HB2 PHE 12 2HB PHE 12 -5.833 0.146 0.729
91 HB3 PHE 12 1HB PHE 12 -6.850 1.414 0.069
92 HD1 PHE 12 1HD PHE 12 -3.768 -0.466 -0.301
93 HD2 PHE 12 2HD PHE 12 -6.048 2.791 -1.799
94 HE1 PHE 12 1HE PHE 12 -2.423 -0.476 -2.349
95 HE2 PHE 12 2HE PHE 12 -4.701 2.789 -3.855
96 HZ PHE 12 HZ PHE 12 -2.885 1.148 -4.134
97 HA PRO 13 HA PRO 13 -8.005 3.276 4.583
98 HB2 PRO 13 2HB PRO 13 -10.306 3.324 2.702
99 HB3 PRO 13 1HB PRO 13 -9.860 4.483 3.959
100 HG2 PRO 13 2HG PRO 13 -9.464 5.089 1.428
101 HG3 PRO 13 1HG PRO 13 -8.218 5.471 2.631
102 HD2 PRO 13 2HD PRO 13 -8.326 3.192 0.685
103 HD3 PRO 13 1HD PRO 13 -6.965 4.259 1.099
104 H ASP 14 H ASP 14 -8.503 0.771 2.248
105 HA ASP 14 HA ASP 14 -10.478 -0.623 3.848
106 HB2 ASP 14 2HB ASP 14 -10.448 -2.327 2.059
107 HB3 ASP 14 1HB ASP 14 -10.742 -0.711 1.439
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -7.449 -0.209 4.673
2 HA2 GLY 1 2HA GLY 1 -6.056 -1.559 5.996
3 HA3 GLY 1 1HA GLY 1 -7.340 -2.764 6.073
4 H ARG 2 H ARG 2 -4.976 -1.331 3.921
5 HA ARG 2 HA ARG 2 -4.428 -3.849 2.611
6 HB2 ARG 2 2HB ARG 2 -6.523 -2.944 1.544
7 HB3 ARG 2 1HB ARG 2 -5.597 -1.528 1.087
8 HG2 ARG 2 2HG ARG 2 -4.091 -3.042 -0.210
9 HG3 ARG 2 1HG ARG 2 -5.237 -4.345 0.123
10 HD2 ARG 2 2HD ARG 2 -5.716 -1.805 -1.424
11 HD3 ARG 2 1HD ARG 2 -5.818 -3.466 -2.004
12 HE ARG 2 HE ARG 2 -7.651 -2.761 0.129
13 HH11 ARG 2 1HH1 ARG 2 -7.241 -2.925 -3.380
14 HH12 ARG 2 2HH1 ARG 2 -8.907 -3.079 -3.691
15 HH21 ARG 2 1HH2 ARG 2 -9.828 -2.925 -0.251
16 HH22 ARG 2 2HH2 ARG 2 -10.478 -3.076 -1.829
17 H CYS 3 H CYS 3 -2.246 -3.665 2.058
18 HA CYS 3 HA CYS 3 -1.244 -0.973 1.510
19 HB2 CYS 3 2HB CYS 3 0.110 -3.009 3.298
20 HB3 CYS 3 1HB CYS 3 0.841 -1.507 2.751
21 H THR 4 H THR 4 0.686 -0.939 0.226
22 HA THR 4 HA THR 4 0.744 -3.048 -1.696
23 HB THR 4 HB THR 4 2.606 -1.675 -2.688
24 HG1 THR 4 1HG THR 4 3.547 -0.494 -1.186
25 HG21 THR 4 1HG2 THR 4 0.287 -1.287 -3.380
26 HG22 THR 4 2HG2 THR 4 1.184 0.230 -3.346
27 HG23 THR 4 3HG2 THR 4 0.067 -0.162 -2.040
28 H LYS 5 H LYS 5 2.461 -4.505 -2.012
29 HA LYS 5 HA LYS 5 4.234 -4.815 0.294
30 HB2 LYS 5 2HB LYS 5 3.656 -6.716 -2.007
31 HB3 LYS 5 1HB LYS 5 4.623 -7.084 -0.585
32 HG2 LYS 5 2HG LYS 5 2.637 -6.771 0.827
33 HG3 LYS 5 1HG LYS 5 1.679 -6.460 -0.616
34 HD2 LYS 5 2HD LYS 5 2.231 -8.708 -1.446
35 HD3 LYS 5 1HD LYS 5 3.148 -9.013 0.030
36 HE2 LYS 5 2HE LYS 5 0.200 -8.392 -0.122
37 HE3 LYS 5 1HE LYS 5 0.897 -9.991 0.132
38 HZ1 LYS 5 1HZ LYS 5 1.161 -7.669 1.994
39 HZ2 LYS 5 2HZ LYS 5 1.858 -9.172 2.214
40 HZ3 LYS 5 3HZ LYS 5 0.183 -9.022 2.206
41 H SER 6 H SER 6 4.241 -2.967 -2.043
42 HA SER 6 HA SER 6 6.959 -3.344 -3.013
43 HB2 SER 6 2HB SER 6 6.078 -1.836 -4.842
44 HB3 SER 6 1HB SER 6 5.344 -3.445 -4.800
45 HG SER 6 HG SER 6 3.599 -2.318 -4.799
46 H ILE 7 H ILE 7 7.922 -1.078 -3.417
47 HA ILE 7 HA ILE 7 7.105 0.707 -1.256
48 HB ILE 7 HB ILE 7 9.375 1.712 -1.441
49 HG12 ILE 7 2HG1 ILE 7 9.976 -0.643 -3.253
50 HG13 ILE 7 1HG1 ILE 7 9.843 1.029 -3.780
51 HG21 ILE 7 1HG2 ILE 7 8.936 0.087 0.285
52 HG22 ILE 7 2HG2 ILE 7 10.579 -0.127 -0.322
53 HG23 ILE 7 3HG2 ILE 7 9.302 -1.234 -0.825
54 HD11 ILE 7 1HD1 ILE 7 11.890 -0.065 -1.870
55 HD12 ILE 7 2HD1 ILE 7 11.765 1.611 -2.397
56 HD13 ILE 7 3HD1 ILE 7 12.164 0.349 -3.563
57 HA PRO 8 HA PRO 8 7.603 2.857 -0.688
58 HB2 PRO 8 2HB PRO 8 5.855 4.916 -0.443
59 HB3 PRO 8 1HB PRO 8 7.478 5.140 -1.105
60 HG2 PRO 8 2HG PRO 8 4.874 4.847 -2.547
61 HG3 PRO 8 1HG PRO 8 6.206 5.971 -2.864
62 HD2 PRO 8 2HD PRO 8 5.830 3.694 -4.291
63 HD3 PRO 8 1HD PRO 8 7.433 4.397 -4.005
64 HA PRO 9 HA PRO 9 4.122 0.535 0.787
65 HB2 PRO 9 2HB PRO 9 4.019 1.437 3.390
66 HB3 PRO 9 1HB PRO 9 5.140 0.197 2.823
67 HG2 PRO 9 2HG PRO 9 5.608 3.101 3.307
68 HG3 PRO 9 1HG PRO 9 6.683 1.725 3.603
69 HD2 PRO 9 2HD PRO 9 6.965 3.375 1.474
70 HD3 PRO 9 1HD PRO 9 7.403 1.654 1.421
71 H ARG 10 H ARG 10 2.352 1.218 -0.155
72 HA ARG 10 HA ARG 10 1.084 3.697 0.745
73 HB2 ARG 10 2HB ARG 10 0.968 2.146 -1.837
74 HB3 ARG 10 1HB ARG 10 -0.177 3.426 -1.448
75 HG2 ARG 10 2HG ARG 10 1.401 5.086 -1.622
76 HG3 ARG 10 1HG ARG 10 2.742 3.991 -1.279
77 HD2 ARG 10 2HD ARG 10 1.102 3.896 -3.801
78 HD3 ARG 10 1HD ARG 10 2.606 4.810 -3.633
79 HE ARG 10 HE ARG 10 3.220 2.318 -2.767
80 HH11 ARG 10 1HH1 ARG 10 2.056 3.678 -5.818
81 HH12 ARG 10 2HH1 ARG 10 2.711 2.453 -6.792
82 HH21 ARG 10 1HH2 ARG 10 4.120 0.593 -4.120
83 HH22 ARG 10 2HH2 ARG 10 3.908 0.637 -5.794
84 H CYS 11 H CYS 11 -0.688 3.454 1.914
85 HA CYS 11 HA CYS 11 -1.972 0.835 1.868
86 HB2 CYS 11 2HB CYS 11 -1.660 2.707 4.226
87 HB3 CYS 11 1HB CYS 11 -2.559 1.193 4.238
88 H PHE 12 H PHE 12 -4.172 0.769 2.216
89 HA PHE 12 HA PHE 12 -5.547 3.210 1.378
90 HB2 PHE 12 2HB PHE 12 -6.262 0.318 0.804
91 HB3 PHE 12 1HB PHE 12 -7.199 1.710 0.292
92 HD1 PHE 12 1HD PHE 12 -6.269 3.285 -1.378
93 HD2 PHE 12 2HD PHE 12 -4.311 -0.365 -0.403
94 HE1 PHE 12 1HE PHE 12 -4.942 3.453 -3.431
95 HE2 PHE 12 2HE PHE 12 -2.978 -0.206 -2.465
96 HZ PHE 12 HZ PHE 12 -3.290 1.704 -3.983
97 HA PRO 13 HA PRO 13 -7.748 3.312 5.137
98 HB2 PRO 13 2HB PRO 13 -10.220 4.122 4.348
99 HB3 PRO 13 1HB PRO 13 -8.811 5.188 4.415
100 HG2 PRO 13 2HG PRO 13 -9.984 3.743 2.067
101 HG3 PRO 13 1HG PRO 13 -9.423 5.423 2.175
102 HD2 PRO 13 2HD PRO 13 -7.919 3.536 1.053
103 HD3 PRO 13 1HD PRO 13 -7.192 4.809 2.052
104 H ASP 14 H ASP 14 -8.503 0.852 3.032
105 HA ASP 14 HA ASP 14 -10.662 -0.152 4.750
106 HB2 ASP 14 2HB ASP 14 -11.247 -1.671 2.999
107 HB3 ASP 14 1HB ASP 14 -11.043 -0.089 2.262
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -7.316 -0.337 4.541
2 HA2 GLY 1 2HA GLY 1 -6.081 -1.759 5.930
3 HA3 GLY 1 1HA GLY 1 -7.357 -2.961 5.772
4 H ARG 2 H ARG 2 -4.996 -1.325 3.743
5 HA ARG 2 HA ARG 2 -3.981 -3.795 2.735
6 HB2 ARG 2 2HB ARG 2 -6.003 -3.716 1.463
7 HB3 ARG 2 1HB ARG 2 -5.771 -2.023 1.092
8 HG2 ARG 2 2HG ARG 2 -3.881 -2.593 -0.333
9 HG3 ARG 2 1HG ARG 2 -4.104 -4.303 0.060
10 HD2 ARG 2 2HD ARG 2 -5.151 -3.592 -2.108
11 HD3 ARG 2 1HD ARG 2 -6.255 -4.342 -0.960
12 HE ARG 2 HE ARG 2 -7.091 -2.147 -0.407
13 HH11 ARG 2 1HH1 ARG 2 -5.120 -2.257 -3.345
14 HH12 ARG 2 2HH1 ARG 2 -5.918 -0.941 -4.084
15 HH21 ARG 2 1HH2 ARG 2 -8.124 -0.370 -1.376
16 HH22 ARG 2 2HH2 ARG 2 -7.681 0.189 -2.935
17 H CYS 3 H CYS 3 -1.895 -3.357 2.518
18 HA CYS 3 HA CYS 3 -1.085 -0.691 1.591
19 HB2 CYS 3 2HB CYS 3 0.452 -2.598 3.384
20 HB3 CYS 3 1HB CYS 3 1.045 -1.055 2.791
21 H THR 4 H THR 4 0.487 -0.671 -0.043
22 HA THR 4 HA THR 4 0.616 -2.994 -1.615
23 HB THR 4 HB THR 4 2.329 -1.666 -2.937
24 HG1 THR 4 1HG THR 4 3.237 -0.133 -1.905
25 HG21 THR 4 1HG2 THR 4 -0.276 -0.273 -2.298
26 HG22 THR 4 2HG2 THR 4 -0.052 -1.547 -3.498
27 HG23 THR 4 3HG2 THR 4 0.715 0.025 -3.726
28 H LYS 5 H LYS 5 2.136 -4.557 -1.701
29 HA LYS 5 HA LYS 5 3.980 -4.772 0.486
30 HB2 LYS 5 2HB LYS 5 4.662 -6.903 -0.564
31 HB3 LYS 5 1HB LYS 5 2.921 -6.808 -0.360
32 HG2 LYS 5 2HG LYS 5 2.666 -6.250 -2.723
33 HG3 LYS 5 1HG LYS 5 4.414 -6.310 -2.933
34 HD2 LYS 5 2HD LYS 5 2.653 -8.612 -2.095
35 HD3 LYS 5 1HD LYS 5 3.297 -8.359 -3.715
36 HE2 LYS 5 2HE LYS 5 5.585 -8.509 -2.781
37 HE3 LYS 5 1HE LYS 5 4.893 -8.859 -1.200
38 HZ1 LYS 5 1HZ LYS 5 4.544 -10.483 -3.643
39 HZ2 LYS 5 2HZ LYS 5 3.877 -10.854 -2.135
40 HZ3 LYS 5 3HZ LYS 5 5.549 -10.873 -2.361
41 H SER 6 H SER 6 4.001 -3.535 -2.664
42 HA SER 6 HA SER 6 6.853 -3.415 -2.776
43 HB2 SER 6 2HB SER 6 6.194 -2.233 -4.984
44 HB3 SER 6 1HB SER 6 5.915 -3.970 -4.847
45 HG SER 6 HG SER 6 4.151 -1.928 -5.117
46 H ILE 7 H ILE 7 7.923 -1.596 -2.327
47 HA ILE 7 HA ILE 7 6.416 0.546 -1.080
48 HB ILE 7 HB ILE 7 8.605 1.366 -0.284
49 HG12 ILE 7 2HG1 ILE 7 9.728 -1.064 -1.704
50 HG13 ILE 7 1HG1 ILE 7 9.981 0.610 -2.186
51 HG21 ILE 7 1HG2 ILE 7 8.119 -1.564 0.210
52 HG22 ILE 7 2HG2 ILE 7 7.348 -0.225 1.057
53 HG23 ILE 7 3HG2 ILE 7 9.083 -0.499 1.233
54 HD11 ILE 7 1HD1 ILE 7 11.909 -0.252 -1.032
55 HD12 ILE 7 2HD1 ILE 7 10.914 -0.686 0.354
56 HD13 ILE 7 3HD1 ILE 7 11.145 1.011 -0.063
57 HA PRO 8 HA PRO 8 7.260 3.050 -0.464
58 HB2 PRO 8 2HB PRO 8 5.381 4.938 -1.226
59 HB3 PRO 8 1HB PRO 8 7.124 5.220 -1.157
60 HG2 PRO 8 2HG PRO 8 5.413 4.507 -3.505
61 HG3 PRO 8 1HG PRO 8 6.729 5.690 -3.400
62 HD2 PRO 8 2HD PRO 8 7.143 3.319 -4.523
63 HD3 PRO 8 1HD PRO 8 8.373 4.046 -3.472
64 HA PRO 9 HA PRO 9 3.677 0.556 0.139
65 HB2 PRO 9 2HB PRO 9 3.447 0.832 2.833
66 HB3 PRO 9 1HB PRO 9 4.646 -0.207 2.061
67 HG2 PRO 9 2HG PRO 9 4.983 2.456 3.319
68 HG3 PRO 9 1HG PRO 9 6.126 1.113 3.205
69 HD2 PRO 9 2HD PRO 9 6.148 3.405 1.608
70 HD3 PRO 9 1HD PRO 9 6.983 1.883 1.251
71 H ARG 10 H ARG 10 1.978 1.412 -0.701
72 HA ARG 10 HA ARG 10 0.734 3.807 0.356
73 HB2 ARG 10 2HB ARG 10 -0.074 1.925 -1.871
74 HB3 ARG 10 1HB ARG 10 -0.918 3.405 -1.449
75 HG2 ARG 10 2HG ARG 10 1.916 3.219 -2.458
76 HG3 ARG 10 1HG ARG 10 0.507 3.710 -3.403
77 HD2 ARG 10 2HD ARG 10 1.632 5.118 -0.983
78 HD3 ARG 10 1HD ARG 10 1.735 5.667 -2.652
79 HE ARG 10 HE ARG 10 -0.875 5.508 -2.397
80 HH11 ARG 10 1HH1 ARG 10 1.478 6.905 -0.156
81 HH12 ARG 10 2HH1 ARG 10 0.353 7.957 0.578
82 HH21 ARG 10 1HH2 ARG 10 -2.411 6.998 -1.398
83 HH22 ARG 10 2HH2 ARG 10 -1.890 7.999 -0.142
84 H CYS 11 H CYS 11 -0.465 3.583 2.140
85 HA CYS 11 HA CYS 11 -1.820 1.037 2.471
86 HB2 CYS 11 2HB CYS 11 -1.060 3.139 4.496
87 HB3 CYS 11 1HB CYS 11 -2.063 1.737 4.865
88 H PHE 12 H PHE 12 -3.757 0.937 2.008
89 HA PHE 12 HA PHE 12 -5.328 3.294 1.505
90 HB2 PHE 12 2HB PHE 12 -5.871 0.349 1.072
91 HB3 PHE 12 1HB PHE 12 -6.928 1.650 0.551
92 HD1 PHE 12 1HD PHE 12 -6.407 2.951 -1.398
93 HD2 PHE 12 2HD PHE 12 -3.717 -0.044 -0.034
94 HE1 PHE 12 1HE PHE 12 -5.209 3.057 -3.536
95 HE2 PHE 12 2HE PHE 12 -2.509 0.056 -2.166
96 HZ PHE 12 HZ PHE 12 -3.252 1.606 -3.929
97 HA PRO 13 HA PRO 13 -7.606 3.083 5.326
98 HB2 PRO 13 2HB PRO 13 -10.058 3.650 3.748
99 HB3 PRO 13 1HB PRO 13 -9.354 4.553 5.093
100 HG2 PRO 13 2HG PRO 13 -9.168 5.505 2.636
101 HG3 PRO 13 1HG PRO 13 -7.786 5.603 3.740
102 HD2 PRO 13 2HD PRO 13 -8.289 3.648 1.526
103 HD3 PRO 13 1HD PRO 13 -6.803 4.544 1.921
104 H ASP 14 H ASP 14 -8.444 1.099 2.655
105 HA ASP 14 HA ASP 14 -10.440 -0.404 4.077
106 HB2 ASP 14 2HB ASP 14 -10.568 -1.859 2.066
107 HB3 ASP 14 1HB ASP 14 -10.837 -0.166 1.708
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -7.192 -0.194 4.359
2 HA2 GLY 1 2HA GLY 1 -5.793 -1.131 6.030
3 HA3 GLY 1 1HA GLY 1 -6.956 -2.443 6.233
4 H ARG 2 H ARG 2 -5.312 -1.049 3.468
5 HA ARG 2 HA ARG 2 -4.342 -3.728 2.719
6 HB2 ARG 2 2HB ARG 2 -6.427 -3.013 1.534
7 HB3 ARG 2 1HB ARG 2 -5.541 -1.631 0.925
8 HG2 ARG 2 2HG ARG 2 -3.983 -3.213 -0.190
9 HG3 ARG 2 1HG ARG 2 -5.053 -4.524 0.322
10 HD2 ARG 2 2HD ARG 2 -5.733 -2.215 -1.482
11 HD3 ARG 2 1HD ARG 2 -5.638 -3.921 -1.916
12 HE ARG 2 HE ARG 2 -7.599 -3.098 0.100
13 HH11 ARG 2 1HH1 ARG 2 -6.984 -4.194 -3.223
14 HH12 ARG 2 2HH1 ARG 2 -8.601 -4.590 -3.530
15 HH21 ARG 2 1HH2 ARG 2 -9.785 -3.589 -0.334
16 HH22 ARG 2 2HH2 ARG 2 -10.247 -4.235 -1.852
17 H CYS 3 H CYS 3 -2.123 -3.519 2.475
18 HA CYS 3 HA CYS 3 -1.147 -0.885 1.621
19 HB2 CYS 3 2HB CYS 3 0.240 -2.837 3.475
20 HB3 CYS 3 1HB CYS 3 0.891 -1.297 2.933
21 H THR 4 H THR 4 0.402 -0.833 0.024
22 HA THR 4 HA THR 4 0.596 -3.120 -1.626
23 HB THR 4 HB THR 4 2.189 -1.706 -2.944
24 HG1 THR 4 1HG THR 4 3.183 -0.200 -1.922
25 HG21 THR 4 1HG2 THR 4 -0.305 -0.245 -2.059
26 HG22 THR 4 2HG2 THR 4 -0.242 -1.485 -3.307
27 HG23 THR 4 3HG2 THR 4 0.590 0.052 -3.551
28 H LYS 5 H LYS 5 2.388 -4.425 -1.978
29 HA LYS 5 HA LYS 5 4.175 -4.654 0.291
30 HB2 LYS 5 2HB LYS 5 4.942 -6.724 -0.796
31 HB3 LYS 5 1HB LYS 5 3.195 -6.703 -0.605
32 HG2 LYS 5 2HG LYS 5 2.996 -6.025 -2.986
33 HG3 LYS 5 1HG LYS 5 4.743 -6.207 -3.151
34 HD2 LYS 5 2HD LYS 5 2.781 -8.367 -2.377
35 HD3 LYS 5 1HD LYS 5 3.530 -8.171 -3.959
36 HE2 LYS 5 2HE LYS 5 5.721 -8.558 -2.994
37 HE3 LYS 5 1HE LYS 5 5.011 -8.682 -1.385
38 HZ1 LYS 5 1HZ LYS 5 4.413 -10.503 -3.645
39 HZ2 LYS 5 2HZ LYS 5 3.825 -10.647 -2.070
40 HZ3 LYS 5 3HZ LYS 5 5.463 -10.854 -2.378
41 H SER 6 H SER 6 4.103 -3.311 -2.797
42 HA SER 6 HA SER 6 6.934 -3.169 -3.211
43 HB2 SER 6 2HB SER 6 6.142 -1.725 -5.124
44 HB3 SER 6 1HB SER 6 5.501 -3.372 -5.121
45 HG SER 6 HG SER 6 4.169 -1.080 -4.093
46 H ILE 7 H ILE 7 8.168 -1.368 -2.743
47 HA ILE 7 HA ILE 7 6.983 0.569 -0.975
48 HB ILE 7 HB ILE 7 9.284 1.500 -0.772
49 HG12 ILE 7 2HG1 ILE 7 10.048 -0.768 -2.633
50 HG13 ILE 7 1HG1 ILE 7 10.093 0.942 -3.038
51 HG21 ILE 7 1HG2 ILE 7 8.543 -0.224 0.764
52 HG22 ILE 7 2HG2 ILE 7 10.259 -0.425 0.409
53 HG23 ILE 7 3HG2 ILE 7 9.071 -1.478 -0.359
54 HD11 ILE 7 1HD1 ILE 7 11.811 1.286 -1.343
55 HD12 ILE 7 2HD1 ILE 7 12.300 0.087 -2.546
56 HD13 ILE 7 3HD1 ILE 7 11.758 -0.433 -0.951
57 HA PRO 8 HA PRO 8 7.316 2.645 -0.294
58 HB2 PRO 8 2HB PRO 8 5.362 4.738 -0.697
59 HB3 PRO 8 1HB PRO 8 7.026 4.885 -0.142
60 HG2 PRO 8 2HG PRO 8 6.137 5.808 -2.567
61 HG3 PRO 8 1HG PRO 8 7.816 5.365 -2.225
62 HD2 PRO 8 2HD PRO 8 5.693 3.808 -3.634
63 HD3 PRO 8 1HD PRO 8 7.426 3.945 -4.000
64 HA PRO 9 HA PRO 9 3.600 0.221 0.305
65 HB2 PRO 9 2HB PRO 9 3.728 1.149 3.111
66 HB3 PRO 9 1HB PRO 9 3.760 -0.498 2.478
67 HG2 PRO 9 2HG PRO 9 5.967 0.620 3.469
68 HG3 PRO 9 1HG PRO 9 6.034 -0.424 2.039
69 HD2 PRO 9 2HD PRO 9 6.106 2.565 2.193
70 HD3 PRO 9 1HD PRO 9 7.072 1.449 1.202
71 H ARG 10 H ARG 10 1.947 1.181 -0.603
72 HA ARG 10 HA ARG 10 0.772 3.603 0.488
73 HB2 ARG 10 2HB ARG 10 1.018 3.395 -1.950
74 HB3 ARG 10 1HB ARG 10 0.105 1.908 -1.927
75 HG2 ARG 10 2HG ARG 10 -1.218 3.762 -2.802
76 HG3 ARG 10 1HG ARG 10 -1.913 3.130 -1.318
77 HD2 ARG 10 2HD ARG 10 -0.055 5.464 -1.201
78 HD3 ARG 10 1HD ARG 10 -1.726 5.713 -1.713
79 HE ARG 10 HE ARG 10 -2.201 4.486 0.507
80 HH11 ARG 10 1HH1 ARG 10 0.423 6.851 0.050
81 HH12 ARG 10 2HH1 ARG 10 0.345 7.419 1.638
82 HH21 ARG 10 1HH2 ARG 10 -2.293 5.296 2.664
83 HH22 ARG 10 2HH2 ARG 10 -1.235 6.530 3.164
84 H CYS 11 H CYS 11 -0.383 3.210 2.228
85 HA CYS 11 HA CYS 11 -1.988 0.815 2.353
86 HB2 CYS 11 2HB CYS 11 -1.370 2.921 4.433
87 HB3 CYS 11 1HB CYS 11 -2.390 1.511 4.705
88 H PHE 12 H PHE 12 -3.927 0.807 1.771
89 HA PHE 12 HA PHE 12 -5.375 3.264 1.244
90 HB2 PHE 12 2HB PHE 12 -6.102 0.375 0.663
91 HB3 PHE 12 1HB PHE 12 -6.958 1.791 0.080
92 HD1 PHE 12 1HD PHE 12 -4.062 -0.369 -0.376
93 HD2 PHE 12 2HD PHE 12 -5.976 3.206 -1.664
94 HE1 PHE 12 1HE PHE 12 -2.656 -0.349 -2.396
95 HE2 PHE 12 2HE PHE 12 -4.565 3.230 -3.681
96 HZ PHE 12 HZ PHE 12 -2.907 1.451 -4.046
97 HA PRO 13 HA PRO 13 -7.855 3.502 4.924
98 HB2 PRO 13 2HB PRO 13 -10.084 3.363 2.938
99 HB3 PRO 13 1HB PRO 13 -9.900 4.427 4.335
100 HG2 PRO 13 2HG PRO 13 -9.316 5.330 1.933
101 HG3 PRO 13 1HG PRO 13 -8.263 5.716 3.306
102 HD2 PRO 13 2HD PRO 13 -7.800 3.847 1.041
103 HD3 PRO 13 1HD PRO 13 -6.642 4.783 2.002
104 H ASP 14 H ASP 14 -8.706 0.929 2.660
105 HA ASP 14 HA ASP 14 -10.479 -0.356 4.523
106 HB2 ASP 14 2HB ASP 14 -10.670 -2.195 2.957
107 HB3 ASP 14 1HB ASP 14 -10.803 -0.677 2.094
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -7.681 -0.468 4.153
2 HA2 GLY 1 2HA GLY 1 -6.592 -2.042 5.461
3 HA3 GLY 1 1HA GLY 1 -7.812 -3.231 4.996
4 H ARG 2 H ARG 2 -5.159 -1.353 3.687
5 HA ARG 2 HA ARG 2 -4.108 -3.633 2.367
6 HB2 ARG 2 2HB ARG 2 -5.856 -3.231 0.819
7 HB3 ARG 2 1HB ARG 2 -5.536 -1.511 0.794
8 HG2 ARG 2 2HG ARG 2 -3.491 -1.884 -0.434
9 HG3 ARG 2 1HG ARG 2 -3.707 -3.633 -0.301
10 HD2 ARG 2 2HD ARG 2 -4.440 -2.581 -2.489
11 HD3 ARG 2 1HD ARG 2 -5.618 -3.612 -1.681
12 HE ARG 2 HE ARG 2 -6.679 -1.563 -0.845
13 HH11 ARG 2 1HH1 ARG 2 -4.611 -1.238 -3.717
14 HH12 ARG 2 2HH1 ARG 2 -5.414 0.122 -4.317
15 HH21 ARG 2 1HH2 ARG 2 -7.737 0.267 -1.605
16 HH22 ARG 2 2HH2 ARG 2 -7.328 1.013 -3.089
17 H CYS 3 H CYS 3 -2.041 -3.350 2.636
18 HA CYS 3 HA CYS 3 -0.892 -0.706 2.136
19 HB2 CYS 3 2HB CYS 3 0.091 -2.877 4.014
20 HB3 CYS 3 1HB CYS 3 0.985 -1.413 3.623
21 H THR 4 H THR 4 0.648 -0.667 0.579
22 HA THR 4 HA THR 4 0.798 -2.930 -1.087
23 HB THR 4 HB THR 4 2.481 -1.534 -2.354
24 HG1 THR 4 1HG THR 4 3.294 0.081 -1.393
25 HG21 THR 4 1HG2 THR 4 0.081 -1.436 -2.881
26 HG22 THR 4 2HG2 THR 4 0.830 0.150 -3.067
27 HG23 THR 4 3HG2 THR 4 -0.141 -0.204 -1.639
28 H LYS 5 H LYS 5 2.282 -4.458 -1.276
29 HA LYS 5 HA LYS 5 4.325 -4.741 0.744
30 HB2 LYS 5 2HB LYS 5 2.949 -6.668 -0.037
31 HB3 LYS 5 1HB LYS 5 3.616 -6.471 -1.644
32 HG2 LYS 5 2HG LYS 5 5.764 -7.188 -0.906
33 HG3 LYS 5 1HG LYS 5 5.253 -7.124 0.784
34 HD2 LYS 5 2HD LYS 5 3.656 -8.913 0.410
35 HD3 LYS 5 1HD LYS 5 4.056 -8.944 -1.306
36 HE2 LYS 5 2HE LYS 5 6.014 -9.517 0.915
37 HE3 LYS 5 1HE LYS 5 5.128 -10.755 0.027
38 HZ1 LYS 5 1HZ LYS 5 6.186 -10.029 -1.996
39 HZ2 LYS 5 2HZ LYS 5 7.377 -10.389 -0.851
40 HZ3 LYS 5 3HZ LYS 5 6.994 -8.798 -1.194
41 H SER 6 H SER 6 3.950 -3.680 -2.468
42 HA SER 6 HA SER 6 6.759 -3.618 -3.102
43 HB2 SER 6 2HB SER 6 5.844 -2.447 -5.142
44 HB3 SER 6 1HB SER 6 5.211 -4.075 -4.891
45 HG SER 6 HG SER 6 3.949 -1.593 -4.620
46 H ILE 7 H ILE 7 7.898 -1.573 -3.339
47 HA ILE 7 HA ILE 7 6.700 0.509 -1.704
48 HB ILE 7 HB ILE 7 8.968 1.565 -1.641
49 HG12 ILE 7 2HG1 ILE 7 9.902 -0.963 -3.019
50 HG13 ILE 7 1HG1 ILE 7 9.838 0.624 -3.782
51 HG21 ILE 7 1HG2 ILE 7 8.290 0.108 0.156
52 HG22 ILE 7 2HG2 ILE 7 10.016 -0.088 -0.152
53 HG23 ILE 7 3HG2 ILE 7 8.873 -1.301 -0.728
54 HD11 ILE 7 1HD1 ILE 7 11.557 -0.167 -1.434
55 HD12 ILE 7 2HD1 ILE 7 11.506 1.433 -2.176
56 HD13 ILE 7 3HD1 ILE 7 12.099 0.052 -3.099
57 HA PRO 8 HA PRO 8 7.306 3.089 -1.564
58 HB2 PRO 8 2HB PRO 8 5.170 4.758 -1.775
59 HB3 PRO 8 1HB PRO 8 6.749 5.116 -2.481
60 HG2 PRO 8 2HG PRO 8 4.319 3.955 -3.791
61 HG3 PRO 8 1HG PRO 8 5.384 5.253 -4.364
62 HD2 PRO 8 2HD PRO 8 5.609 2.749 -5.277
63 HD3 PRO 8 1HD PRO 8 7.037 3.774 -5.024
64 HA PRO 9 HA PRO 9 4.133 0.662 0.556
65 HB2 PRO 9 2HB PRO 9 4.786 2.031 3.017
66 HB3 PRO 9 1HB PRO 9 5.169 0.373 2.563
67 HG2 PRO 9 2HG PRO 9 7.038 2.352 2.852
68 HG3 PRO 9 1HG PRO 9 7.243 0.924 1.827
69 HD2 PRO 9 2HD PRO 9 6.553 3.724 1.068
70 HD3 PRO 9 1HD PRO 9 7.562 2.519 0.236
71 H ARG 10 H ARG 10 2.128 1.319 0.175
72 HA ARG 10 HA ARG 10 1.243 3.833 1.417
73 HB2 ARG 10 2HB ARG 10 0.241 2.575 -1.140
74 HB3 ARG 10 1HB ARG 10 -0.347 4.069 -0.428
75 HG2 ARG 10 2HG ARG 10 1.854 5.091 -0.760
76 HG3 ARG 10 1HG ARG 10 2.431 3.593 -1.489
77 HD2 ARG 10 2HD ARG 10 1.831 5.187 -3.210
78 HD3 ARG 10 1HD ARG 10 0.726 3.812 -3.231
79 HE ARG 10 HE ARG 10 -0.462 5.656 -1.611
80 HH11 ARG 10 1HH1 ARG 10 0.573 5.600 -4.966
81 HH12 ARG 10 2HH1 ARG 10 -0.579 6.732 -5.498
82 HH21 ARG 10 1HH2 ARG 10 -2.003 7.160 -2.280
83 HH22 ARG 10 2HH2 ARG 10 -2.127 7.647 -3.919
84 H CYS 11 H CYS 11 -0.559 3.688 2.660
85 HA CYS 11 HA CYS 11 -1.877 1.084 2.753
86 HB2 CYS 11 2HB CYS 11 -1.269 2.963 5.038
87 HB3 CYS 11 1HB CYS 11 -2.339 1.571 5.165
88 H PHE 12 H PHE 12 -3.933 1.063 2.490
89 HA PHE 12 HA PHE 12 -5.316 3.636 2.239
90 HB2 PHE 12 2HB PHE 12 -5.903 1.000 0.873
91 HB3 PHE 12 1HB PHE 12 -6.713 2.530 0.567
92 HD1 PHE 12 1HD PHE 12 -3.990 0.409 -0.322
93 HD2 PHE 12 2HD PHE 12 -5.289 4.458 -0.347
94 HE1 PHE 12 1HE PHE 12 -2.317 0.935 -2.045
95 HE2 PHE 12 2HE PHE 12 -3.630 4.982 -2.076
96 HZ PHE 12 HZ PHE 12 -2.142 3.227 -2.926
97 HA PRO 13 HA PRO 13 -8.037 2.582 5.562
98 HB2 PRO 13 2HB PRO 13 -10.451 3.501 4.641
99 HB3 PRO 13 1HB PRO 13 -9.176 4.546 5.271
100 HG2 PRO 13 2HG PRO 13 -9.842 3.877 2.431
101 HG3 PRO 13 1HG PRO 13 -9.442 5.451 3.143
102 HD2 PRO 13 2HD PRO 13 -7.625 4.064 1.765
103 HD3 PRO 13 1HD PRO 13 -7.169 4.977 3.216
104 H ASP 14 H ASP 14 -8.589 1.210 2.482
105 HA ASP 14 HA ASP 14 -10.773 -0.479 3.312
106 HB2 ASP 14 2HB ASP 14 -10.582 -1.577 1.106
107 HB3 ASP 14 1HB ASP 14 -10.676 0.165 0.946
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -7.255 -0.386 4.335
2 HA2 GLY 1 2HA GLY 1 -5.948 -1.515 6.031
3 HA3 GLY 1 1HA GLY 1 -7.093 -2.836 5.940
4 H ARG 2 H ARG 2 -5.419 -1.112 3.308
5 HA ARG 2 HA ARG 2 -4.078 -3.662 2.664
6 HB2 ARG 2 2HB ARG 2 -5.296 -1.835 0.587
7 HB3 ARG 2 1HB ARG 2 -4.445 -3.338 0.291
8 HG2 ARG 2 2HG ARG 2 -6.216 -4.524 1.510
9 HG3 ARG 2 1HG ARG 2 -7.088 -2.999 1.657
10 HD2 ARG 2 2HD ARG 2 -7.048 -2.824 -0.834
11 HD3 ARG 2 1HD ARG 2 -6.364 -4.453 -0.870
12 HE ARG 2 HE ARG 2 -8.870 -3.898 0.490
13 HH11 ARG 2 1HH1 ARG 2 -7.165 -5.570 -2.126
14 HH12 ARG 2 2HH1 ARG 2 -8.434 -6.634 -2.496
15 HH21 ARG 2 1HH2 ARG 2 -10.635 -5.387 -0.002
16 HH22 ARG 2 2HH2 ARG 2 -10.472 -6.532 -1.248
17 H CYS 3 H CYS 3 -1.968 -3.293 2.774
18 HA CYS 3 HA CYS 3 -1.004 -0.706 1.801
19 HB2 CYS 3 2HB CYS 3 0.319 -2.658 3.706
20 HB3 CYS 3 1HB CYS 3 1.034 -1.153 3.135
21 H THR 4 H THR 4 0.574 -0.670 0.250
22 HA THR 4 HA THR 4 0.592 -2.882 -1.480
23 HB THR 4 HB THR 4 2.285 -1.548 -2.762
24 HG1 THR 4 1HG THR 4 3.361 -0.327 -1.408
25 HG21 THR 4 1HG2 THR 4 0.744 0.285 -3.343
26 HG22 THR 4 2HG2 THR 4 -0.185 -0.040 -1.881
27 HG23 THR 4 3HG2 THR 4 -0.118 -1.244 -3.169
28 H LYS 5 H LYS 5 2.094 -4.371 -1.897
29 HA LYS 5 HA LYS 5 3.995 -5.040 0.117
30 HB2 LYS 5 2HB LYS 5 3.660 -6.148 -2.678
31 HB3 LYS 5 1HB LYS 5 4.590 -6.885 -1.387
32 HG2 LYS 5 2HG LYS 5 1.600 -6.499 -1.454
33 HG3 LYS 5 1HG LYS 5 2.471 -8.020 -1.654
34 HD2 LYS 5 2HD LYS 5 3.331 -7.808 0.646
35 HD3 LYS 5 1HD LYS 5 2.430 -6.304 0.831
36 HE2 LYS 5 2HE LYS 5 0.337 -7.537 0.411
37 HE3 LYS 5 1HE LYS 5 1.277 -9.025 0.292
38 HZ1 LYS 5 1HZ LYS 5 1.980 -8.720 2.572
39 HZ2 LYS 5 2HZ LYS 5 0.307 -8.782 2.472
40 HZ3 LYS 5 3HZ LYS 5 1.077 -7.306 2.694
41 H SER 6 H SER 6 3.971 -3.410 -2.922
42 HA SER 6 HA SER 6 6.800 -3.286 -3.256
43 HB2 SER 6 2HB SER 6 6.096 -1.725 -5.089
44 HB3 SER 6 1HB SER 6 5.383 -3.338 -5.193
45 HG SER 6 HG SER 6 3.936 -1.495 -5.487
46 H ILE 7 H ILE 7 8.040 -1.409 -2.977
47 HA ILE 7 HA ILE 7 6.966 0.496 -1.082
48 HB ILE 7 HB ILE 7 9.277 1.415 -0.985
49 HG12 ILE 7 2HG1 ILE 7 9.974 -0.843 -2.890
50 HG13 ILE 7 1HG1 ILE 7 9.951 0.858 -3.307
51 HG21 ILE 7 1HG2 ILE 7 8.632 -0.304 0.579
52 HG22 ILE 7 2HG2 ILE 7 10.320 -0.529 0.115
53 HG23 ILE 7 3HG2 ILE 7 9.070 -1.559 -0.579
54 HD11 ILE 7 1HD1 ILE 7 11.776 -0.443 -1.299
55 HD12 ILE 7 2HD1 ILE 7 11.770 1.265 -1.734
56 HD13 ILE 7 3HD1 ILE 7 12.215 0.051 -2.935
57 HA PRO 8 HA PRO 8 7.450 2.657 -0.453
58 HB2 PRO 8 2HB PRO 8 5.675 4.695 -0.330
59 HB3 PRO 8 1HB PRO 8 7.354 4.929 -0.832
60 HG2 PRO 8 2HG PRO 8 4.889 4.692 -2.507
61 HG3 PRO 8 1HG PRO 8 6.263 5.793 -2.690
62 HD2 PRO 8 2HD PRO 8 5.960 3.521 -4.164
63 HD3 PRO 8 1HD PRO 8 7.539 4.221 -3.766
64 HA PRO 9 HA PRO 9 3.764 0.274 0.464
65 HB2 PRO 9 2HB PRO 9 4.105 1.023 3.281
66 HB3 PRO 9 1HB PRO 9 4.215 -0.573 2.540
67 HG2 PRO 9 2HG PRO 9 6.383 0.711 3.477
68 HG3 PRO 9 1HG PRO 9 6.456 -0.344 2.054
69 HD2 PRO 9 2HD PRO 9 6.340 2.650 2.187
70 HD3 PRO 9 1HD PRO 9 7.325 1.590 1.149
71 H ARG 10 H ARG 10 2.199 1.467 -0.376
72 HA ARG 10 HA ARG 10 1.148 3.776 1.074
73 HB2 ARG 10 2HB ARG 10 0.599 2.666 -1.685
74 HB3 ARG 10 1HB ARG 10 -0.216 4.070 -1.002
75 HG2 ARG 10 2HG ARG 10 1.814 5.321 -0.942
76 HG3 ARG 10 1HG ARG 10 2.767 3.894 -1.349
77 HD2 ARG 10 2HD ARG 10 0.670 5.095 -3.137
78 HD3 ARG 10 1HD ARG 10 2.391 5.471 -3.252
79 HE ARG 10 HE ARG 10 2.559 2.907 -3.503
80 HH11 ARG 10 1HH1 ARG 10 0.002 4.932 -4.914
81 HH12 ARG 10 2HH1 ARG 10 -0.240 3.887 -6.234
82 HH21 ARG 10 1HH2 ARG 10 2.256 1.567 -5.346
83 HH22 ARG 10 2HH2 ARG 10 1.058 1.970 -6.509
84 H CYS 11 H CYS 11 -0.851 3.677 2.043
85 HA CYS 11 HA CYS 11 -2.024 1.015 1.993
86 HB2 CYS 11 2HB CYS 11 -1.900 2.929 4.316
87 HB3 CYS 11 1HB CYS 11 -2.636 1.331 4.312
88 H PHE 12 H PHE 12 -4.007 0.790 1.638
89 HA PHE 12 HA PHE 12 -5.702 3.044 0.980
90 HB2 PHE 12 2HB PHE 12 -6.142 0.047 0.738
91 HB3 PHE 12 1HB PHE 12 -7.215 1.286 0.108
92 HD1 PHE 12 1HD PHE 12 -3.862 -0.255 -0.280
93 HD2 PHE 12 2HD PHE 12 -6.790 2.331 -1.981
94 HE1 PHE 12 1HE PHE 12 -2.620 -0.254 -2.403
95 HE2 PHE 12 2HE PHE 12 -5.549 2.334 -4.102
96 HZ PHE 12 HZ PHE 12 -3.463 1.043 -4.317
97 HA PRO 13 HA PRO 13 -7.566 3.175 4.961
98 HB2 PRO 13 2HB PRO 13 -10.078 3.990 4.338
99 HB3 PRO 13 1HB PRO 13 -8.661 5.047 4.288
100 HG2 PRO 13 2HG PRO 13 -9.982 3.549 2.053
101 HG3 PRO 13 1HG PRO 13 -9.459 5.243 2.091
102 HD2 PRO 13 2HD PRO 13 -7.959 3.392 0.907
103 HD3 PRO 13 1HD PRO 13 -7.206 4.676 1.879
104 H ASP 14 H ASP 14 -8.455 0.668 2.943
105 HA ASP 14 HA ASP 14 -10.500 -0.265 4.825
106 HB2 ASP 14 2HB ASP 14 -11.132 -1.907 3.203
107 HB3 ASP 14 1HB ASP 14 -10.968 -0.378 2.354
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -7.454 -0.193 4.242
2 HA2 GLY 1 2HA GLY 1 -6.278 -1.020 6.100
3 HA3 GLY 1 1HA GLY 1 -7.471 -2.308 6.247
4 H ARG 2 H ARG 2 -5.226 -1.091 3.783
5 HA ARG 2 HA ARG 2 -3.911 -3.644 3.757
6 HB2 ARG 2 2HB ARG 2 -4.157 -4.078 1.391
7 HB3 ARG 2 1HB ARG 2 -5.754 -3.992 2.109
8 HG2 ARG 2 2HG ARG 2 -6.042 -1.743 1.205
9 HG3 ARG 2 1HG ARG 2 -4.409 -1.802 0.536
10 HD2 ARG 2 2HD ARG 2 -5.994 -2.300 -1.216
11 HD3 ARG 2 1HD ARG 2 -5.088 -3.761 -0.816
12 HE ARG 2 HE ARG 2 -7.653 -3.294 0.463
13 HH11 ARG 2 1HH1 ARG 2 -5.746 -5.214 -1.836
14 HH12 ARG 2 2HH1 ARG 2 -6.942 -6.394 -2.079
15 HH21 ARG 2 1HH2 ARG 2 -9.300 -4.915 0.108
16 HH22 ARG 2 2HH2 ARG 2 -9.004 -6.231 -0.937
17 H CYS 3 H CYS 3 -1.836 -3.489 2.911
18 HA CYS 3 HA CYS 3 -1.064 -0.904 1.780
19 HB2 CYS 3 2HB CYS 3 0.550 -2.540 3.765
20 HB3 CYS 3 1HB CYS 3 1.085 -1.055 2.990
21 H THR 4 H THR 4 0.091 -1.090 -0.065
22 HA THR 4 HA THR 4 0.277 -3.656 -1.258
23 HB THR 4 HB THR 4 1.326 -2.422 -3.143
24 HG1 THR 4 1HG THR 4 2.355 -0.745 -2.540
25 HG21 THR 4 1HG2 THR 4 -1.121 -2.555 -3.007
26 HG22 THR 4 2HG2 THR 4 -0.622 -1.003 -3.683
27 HG23 THR 4 3HG2 THR 4 -1.146 -1.107 -2.002
28 H LYS 5 H LYS 5 2.119 -4.836 -1.758
29 HA LYS 5 HA LYS 5 4.400 -4.213 -0.130
30 HB2 LYS 5 2HB LYS 5 3.815 -6.624 -1.860
31 HB3 LYS 5 1HB LYS 5 5.242 -6.425 -0.849
32 HG2 LYS 5 2HG LYS 5 3.817 -6.283 1.128
33 HG3 LYS 5 1HG LYS 5 2.401 -6.527 0.108
34 HD2 LYS 5 2HD LYS 5 3.195 -8.713 -0.532
35 HD3 LYS 5 1HD LYS 5 4.687 -8.468 0.382
36 HE2 LYS 5 2HE LYS 5 1.898 -8.550 1.520
37 HE3 LYS 5 1HE LYS 5 3.086 -9.846 1.620
38 HZ1 LYS 5 1HZ LYS 5 3.088 -8.592 3.666
39 HZ2 LYS 5 2HZ LYS 5 3.292 -7.145 2.843
40 HZ3 LYS 5 3HZ LYS 5 4.537 -8.254 2.866
41 H SER 6 H SER 6 4.904 -2.398 -1.194
42 HA SER 6 HA SER 6 6.651 -2.754 -3.455
43 HB2 SER 6 2HB SER 6 5.539 -0.769 -4.539
44 HB3 SER 6 1HB SER 6 4.551 -2.231 -4.534
45 HG SER 6 HG SER 6 4.177 0.180 -3.259
46 H ILE 7 H ILE 7 7.805 -0.530 -3.711
47 HA ILE 7 HA ILE 7 7.872 0.820 -1.125
48 HB ILE 7 HB ILE 7 10.138 0.475 -3.124
49 HG12 ILE 7 2HG1 ILE 7 9.746 -1.521 -1.741
50 HG13 ILE 7 1HG1 ILE 7 11.287 -0.771 -1.340
51 HG21 ILE 7 1HG2 ILE 7 10.152 2.022 -0.532
52 HG22 ILE 7 2HG2 ILE 7 10.257 2.700 -2.157
53 HG23 ILE 7 3HG2 ILE 7 11.567 1.694 -1.535
54 HD11 ILE 7 1HD1 ILE 7 8.725 -0.585 0.243
55 HD12 ILE 7 2HD1 ILE 7 10.234 0.229 0.651
56 HD13 ILE 7 3HD1 ILE 7 10.154 -1.532 0.657
57 HA PRO 8 HA PRO 8 7.509 2.487 -0.203
58 HB2 PRO 8 2HB PRO 8 5.667 4.363 0.280
59 HB3 PRO 8 1HB PRO 8 7.341 4.787 -0.108
60 HG2 PRO 8 2HG PRO 8 4.942 4.764 -1.901
61 HG3 PRO 8 1HG PRO 8 6.196 6.007 -1.735
62 HD2 PRO 8 2HD PRO 8 6.188 4.130 -3.718
63 HD3 PRO 8 1HD PRO 8 7.668 4.868 -3.078
64 HA PRO 9 HA PRO 9 3.801 -0.062 0.021
65 HB2 PRO 9 2HB PRO 9 3.546 0.598 2.873
66 HB3 PRO 9 1HB PRO 9 3.917 -0.957 2.127
67 HG2 PRO 9 2HG PRO 9 5.764 0.437 3.504
68 HG3 PRO 9 1HG PRO 9 6.188 -0.550 2.093
69 HD2 PRO 9 2HD PRO 9 5.814 2.417 2.286
70 HD3 PRO 9 1HD PRO 9 7.062 1.479 1.433
71 H ARG 10 H ARG 10 1.998 0.720 -0.828
72 HA ARG 10 HA ARG 10 0.899 3.256 0.029
73 HB2 ARG 10 2HB ARG 10 0.090 1.316 -2.139
74 HB3 ARG 10 1HB ARG 10 -0.610 2.909 -1.893
75 HG2 ARG 10 2HG ARG 10 1.400 3.995 -2.515
76 HG3 ARG 10 1HG ARG 10 2.317 2.493 -2.416
77 HD2 ARG 10 2HD ARG 10 1.875 3.120 -4.734
78 HD3 ARG 10 1HD ARG 10 1.096 1.602 -4.301
79 HE ARG 10 HE ARG 10 -0.507 4.003 -4.116
80 HH11 ARG 10 1HH1 ARG 10 0.365 1.134 -5.999
81 HH12 ARG 10 2HH1 ARG 10 -0.984 1.223 -7.032
82 HH21 ARG 10 1HH2 ARG 10 -2.393 4.124 -5.558
83 HH22 ARG 10 2HH2 ARG 10 -2.598 2.944 -6.756
84 H CYS 11 H CYS 11 -0.341 3.165 1.776
85 HA CYS 11 HA CYS 11 -1.964 0.812 2.272
86 HB2 CYS 11 2HB CYS 11 -1.350 3.189 4.034
87 HB3 CYS 11 1HB CYS 11 -2.260 1.760 4.516
88 H PHE 12 H PHE 12 -4.075 0.809 2.170
89 HA PHE 12 HA PHE 12 -5.414 3.308 1.407
90 HB2 PHE 12 2HB PHE 12 -6.065 0.466 0.581
91 HB3 PHE 12 1HB PHE 12 -7.031 1.874 0.160
92 HD1 PHE 12 1HD PHE 12 -4.175 -0.138 -0.686
93 HD2 PHE 12 2HD PHE 12 -5.988 3.665 -1.278
94 HE1 PHE 12 1HE PHE 12 -2.778 0.216 -2.672
95 HE2 PHE 12 2HE PHE 12 -4.587 4.019 -3.266
96 HZ PHE 12 HZ PHE 12 -2.983 2.292 -3.965
97 HA PRO 13 HA PRO 13 -7.923 3.411 4.998
98 HB2 PRO 13 2HB PRO 13 -10.439 3.695 3.794
99 HB3 PRO 13 1HB PRO 13 -9.354 4.993 4.285
100 HG2 PRO 13 2HG PRO 13 -9.744 3.758 1.603
101 HG3 PRO 13 1HG PRO 13 -9.375 5.436 2.026
102 HD2 PRO 13 2HD PRO 13 -7.501 3.849 1.020
103 HD3 PRO 13 1HD PRO 13 -7.110 4.992 2.323
104 H ASP 14 H ASP 14 -8.819 1.031 2.607
105 HA ASP 14 HA ASP 14 -10.793 -0.246 4.263
106 HB2 ASP 14 2HB ASP 14 -10.771 -2.086 2.635
107 HB3 ASP 14 1HB ASP 14 -10.907 -0.535 1.825
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -7.358 -0.270 4.478
2 HA2 GLY 1 2HA GLY 1 -5.987 -1.437 5.936
3 HA3 GLY 1 1HA GLY 1 -7.062 -2.825 5.795
4 H ARG 2 H ARG 2 -5.553 -1.062 3.210
5 HA ARG 2 HA ARG 2 -4.210 -3.565 2.379
6 HB2 ARG 2 2HB ARG 2 -6.114 -2.629 1.000
7 HB3 ARG 2 1HB ARG 2 -5.063 -1.273 0.650
8 HG2 ARG 2 2HG ARG 2 -3.406 -3.032 -0.196
9 HG3 ARG 2 1HG ARG 2 -4.790 -4.125 -0.200
10 HD2 ARG 2 2HD ARG 2 -4.271 -1.697 -1.859
11 HD3 ARG 2 1HD ARG 2 -4.873 -3.276 -2.352
12 HE ARG 2 HE ARG 2 -6.778 -2.048 -0.682
13 HH11 ARG 2 1HH1 ARG 2 -5.568 -1.902 -4.025
14 HH12 ARG 2 2HH1 ARG 2 -6.818 -0.874 -4.540
15 HH21 ARG 2 1HH2 ARG 2 -8.403 -0.630 -1.398
16 HH22 ARG 2 2HH2 ARG 2 -8.504 -0.173 -3.055
17 H CYS 3 H CYS 3 -2.045 -3.273 2.814
18 HA CYS 3 HA CYS 3 -0.916 -0.693 2.028
19 HB2 CYS 3 2HB CYS 3 0.153 -2.718 4.016
20 HB3 CYS 3 1HB CYS 3 0.971 -1.233 3.541
21 H THR 4 H THR 4 0.557 -0.727 0.435
22 HA THR 4 HA THR 4 0.653 -3.035 -1.163
23 HB THR 4 HB THR 4 2.223 -1.661 -2.578
24 HG1 THR 4 1HG THR 4 3.205 -0.185 -1.549
25 HG21 THR 4 1HG2 THR 4 -0.213 -1.572 -2.917
26 HG22 THR 4 2HG2 THR 4 0.526 0.003 -3.209
27 HG23 THR 4 3HG2 THR 4 -0.324 -0.307 -1.693
28 H LYS 5 H LYS 5 2.143 -4.556 -1.427
29 HA LYS 5 HA LYS 5 4.352 -4.713 0.383
30 HB2 LYS 5 2HB LYS 5 4.887 -6.836 -0.794
31 HB3 LYS 5 1HB LYS 5 3.222 -6.777 -0.247
32 HG2 LYS 5 2HG LYS 5 2.520 -6.215 -2.551
33 HG3 LYS 5 1HG LYS 5 4.201 -6.355 -3.064
34 HD2 LYS 5 2HD LYS 5 4.235 -8.693 -2.346
35 HD3 LYS 5 1HD LYS 5 2.566 -8.551 -1.800
36 HE2 LYS 5 2HE LYS 5 2.663 -9.646 -3.967
37 HE3 LYS 5 1HE LYS 5 1.854 -8.089 -4.100
38 HZ1 LYS 5 1HZ LYS 5 3.926 -7.156 -5.011
39 HZ2 LYS 5 2HZ LYS 5 3.428 -8.502 -5.909
40 HZ3 LYS 5 3HZ LYS 5 4.674 -8.654 -4.844
41 H SER 6 H SER 6 3.751 -3.561 -2.767
42 HA SER 6 HA SER 6 6.484 -3.317 -3.539
43 HB2 SER 6 2HB SER 6 5.494 -1.859 -5.360
44 HB3 SER 6 1HB SER 6 4.853 -3.499 -5.312
45 HG SER 6 HG SER 6 3.642 -1.087 -4.455
46 H ILE 7 H ILE 7 7.720 -1.511 -3.396
47 HA ILE 7 HA ILE 7 6.885 0.354 -1.340
48 HB ILE 7 HB ILE 7 9.272 1.068 -1.335
49 HG12 ILE 7 2HG1 ILE 7 9.662 -1.197 -3.319
50 HG13 ILE 7 1HG1 ILE 7 9.748 0.512 -3.726
51 HG21 ILE 7 1HG2 ILE 7 10.164 -1.012 -0.349
52 HG22 ILE 7 2HG2 ILE 7 8.785 -1.891 -1.009
53 HG23 ILE 7 3HG2 ILE 7 8.531 -0.640 0.206
54 HD11 ILE 7 1HD1 ILE 7 11.683 0.744 -2.248
55 HD12 ILE 7 2HD1 ILE 7 11.950 -0.466 -3.503
56 HD13 ILE 7 3HD1 ILE 7 11.574 -0.971 -1.855
57 HA PRO 8 HA PRO 8 7.565 2.391 -0.641
58 HB2 PRO 8 2HB PRO 8 5.774 4.693 -0.848
59 HB3 PRO 8 1HB PRO 8 7.465 4.653 -0.343
60 HG2 PRO 8 2HG PRO 8 6.688 5.776 -2.678
61 HG3 PRO 8 1HG PRO 8 8.254 4.976 -2.484
62 HD2 PRO 8 2HD PRO 8 5.725 3.901 -3.691
63 HD3 PRO 8 1HD PRO 8 7.392 3.795 -4.298
64 HA PRO 9 HA PRO 9 3.756 0.429 0.492
65 HB2 PRO 9 2HB PRO 9 3.993 1.446 3.226
66 HB3 PRO 9 1HB PRO 9 4.133 -0.213 2.639
67 HG2 PRO 9 2HG PRO 9 6.264 1.165 3.540
68 HG3 PRO 9 1HG PRO 9 6.391 -0.016 2.225
69 HD2 PRO 9 2HD PRO 9 6.243 2.970 2.075
70 HD3 PRO 9 1HD PRO 9 7.294 1.839 1.192
71 H ARG 10 H ARG 10 1.985 1.264 -0.244
72 HA ARG 10 HA ARG 10 0.898 3.729 0.886
73 HB2 ARG 10 2HB ARG 10 0.349 2.175 -1.627
74 HB3 ARG 10 1HB ARG 10 -0.808 3.348 -1.018
75 HG2 ARG 10 2HG ARG 10 2.060 4.000 -1.619
76 HG3 ARG 10 1HG ARG 10 0.740 4.202 -2.777
77 HD2 ARG 10 2HD ARG 10 -0.399 5.709 -1.236
78 HD3 ARG 10 1HD ARG 10 0.871 5.481 -0.047
79 HE ARG 10 HE ARG 10 2.373 6.544 -1.560
80 HH11 ARG 10 1HH1 ARG 10 -1.064 6.967 -2.343
81 HH12 ARG 10 2HH1 ARG 10 -0.868 8.501 -3.021
82 HH21 ARG 10 1HH2 ARG 10 2.643 8.689 -2.481
83 HH22 ARG 10 2HH2 ARG 10 1.300 9.516 -3.101
84 H CYS 11 H CYS 11 -0.570 3.544 2.430
85 HA CYS 11 HA CYS 11 -2.008 1.034 2.580
86 HB2 CYS 11 2HB CYS 11 -1.491 3.103 4.729
87 HB3 CYS 11 1HB CYS 11 -2.492 1.673 4.935
88 H PHE 12 H PHE 12 -3.933 1.005 2.017
89 HA PHE 12 HA PHE 12 -5.422 3.464 1.514
90 HB2 PHE 12 2HB PHE 12 -5.987 0.591 0.717
91 HB3 PHE 12 1HB PHE 12 -6.893 1.997 0.189
92 HD1 PHE 12 1HD PHE 12 -3.712 0.175 -0.135
93 HD2 PHE 12 2HD PHE 12 -6.069 3.421 -1.550
94 HE1 PHE 12 1HE PHE 12 -2.227 0.404 -2.071
95 HE2 PHE 12 2HE PHE 12 -4.583 3.655 -3.476
96 HZ PHE 12 HZ PHE 12 -2.653 2.143 -3.739
97 HA PRO 13 HA PRO 13 -7.981 2.959 5.099
98 HB2 PRO 13 2HB PRO 13 -10.453 3.651 4.115
99 HB3 PRO 13 1HB PRO 13 -9.186 4.804 4.542
100 HG2 PRO 13 2HG PRO 13 -9.890 3.682 1.863
101 HG3 PRO 13 1HG PRO 13 -9.518 5.360 2.305
102 HD2 PRO 13 2HD PRO 13 -7.701 3.820 1.117
103 HD3 PRO 13 1HD PRO 13 -7.236 4.943 2.413
104 H ASP 14 H ASP 14 -8.292 0.786 2.591
105 HA ASP 14 HA ASP 14 -10.415 -0.718 3.925
106 HB2 ASP 14 2HB ASP 14 -10.348 -2.244 1.960
107 HB3 ASP 14 1HB ASP 14 -10.682 -0.583 1.502
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -7.360 -0.423 4.409
2 HA2 GLY 1 2HA GLY 1 -6.154 -1.914 5.761
3 HA3 GLY 1 1HA GLY 1 -7.433 -3.110 5.548
4 H ARG 2 H ARG 2 -5.281 -1.257 3.508
5 HA ARG 2 HA ARG 2 -4.381 -3.668 2.173
6 HB2 ARG 2 2HB ARG 2 -6.352 -3.163 0.936
7 HB3 ARG 2 1HB ARG 2 -5.969 -1.456 0.918
8 HG2 ARG 2 2HG ARG 2 -4.177 -1.853 -0.663
9 HG3 ARG 2 1HG ARG 2 -4.462 -3.593 -0.578
10 HD2 ARG 2 2HD ARG 2 -5.515 -2.369 -2.557
11 HD3 ARG 2 1HD ARG 2 -6.575 -3.415 -1.613
12 HE ARG 2 HE ARG 2 -7.137 -1.174 -0.417
13 HH11 ARG 2 1HH1 ARG 2 -6.700 -1.544 -3.912
14 HH12 ARG 2 2HH1 ARG 2 -7.722 -0.229 -4.278
15 HH21 ARG 2 1HH2 ARG 2 -8.437 0.478 -0.885
16 HH22 ARG 2 2HH2 ARG 2 -8.767 1.006 -2.492
17 H CYS 3 H CYS 3 -2.254 -3.424 2.242
18 HA CYS 3 HA CYS 3 -1.101 -0.799 1.625
19 HB2 CYS 3 2HB CYS 3 -0.111 -2.871 3.587
20 HB3 CYS 3 1HB CYS 3 0.811 -1.465 3.076
21 H THR 4 H THR 4 0.369 -0.816 0.028
22 HA THR 4 HA THR 4 0.761 -3.176 -1.454
23 HB THR 4 HB THR 4 2.393 -1.778 -2.744
24 HG1 THR 4 1HG THR 4 3.221 -0.192 -1.683
25 HG21 THR 4 1HG2 THR 4 -0.275 -0.473 -2.176
26 HG22 THR 4 2HG2 THR 4 0.019 -1.766 -3.340
27 HG23 THR 4 3HG2 THR 4 0.730 -0.173 -3.594
28 H LYS 5 H LYS 5 2.386 -4.622 -1.343
29 HA LYS 5 HA LYS 5 4.312 -4.320 0.788
30 HB2 LYS 5 2HB LYS 5 3.996 -6.570 -1.227
31 HB3 LYS 5 1HB LYS 5 5.022 -6.609 0.200
32 HG2 LYS 5 2HG LYS 5 2.010 -6.426 0.186
33 HG3 LYS 5 1HG LYS 5 2.968 -7.854 0.577
34 HD2 LYS 5 2HD LYS 5 3.895 -6.741 2.530
35 HD3 LYS 5 1HD LYS 5 3.068 -5.246 2.106
36 HE2 LYS 5 2HE LYS 5 1.874 -6.391 3.879
37 HE3 LYS 5 1HE LYS 5 0.907 -6.360 2.412
38 HZ1 LYS 5 1HZ LYS 5 2.500 -8.674 3.367
39 HZ2 LYS 5 2HZ LYS 5 1.513 -8.657 1.991
40 HZ3 LYS 5 3HZ LYS 5 0.842 -8.492 3.519
41 H SER 6 H SER 6 4.043 -3.590 -2.455
42 HA SER 6 HA SER 6 6.830 -3.410 -3.014
43 HB2 SER 6 2HB SER 6 5.837 -2.102 -5.004
44 HB3 SER 6 1HB SER 6 5.460 -3.821 -4.899
45 HG SER 6 HG SER 6 3.480 -3.245 -4.919
46 H ILE 7 H ILE 7 8.013 -1.512 -2.968
47 HA ILE 7 HA ILE 7 7.028 0.543 -1.165
48 HB ILE 7 HB ILE 7 9.771 0.182 -2.458
49 HG12 ILE 7 2HG1 ILE 7 9.243 -1.757 -1.080
50 HG13 ILE 7 1HG1 ILE 7 10.499 -0.789 -0.318
51 HG21 ILE 7 1HG2 ILE 7 10.638 1.647 -0.728
52 HG22 ILE 7 2HG2 ILE 7 9.036 1.810 -0.033
53 HG23 ILE 7 3HG2 ILE 7 9.366 2.470 -1.638
54 HD11 ILE 7 1HD1 ILE 7 8.820 0.148 1.209
55 HD12 ILE 7 2HD1 ILE 7 8.920 -1.608 1.323
56 HD13 ILE 7 3HD1 ILE 7 7.582 -0.856 0.454
57 HA PRO 8 HA PRO 8 7.389 2.866 -0.775
58 HB2 PRO 8 2HB PRO 8 5.542 4.828 -0.893
59 HB3 PRO 8 1HB PRO 8 7.202 5.068 -1.446
60 HG2 PRO 8 2HG PRO 8 4.745 4.465 -3.041
61 HG3 PRO 8 1HG PRO 8 6.027 5.646 -3.370
62 HD2 PRO 8 2HD PRO 8 5.917 3.226 -4.580
63 HD3 PRO 8 1HD PRO 8 7.450 4.047 -4.221
64 HA PRO 9 HA PRO 9 3.957 0.470 0.673
65 HB2 PRO 9 2HB PRO 9 3.883 1.408 3.253
66 HB3 PRO 9 1HB PRO 9 5.040 0.194 2.689
67 HG2 PRO 9 2HG PRO 9 5.408 3.121 3.119
68 HG3 PRO 9 1HG PRO 9 6.535 1.791 3.430
69 HD2 PRO 9 2HD PRO 9 6.721 3.418 1.272
70 HD3 PRO 9 1HD PRO 9 7.244 1.722 1.256
71 H ARG 10 H ARG 10 2.224 1.226 -0.361
72 HA ARG 10 HA ARG 10 1.012 3.756 0.437
73 HB2 ARG 10 2HB ARG 10 1.573 3.185 -1.951
74 HB3 ARG 10 1HB ARG 10 0.391 1.898 -1.849
75 HG2 ARG 10 2HG ARG 10 -1.364 3.571 -1.452
76 HG3 ARG 10 1HG ARG 10 -0.146 4.845 -1.604
77 HD2 ARG 10 2HD ARG 10 -0.926 2.842 -3.723
78 HD3 ARG 10 1HD ARG 10 -1.308 4.560 -3.722
79 HE ARG 10 HE ARG 10 0.990 5.044 -4.063
80 HH11 ARG 10 1HH1 ARG 10 0.145 1.625 -4.521
81 HH12 ARG 10 2HH1 ARG 10 1.563 1.232 -5.361
82 HH21 ARG 10 1HH2 ARG 10 2.922 4.496 -5.258
83 HH22 ARG 10 2HH2 ARG 10 3.179 2.915 -5.843
84 H CYS 11 H CYS 11 -0.539 3.542 1.956
85 HA CYS 11 HA CYS 11 -1.991 1.016 2.035
86 HB2 CYS 11 2HB CYS 11 -1.449 2.964 4.282
87 HB3 CYS 11 1HB CYS 11 -2.462 1.535 4.393
88 H PHE 12 H PHE 12 -4.119 1.024 2.204
89 HA PHE 12 HA PHE 12 -5.435 3.591 1.889
90 HB2 PHE 12 2HB PHE 12 -6.256 0.900 0.756
91 HB3 PHE 12 1HB PHE 12 -7.136 2.407 0.548
92 HD1 PHE 12 1HD PHE 12 -4.563 0.289 -0.726
93 HD2 PHE 12 2HD PHE 12 -5.974 4.296 -0.692
94 HE1 PHE 12 1HE PHE 12 -3.251 0.763 -2.755
95 HE2 PHE 12 2HE PHE 12 -4.671 4.779 -2.716
96 HZ PHE 12 HZ PHE 12 -3.306 3.001 -3.752
97 HA PRO 13 HA PRO 13 -7.465 2.756 5.704
98 HB2 PRO 13 2HB PRO 13 -10.004 3.650 4.490
99 HB3 PRO 13 1HB PRO 13 -9.133 4.286 5.891
100 HG2 PRO 13 2HG PRO 13 -9.136 5.624 3.616
101 HG3 PRO 13 1HG PRO 13 -7.660 5.505 4.593
102 HD2 PRO 13 2HD PRO 13 -8.411 3.989 2.120
103 HD3 PRO 13 1HD PRO 13 -6.862 4.745 2.566
104 H ASP 14 H ASP 14 -8.557 1.137 2.900
105 HA ASP 14 HA ASP 14 -10.641 -0.348 4.207
106 HB2 ASP 14 2HB ASP 14 -10.859 -1.592 2.158
107 HB3 ASP 14 1HB ASP 14 -10.671 0.107 1.744
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -7.585 -0.622 4.457
2 HA2 GLY 1 2HA GLY 1 -6.534 -2.074 5.950
3 HA3 GLY 1 1HA GLY 1 -7.765 -3.282 5.599
4 H ARG 2 H ARG 2 -5.331 -1.510 3.765
5 HA ARG 2 HA ARG 2 -4.018 -3.897 2.883
6 HB2 ARG 2 2HB ARG 2 -5.967 -3.974 1.454
7 HB3 ARG 2 1HB ARG 2 -5.799 -2.277 1.065
8 HG2 ARG 2 2HG ARG 2 -3.771 -2.774 -0.208
9 HG3 ARG 2 1HG ARG 2 -3.933 -4.481 0.215
10 HD2 ARG 2 2HD ARG 2 -4.830 -3.858 -2.048
11 HD3 ARG 2 1HD ARG 2 -5.968 -4.688 -0.988
12 HE ARG 2 HE ARG 2 -6.846 -2.405 -0.452
13 HH11 ARG 2 1HH1 ARG 2 -5.418 -3.085 -3.629
14 HH12 ARG 2 2HH1 ARG 2 -6.250 -1.820 -4.400
15 HH21 ARG 2 1HH2 ARG 2 -7.903 -0.725 -1.461
16 HH22 ARG 2 2HH2 ARG 2 -7.741 -0.414 -3.149
17 H CYS 3 H CYS 3 -1.991 -3.342 2.023
18 HA CYS 3 HA CYS 3 -1.409 -0.504 1.623
19 HB2 CYS 3 2HB CYS 3 0.318 -2.380 3.281
20 HB3 CYS 3 1HB CYS 3 0.664 -0.697 2.921
21 H THR 4 H THR 4 0.514 -0.235 0.248
22 HA THR 4 HA THR 4 0.780 -2.407 -1.541
23 HB THR 4 HB THR 4 2.642 -0.985 -2.536
24 HG1 THR 4 1HG THR 4 3.109 0.869 -1.650
25 HG21 THR 4 1HG2 THR 4 -0.118 0.211 -2.301
26 HG22 THR 4 2HG2 THR 4 0.415 -0.973 -3.499
27 HG23 THR 4 3HG2 THR 4 1.075 0.660 -3.517
28 H LYS 5 H LYS 5 1.985 -4.019 -1.344
29 HA LYS 5 HA LYS 5 3.842 -4.344 0.818
30 HB2 LYS 5 2HB LYS 5 3.375 -6.130 -1.583
31 HB3 LYS 5 1HB LYS 5 4.128 -6.597 -0.065
32 HG2 LYS 5 2HG LYS 5 2.003 -6.212 1.098
33 HG3 LYS 5 1HG LYS 5 1.250 -5.780 -0.437
34 HD2 LYS 5 2HD LYS 5 1.856 -8.052 -1.279
35 HD3 LYS 5 1HD LYS 5 2.431 -8.434 0.338
36 HE2 LYS 5 2HE LYS 5 0.189 -9.295 0.050
37 HE3 LYS 5 1HE LYS 5 0.183 -8.000 1.242
38 HZ1 LYS 5 1HZ LYS 5 -1.678 -7.837 -0.262
39 HZ2 LYS 5 2HZ LYS 5 -0.683 -7.798 -1.595
40 HZ3 LYS 5 3HZ LYS 5 -0.682 -6.500 -0.509
41 H SER 6 H SER 6 3.841 -3.706 -2.563
42 HA SER 6 HA SER 6 6.668 -3.743 -2.890
43 HB2 SER 6 2HB SER 6 5.903 -2.825 -5.161
44 HB3 SER 6 1HB SER 6 5.401 -4.468 -4.749
45 HG SER 6 HG SER 6 3.870 -2.513 -5.460
46 H ILE 7 H ILE 7 7.937 -2.017 -2.749
47 HA ILE 7 HA ILE 7 7.018 0.340 -1.467
48 HB ILE 7 HB ILE 7 9.376 1.117 -1.716
49 HG12 ILE 7 2HG1 ILE 7 9.761 -1.537 -3.140
50 HG13 ILE 7 1HG1 ILE 7 9.836 0.045 -3.903
51 HG21 ILE 7 1HG2 ILE 7 9.026 -1.698 -0.689
52 HG22 ILE 7 2HG2 ILE 7 8.715 -0.220 0.217
53 HG23 ILE 7 3HG2 ILE 7 10.358 -0.622 -0.279
54 HD11 ILE 7 1HD1 ILE 7 11.780 0.593 -2.544
55 HD12 ILE 7 2HD1 ILE 7 12.047 -0.860 -3.511
56 HD13 ILE 7 3HD1 ILE 7 11.698 -0.995 -1.786
57 HA PRO 8 HA PRO 8 7.671 2.560 -1.242
58 HB2 PRO 8 2HB PRO 8 6.048 4.727 -1.390
59 HB3 PRO 8 1HB PRO 8 7.703 4.739 -2.010
60 HG2 PRO 8 2HG PRO 8 5.131 4.363 -3.488
61 HG3 PRO 8 1HG PRO 8 6.535 5.350 -3.932
62 HD2 PRO 8 2HD PRO 8 6.065 2.900 -4.992
63 HD3 PRO 8 1HD PRO 8 7.702 3.535 -4.737
64 HA PRO 9 HA PRO 9 3.955 0.684 0.328
65 HB2 PRO 9 2HB PRO 9 4.401 1.016 2.953
66 HB3 PRO 9 1HB PRO 9 5.342 -0.115 1.977
67 HG2 PRO 9 2HG PRO 9 6.064 2.633 2.890
68 HG3 PRO 9 1HG PRO 9 7.068 1.172 2.851
69 HD2 PRO 9 2HD PRO 9 7.152 3.139 0.953
70 HD3 PRO 9 1HD PRO 9 7.578 1.446 0.638
71 H ARG 10 H ARG 10 2.085 1.602 0.160
72 HA ARG 10 HA ARG 10 1.429 4.031 1.696
73 HB2 ARG 10 2HB ARG 10 1.605 4.405 -0.793
74 HB3 ARG 10 1HB ARG 10 0.344 3.206 -1.009
75 HG2 ARG 10 2HG ARG 10 -1.174 4.637 0.345
76 HG3 ARG 10 1HG ARG 10 0.092 5.865 0.378
77 HD2 ARG 10 2HD ARG 10 -1.274 4.757 -2.073
78 HD3 ARG 10 1HD ARG 10 -1.510 6.357 -1.374
79 HE ARG 10 HE ARG 10 1.204 5.956 -1.997
80 HH11 ARG 10 1HH1 ARG 10 -1.899 6.552 -3.607
81 HH12 ARG 10 2HH1 ARG 10 -1.201 7.316 -4.955
82 HH21 ARG 10 1HH2 ARG 10 2.140 6.951 -3.844
83 HH22 ARG 10 2HH2 ARG 10 1.165 7.521 -5.118
84 H CYS 11 H CYS 11 -0.437 3.771 2.907
85 HA CYS 11 HA CYS 11 -1.755 1.196 2.628
86 HB2 CYS 11 2HB CYS 11 -1.510 3.015 5.012
87 HB3 CYS 11 1HB CYS 11 -2.578 1.614 4.966
88 H PHE 12 H PHE 12 -3.887 0.973 2.504
89 HA PHE 12 HA PHE 12 -5.343 3.374 1.718
90 HB2 PHE 12 2HB PHE 12 -5.883 0.508 0.905
91 HB3 PHE 12 1HB PHE 12 -6.582 1.964 0.206
92 HD1 PHE 12 1HD PHE 12 -4.109 -0.492 -0.150
93 HD2 PHE 12 2HD PHE 12 -4.827 3.644 -0.828
94 HE1 PHE 12 1HE PHE 12 -2.278 -0.448 -1.791
95 HE2 PHE 12 2HE PHE 12 -3.006 3.690 -2.476
96 HZ PHE 12 HZ PHE 12 -1.726 1.645 -2.955
97 HA PRO 13 HA PRO 13 -7.980 2.748 5.225
98 HB2 PRO 13 2HB PRO 13 -10.297 3.462 3.536
99 HB3 PRO 13 1HB PRO 13 -9.676 4.253 4.986
100 HG2 PRO 13 2HG PRO 13 -9.347 5.355 2.584
101 HG3 PRO 13 1HG PRO 13 -8.071 5.441 3.811
102 HD2 PRO 13 2HD PRO 13 -8.278 3.650 1.418
103 HD3 PRO 13 1HD PRO 13 -6.877 4.523 2.075
104 H ASP 14 H ASP 14 -8.365 0.765 2.518
105 HA ASP 14 HA ASP 14 -10.654 -0.654 3.627
106 HB2 ASP 14 2HB ASP 14 -10.655 -2.032 1.623
107 HB3 ASP 14 1HB ASP 14 -10.574 -0.336 1.179
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -7.156 -0.188 4.503
2 HA2 GLY 1 2HA GLY 1 -5.658 -1.220 6.106
3 HA3 GLY 1 1HA GLY 1 -6.838 -2.505 6.299
4 H ARG 2 H ARG 2 -5.491 -1.088 3.354
5 HA ARG 2 HA ARG 2 -4.296 -3.722 2.763
6 HB2 ARG 2 2HB ARG 2 -5.576 -1.831 0.794
7 HB3 ARG 2 1HB ARG 2 -4.748 -3.318 0.391
8 HG2 ARG 2 2HG ARG 2 -6.453 -4.586 1.564
9 HG3 ARG 2 1HG ARG 2 -7.271 -3.079 1.995
10 HD2 ARG 2 2HD ARG 2 -7.577 -2.554 -0.325
11 HD3 ARG 2 1HD ARG 2 -6.732 -4.026 -0.809
12 HE ARG 2 HE ARG 2 -8.938 -4.494 0.912
13 HH11 ARG 2 1HH1 ARG 2 -8.103 -3.790 -2.441
14 HH12 ARG 2 2HH1 ARG 2 -9.427 -4.613 -3.118
15 HH21 ARG 2 1HH2 ARG 2 -10.801 -5.592 0.000
16 HH22 ARG 2 2HH2 ARG 2 -11.016 -5.641 -1.695
17 H CYS 3 H CYS 3 -2.138 -3.409 2.857
18 HA CYS 3 HA CYS 3 -1.129 -0.951 1.618
19 HB2 CYS 3 2HB CYS 3 0.162 -2.732 3.702
20 HB3 CYS 3 1HB CYS 3 0.960 -1.371 2.923
21 H THR 4 H THR 4 0.119 -1.128 -0.147
22 HA THR 4 HA THR 4 0.202 -3.640 -1.425
23 HB THR 4 HB THR 4 1.440 -2.416 -3.196
24 HG1 THR 4 1HG THR 4 2.504 -0.766 -2.532
25 HG21 THR 4 1HG2 THR 4 -0.392 -0.871 -3.775
26 HG22 THR 4 2HG2 THR 4 -1.003 -0.990 -2.124
27 HG23 THR 4 3HG2 THR 4 -1.014 -2.409 -3.171
28 H LYS 5 H LYS 5 1.999 -4.858 -1.962
29 HA LYS 5 HA LYS 5 4.287 -4.546 -0.242
30 HB2 LYS 5 2HB LYS 5 3.754 -6.594 -2.412
31 HB3 LYS 5 1HB LYS 5 5.122 -6.625 -1.318
32 HG2 LYS 5 2HG LYS 5 2.218 -6.947 -0.554
33 HG3 LYS 5 1HG LYS 5 3.420 -8.230 -0.649
34 HD2 LYS 5 2HD LYS 5 3.427 -5.895 1.283
35 HD3 LYS 5 1HD LYS 5 3.044 -7.568 1.669
36 HE2 LYS 5 2HE LYS 5 5.718 -6.513 0.738
37 HE3 LYS 5 1HE LYS 5 5.309 -7.008 2.374
38 HZ1 LYS 5 1HZ LYS 5 6.535 -8.717 1.215
39 HZ2 LYS 5 2HZ LYS 5 5.392 -8.802 -0.003
40 HZ3 LYS 5 3HZ LYS 5 4.988 -9.285 1.550
41 H SER 6 H SER 6 4.897 -2.548 -1.019
42 HA SER 6 HA SER 6 6.760 -2.640 -3.196
43 HB2 SER 6 2HB SER 6 5.781 -0.642 -4.291
44 HB3 SER 6 1HB SER 6 4.653 -1.996 -4.345
45 HG SER 6 HG SER 6 4.600 0.248 -2.584
46 H ILE 7 H ILE 7 8.009 -0.563 -3.118
47 HA ILE 7 HA ILE 7 7.757 0.781 -0.542
48 HB ILE 7 HB ILE 7 10.313 0.209 -2.095
49 HG12 ILE 7 2HG1 ILE 7 9.506 -1.798 -0.935
50 HG13 ILE 7 1HG1 ILE 7 10.983 -1.205 -0.192
51 HG21 ILE 7 1HG2 ILE 7 11.514 1.217 -0.204
52 HG22 ILE 7 2HG2 ILE 7 9.972 1.642 0.537
53 HG23 ILE 7 3HG2 ILE 7 10.440 2.369 -1.000
54 HD11 ILE 7 1HD1 ILE 7 9.634 -0.197 1.610
55 HD12 ILE 7 2HD1 ILE 7 9.410 -1.940 1.495
56 HD13 ILE 7 3HD1 ILE 7 8.177 -0.853 0.863
57 HA PRO 8 HA PRO 8 7.404 2.582 0.256
58 HB2 PRO 8 2HB PRO 8 5.416 4.613 -0.414
59 HB3 PRO 8 1HB PRO 8 6.801 4.747 0.671
60 HG2 PRO 8 2HG PRO 8 6.698 6.073 -1.664
61 HG3 PRO 8 1HG PRO 8 8.219 5.440 -1.020
62 HD2 PRO 8 2HD PRO 8 6.420 4.240 -3.104
63 HD3 PRO 8 1HD PRO 8 8.185 4.455 -3.143
64 HA PRO 9 HA PRO 9 3.675 0.166 -0.190
65 HB2 PRO 9 2HB PRO 9 2.701 0.312 2.351
66 HB3 PRO 9 1HB PRO 9 4.064 -0.716 1.903
67 HG2 PRO 9 2HG PRO 9 4.052 1.948 3.234
68 HG3 PRO 9 1HG PRO 9 5.094 0.550 3.544
69 HD2 PRO 9 2HD PRO 9 5.886 2.729 2.103
70 HD3 PRO 9 1HD PRO 9 6.538 1.099 1.846
71 H ARG 10 H ARG 10 1.739 0.683 -0.982
72 HA ARG 10 HA ARG 10 0.639 3.302 -0.385
73 HB2 ARG 10 2HB ARG 10 0.991 2.461 -2.764
74 HB3 ARG 10 1HB ARG 10 -0.245 1.260 -2.445
75 HG2 ARG 10 2HG ARG 10 -1.106 3.178 -3.700
76 HG3 ARG 10 1HG ARG 10 -1.896 3.013 -2.129
77 HD2 ARG 10 2HD ARG 10 -1.259 5.361 -2.723
78 HD3 ARG 10 1HD ARG 10 -0.585 4.786 -1.200
79 HE ARG 10 HE ARG 10 1.008 4.680 -3.663
80 HH11 ARG 10 1HH1 ARG 10 0.575 5.971 -0.377
81 HH12 ARG 10 2HH1 ARG 10 2.139 6.619 -0.290
82 HH21 ARG 10 1HH2 ARG 10 3.167 5.537 -3.493
83 HH22 ARG 10 2HH2 ARG 10 3.661 6.366 -2.080
84 H CYS 11 H CYS 11 -0.741 3.306 1.265
85 HA CYS 11 HA CYS 11 -2.138 0.822 1.867
86 HB2 CYS 11 2HB CYS 11 -1.455 3.126 3.681
87 HB3 CYS 11 1HB CYS 11 -2.380 1.708 4.159
88 H PHE 12 H PHE 12 -4.109 0.680 1.582
89 HA PHE 12 HA PHE 12 -5.787 2.961 0.953
90 HB2 PHE 12 2HB PHE 12 -6.376 -0.016 1.003
91 HB3 PHE 12 1HB PHE 12 -7.456 1.225 0.396
92 HD1 PHE 12 1HD PHE 12 -4.255 -0.534 -0.249
93 HD2 PHE 12 2HD PHE 12 -7.213 2.109 -1.785
94 HE1 PHE 12 1HE PHE 12 -3.287 -0.761 -2.487
95 HE2 PHE 12 2HE PHE 12 -6.243 1.894 -4.024
96 HZ PHE 12 HZ PHE 12 -4.273 0.453 -4.383
97 HA PRO 13 HA PRO 13 -7.349 3.573 5.005
98 HB2 PRO 13 2HB PRO 13 -10.053 3.898 4.527
99 HB3 PRO 13 1HB PRO 13 -8.832 5.154 4.315
100 HG2 PRO 13 2HG PRO 13 -10.056 3.337 2.277
101 HG3 PRO 13 1HG PRO 13 -9.680 5.067 2.153
102 HD2 PRO 13 2HD PRO 13 -8.103 3.243 1.020
103 HD3 PRO 13 1HD PRO 13 -7.406 4.669 1.812
104 H ASP 14 H ASP 14 -8.839 0.997 3.149
105 HA ASP 14 HA ASP 14 -10.340 0.027 5.393
106 HB2 ASP 14 2HB ASP 14 -11.144 -1.705 3.943
107 HB3 ASP 14 1HB ASP 14 -11.155 -0.198 3.043
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -7.226 -0.182 4.514
2 HA2 GLY 1 2HA GLY 1 -5.887 -0.930 6.295
3 HA3 GLY 1 1HA GLY 1 -6.936 -2.327 6.459
4 H ARG 2 H ARG 2 -5.582 -1.269 3.392
5 HA ARG 2 HA ARG 2 -3.782 -3.567 3.579
6 HB2 ARG 2 2HB ARG 2 -4.198 -4.205 1.307
7 HB3 ARG 2 1HB ARG 2 -5.723 -4.148 2.166
8 HG2 ARG 2 2HG ARG 2 -6.154 -1.931 1.139
9 HG3 ARG 2 1HG ARG 2 -4.669 -2.128 0.198
10 HD2 ARG 2 2HD ARG 2 -5.603 -4.282 -0.637
11 HD3 ARG 2 1HD ARG 2 -7.121 -3.861 0.141
12 HE ARG 2 HE ARG 2 -5.863 -2.353 -2.039
13 HH11 ARG 2 1HH1 ARG 2 -8.735 -3.070 -0.161
14 HH12 ARG 2 2HH1 ARG 2 -9.849 -2.749 -1.412
15 HH21 ARG 2 1HH2 ARG 2 -7.354 -1.817 -3.765
16 HH22 ARG 2 2HH2 ARG 2 -9.029 -1.945 -3.527
17 H CYS 3 H CYS 3 -1.853 -3.416 2.402
18 HA CYS 3 HA CYS 3 -1.207 -0.756 1.406
19 HB2 CYS 3 2HB CYS 3 0.487 -2.425 3.287
20 HB3 CYS 3 1HB CYS 3 0.982 -0.905 2.550
21 H THR 4 H THR 4 0.465 -0.784 -0.174
22 HA THR 4 HA THR 4 0.478 -3.081 -1.799
23 HB THR 4 HB THR 4 2.225 -1.783 -3.082
24 HG1 THR 4 1HG THR 4 3.186 -0.272 -2.005
25 HG21 THR 4 1HG2 THR 4 0.646 -0.029 -3.813
26 HG22 THR 4 2HG2 THR 4 -0.340 -0.335 -2.381
27 HG23 THR 4 3HG2 THR 4 -0.163 -1.583 -3.612
28 H LYS 5 H LYS 5 2.162 -4.494 -2.248
29 HA LYS 5 HA LYS 5 4.052 -5.009 -0.157
30 HB2 LYS 5 2HB LYS 5 3.756 -6.211 -2.923
31 HB3 LYS 5 1HB LYS 5 4.837 -6.808 -1.673
32 HG2 LYS 5 2HG LYS 5 2.987 -7.393 -0.261
33 HG3 LYS 5 1HG LYS 5 1.853 -6.627 -1.364
34 HD2 LYS 5 2HD LYS 5 1.705 -9.004 -1.667
35 HD3 LYS 5 1HD LYS 5 2.467 -8.318 -3.088
36 HE2 LYS 5 2HE LYS 5 3.999 -9.604 -0.816
37 HE3 LYS 5 1HE LYS 5 3.454 -10.488 -2.230
38 HZ1 LYS 5 1HZ LYS 5 4.847 -8.935 -3.589
39 HZ2 LYS 5 2HZ LYS 5 5.698 -9.908 -2.553
40 HZ3 LYS 5 3HZ LYS 5 5.499 -8.308 -2.154
41 H SER 6 H SER 6 3.986 -3.376 -3.195
42 HA SER 6 HA SER 6 6.764 -3.054 -3.502
43 HB2 SER 6 2HB SER 6 5.936 -1.272 -5.138
44 HB3 SER 6 1HB SER 6 5.432 -2.934 -5.453
45 HG SER 6 HG SER 6 3.479 -2.285 -5.296
46 H ILE 7 H ILE 7 8.029 -1.497 -2.689
47 HA ILE 7 HA ILE 7 6.902 0.333 -0.743
48 HB ILE 7 HB ILE 7 9.304 0.874 -0.237
49 HG12 ILE 7 2HG1 ILE 7 9.881 -1.362 -2.212
50 HG13 ILE 7 1HG1 ILE 7 10.256 0.337 -2.443
51 HG21 ILE 7 1HG2 ILE 7 8.522 -2.032 -0.073
52 HG22 ILE 7 2HG2 ILE 7 8.132 -0.767 1.091
53 HG23 ILE 7 3HG2 ILE 7 9.806 -1.271 0.865
54 HD11 ILE 7 1HD1 ILE 7 11.836 0.251 -0.610
55 HD12 ILE 7 2HD1 ILE 7 12.220 -0.968 -1.826
56 HD13 ILE 7 3HD1 ILE 7 11.432 -1.439 -0.319
57 HA PRO 8 HA PRO 8 7.559 2.297 0.253
58 HB2 PRO 8 2HB PRO 8 6.036 4.743 -0.182
59 HB3 PRO 8 1HB PRO 8 7.580 4.548 0.647
60 HG2 PRO 8 2HG PRO 8 7.368 5.831 -1.727
61 HG3 PRO 8 1HG PRO 8 8.807 4.901 -1.270
62 HD2 PRO 8 2HD PRO 8 6.515 4.089 -3.027
63 HD3 PRO 8 1HD PRO 8 8.261 3.876 -3.287
64 HA PRO 9 HA PRO 9 3.635 0.359 0.590
65 HB2 PRO 9 2HB PRO 9 2.987 1.120 3.171
66 HB3 PRO 9 1HB PRO 9 4.030 -0.241 2.753
67 HG2 PRO 9 2HG PRO 9 4.771 2.534 3.575
68 HG3 PRO 9 1HG PRO 9 5.529 0.993 4.015
69 HD2 PRO 9 2HD PRO 9 6.621 2.610 2.189
70 HD3 PRO 9 1HD PRO 9 6.680 0.844 2.004
71 H ARG 10 H ARG 10 2.122 1.192 -0.632
72 HA ARG 10 HA ARG 10 0.862 3.724 0.047
73 HB2 ARG 10 2HB ARG 10 1.411 3.238 -2.301
74 HB3 ARG 10 1HB ARG 10 0.481 1.756 -2.222
75 HG2 ARG 10 2HG ARG 10 -1.566 3.045 -1.946
76 HG3 ARG 10 1HG ARG 10 -0.630 4.546 -1.991
77 HD2 ARG 10 2HD ARG 10 0.164 3.997 -4.216
78 HD3 ARG 10 1HD ARG 10 -0.733 2.481 -4.176
79 HE ARG 10 HE ARG 10 -2.504 4.573 -3.736
80 HH11 ARG 10 1HH1 ARG 10 -0.414 3.323 -6.324
81 HH12 ARG 10 2HH1 ARG 10 -1.386 3.869 -7.600
82 HH21 ARG 10 1HH2 ARG 10 -3.900 5.325 -5.540
83 HH22 ARG 10 2HH2 ARG 10 -3.408 5.035 -7.137
84 H CYS 11 H CYS 11 -0.726 3.598 1.526
85 HA CYS 11 HA CYS 11 -2.037 1.015 1.837
86 HB2 CYS 11 2HB CYS 11 -1.613 3.204 3.863
87 HB3 CYS 11 1HB CYS 11 -2.440 1.676 4.164
88 H PHE 12 H PHE 12 -4.142 0.855 1.976
89 HA PHE 12 HA PHE 12 -5.681 3.203 1.186
90 HB2 PHE 12 2HB PHE 12 -6.192 0.261 0.640
91 HB3 PHE 12 1HB PHE 12 -7.269 1.573 0.175
92 HD1 PHE 12 1HD PHE 12 -6.741 3.017 -1.674
93 HD2 PHE 12 2HD PHE 12 -4.058 -0.072 -0.514
94 HE1 PHE 12 1HE PHE 12 -5.526 3.287 -3.786
95 HE2 PHE 12 2HE PHE 12 -2.836 0.189 -2.625
96 HZ PHE 12 HZ PHE 12 -3.565 1.872 -4.269
97 HA PRO 13 HA PRO 13 -7.818 3.225 5.025
98 HB2 PRO 13 2HB PRO 13 -10.383 3.493 3.587
99 HB3 PRO 13 1HB PRO 13 -9.632 4.578 4.759
100 HG2 PRO 13 2HG PRO 13 -9.663 5.203 2.176
101 HG3 PRO 13 1HG PRO 13 -8.237 5.544 3.170
102 HD2 PRO 13 2HD PRO 13 -8.705 3.334 1.212
103 HD3 PRO 13 1HD PRO 13 -7.258 4.330 1.481
104 H ASP 14 H ASP 14 -8.580 0.699 2.876
105 HA ASP 14 HA ASP 14 -10.477 -0.527 4.702
106 HB2 ASP 14 2HB ASP 14 -10.666 -2.317 3.075
107 HB3 ASP 14 1HB ASP 14 -10.811 -0.771 2.252
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -7.039 -0.434 4.938
2 HA2 GLY 1 2HA GLY 1 -5.352 -1.581 6.035
3 HA3 GLY 1 1HA GLY 1 -6.402 -2.991 6.129
4 H ARG 2 H ARG 2 -5.749 -1.253 3.252
5 HA ARG 2 HA ARG 2 -4.385 -3.596 2.116
6 HB2 ARG 2 2HB ARG 2 -6.594 -2.948 1.167
7 HB3 ARG 2 1HB ARG 2 -5.931 -1.371 0.788
8 HG2 ARG 2 2HG ARG 2 -4.276 -2.501 -0.677
9 HG3 ARG 2 1HG ARG 2 -5.138 -4.015 -0.388
10 HD2 ARG 2 2HD ARG 2 -6.233 -1.509 -1.656
11 HD3 ARG 2 1HD ARG 2 -5.915 -3.046 -2.451
12 HE ARG 2 HE ARG 2 -7.919 -2.817 -0.298
13 HH11 ARG 2 1HH1 ARG 2 -7.085 -3.772 -3.614
14 HH12 ARG 2 2HH1 ARG 2 -8.623 -4.395 -3.974
15 HH21 ARG 2 1HH2 ARG 2 -9.995 -3.644 -0.784
16 HH22 ARG 2 2HH2 ARG 2 -10.348 -4.323 -2.310
17 H CYS 3 H CYS 3 -2.270 -3.205 1.585
18 HA CYS 3 HA CYS 3 -1.460 -0.454 1.010
19 HB2 CYS 3 2HB CYS 3 0.038 -2.327 2.865
20 HB3 CYS 3 1HB CYS 3 0.547 -0.716 2.384
21 H THR 4 H THR 4 0.317 -0.372 -0.441
22 HA THR 4 HA THR 4 0.627 -2.655 -2.063
23 HB THR 4 HB THR 4 2.515 -1.307 -3.090
24 HG1 THR 4 1HG THR 4 3.274 0.168 -1.819
25 HG21 THR 4 1HG2 THR 4 1.039 0.422 -4.053
26 HG22 THR 4 2HG2 THR 4 -0.149 0.096 -2.790
27 HG23 THR 4 3HG2 THR 4 0.241 -1.149 -3.977
28 H LYS 5 H LYS 5 1.978 -4.310 -1.815
29 HA LYS 5 HA LYS 5 3.602 -4.459 0.526
30 HB2 LYS 5 2HB LYS 5 3.237 -6.358 -1.781
31 HB3 LYS 5 1HB LYS 5 4.188 -6.731 -0.346
32 HG2 LYS 5 2HG LYS 5 2.242 -6.543 1.054
33 HG3 LYS 5 1HG LYS 5 1.260 -6.007 -0.304
34 HD2 LYS 5 2HD LYS 5 1.668 -8.205 -1.393
35 HD3 LYS 5 1HD LYS 5 2.558 -8.703 0.047
36 HE2 LYS 5 2HE LYS 5 0.258 -9.542 0.059
37 HE3 LYS 5 1HE LYS 5 0.566 -8.447 1.404
38 HZ1 LYS 5 1HZ LYS 5 -0.828 -7.683 -1.123
39 HZ2 LYS 5 2HZ LYS 5 -0.598 -6.704 0.234
40 HZ3 LYS 5 3HZ LYS 5 -1.566 -8.063 0.339
41 H SER 6 H SER 6 4.115 -3.495 -2.680
42 HA SER 6 HA SER 6 6.970 -3.710 -2.468
43 HB2 SER 6 2HB SER 6 6.871 -2.540 -4.703
44 HB3 SER 6 1HB SER 6 6.051 -4.104 -4.643
45 HG SER 6 HG SER 6 4.213 -3.183 -4.908
46 H ILE 7 H ILE 7 8.317 -1.900 -2.278
47 HA ILE 7 HA ILE 7 7.180 0.245 -0.802
48 HB ILE 7 HB ILE 7 9.532 1.159 -0.668
49 HG12 ILE 7 2HG1 ILE 7 11.380 -0.558 -1.214
50 HG13 ILE 7 1HG1 ILE 7 10.199 -1.358 -2.229
51 HG21 ILE 7 1HG2 ILE 7 9.094 -1.667 0.246
52 HG22 ILE 7 2HG2 ILE 7 8.636 -0.190 1.095
53 HG23 ILE 7 3HG2 ILE 7 10.339 -0.581 0.859
54 HD11 ILE 7 1HD1 ILE 7 11.681 0.022 -3.541
55 HD12 ILE 7 2HD1 ILE 7 11.251 1.438 -2.583
56 HD13 ILE 7 3HD1 ILE 7 10.040 0.666 -3.606
57 HA PRO 8 HA PRO 8 7.541 2.222 -0.180
58 HB2 PRO 8 2HB PRO 8 6.108 4.504 -0.151
59 HB3 PRO 8 1HB PRO 8 7.832 4.501 -0.538
60 HG2 PRO 8 2HG PRO 8 5.480 4.687 -2.357
61 HG3 PRO 8 1HG PRO 8 7.039 5.520 -2.458
62 HD2 PRO 8 2HD PRO 8 6.352 3.280 -3.927
63 HD3 PRO 8 1HD PRO 8 8.013 3.789 -3.586
64 HA PRO 9 HA PRO 9 3.553 0.401 0.304
65 HB2 PRO 9 2HB PRO 9 3.208 0.677 2.984
66 HB3 PRO 9 1HB PRO 9 4.305 -0.507 2.264
67 HG2 PRO 9 2HG PRO 9 4.916 2.118 3.518
68 HG3 PRO 9 1HG PRO 9 5.833 0.606 3.576
69 HD2 PRO 9 2HD PRO 9 6.452 2.737 1.949
70 HD3 PRO 9 1HD PRO 9 6.917 1.055 1.621
71 H ARG 10 H ARG 10 2.068 1.598 -0.659
72 HA ARG 10 HA ARG 10 1.048 3.988 0.664
73 HB2 ARG 10 2HB ARG 10 1.554 4.146 -1.742
74 HB3 ARG 10 1HB ARG 10 0.466 2.808 -2.063
75 HG2 ARG 10 2HG ARG 10 -1.437 4.130 -1.409
76 HG3 ARG 10 1HG ARG 10 -0.386 5.456 -0.905
77 HD2 ARG 10 2HD ARG 10 -1.345 5.885 -3.118
78 HD3 ARG 10 1HD ARG 10 0.398 5.721 -3.191
79 HE ARG 10 HE ARG 10 -1.393 3.504 -3.866
80 HH11 ARG 10 1HH1 ARG 10 1.262 5.705 -4.779
81 HH12 ARG 10 2HH1 ARG 10 1.695 4.817 -6.158
82 HH21 ARG 10 1HH2 ARG 10 -0.766 2.309 -5.825
83 HH22 ARG 10 2HH2 ARG 10 0.549 2.868 -6.743
84 H CYS 11 H CYS 11 -0.706 3.828 1.849
85 HA CYS 11 HA CYS 11 -2.113 1.280 1.813
86 HB2 CYS 11 2HB CYS 11 -1.741 3.262 4.033
87 HB3 CYS 11 1HB CYS 11 -2.766 1.835 4.120
88 H PHE 12 H PHE 12 -4.251 1.163 2.169
89 HA PHE 12 HA PHE 12 -5.888 3.507 1.546
90 HB2 PHE 12 2HB PHE 12 -6.412 0.595 0.828
91 HB3 PHE 12 1HB PHE 12 -7.366 1.982 0.333
92 HD1 PHE 12 1HD PHE 12 -6.493 3.541 -1.354
93 HD2 PHE 12 2HD PHE 12 -4.413 -0.018 -0.343
94 HE1 PHE 12 1HE PHE 12 -5.150 3.746 -3.408
95 HE2 PHE 12 2HE PHE 12 -3.072 0.169 -2.388
96 HZ PHE 12 HZ PHE 12 -3.439 2.055 -3.926
97 HA PRO 13 HA PRO 13 -7.654 2.857 5.515
98 HB2 PRO 13 2HB PRO 13 -10.294 3.330 5.174
99 HB3 PRO 13 1HB PRO 13 -9.064 4.597 5.098
100 HG2 PRO 13 2HG PRO 13 -10.334 3.074 2.849
101 HG3 PRO 13 1HG PRO 13 -10.120 4.826 3.021
102 HD2 PRO 13 2HD PRO 13 -8.436 3.399 1.528
103 HD3 PRO 13 1HD PRO 13 -7.826 4.708 2.560
104 H ASP 14 H ASP 14 -8.359 0.545 3.200
105 HA ASP 14 HA ASP 14 -10.128 -0.922 4.987
106 HB2 ASP 14 2HB ASP 14 -10.535 -2.453 3.129
107 HB3 ASP 14 1HB ASP 14 -10.818 -0.798 2.623
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -7.536 -0.109 4.079
2 HA2 GLY 1 2HA GLY 1 -6.441 -1.456 5.699
3 HA3 GLY 1 1HA GLY 1 -7.756 -2.614 5.583
4 H ARG 2 H ARG 2 -5.537 -1.097 3.263
5 HA ARG 2 HA ARG 2 -4.582 -3.776 2.531
6 HB2 ARG 2 2HB ARG 2 -5.445 -1.659 0.558
7 HB3 ARG 2 1HB ARG 2 -4.522 -3.083 0.141
8 HG2 ARG 2 2HG ARG 2 -6.405 -4.486 0.839
9 HG3 ARG 2 1HG ARG 2 -7.323 -3.022 1.220
10 HD2 ARG 2 2HD ARG 2 -6.199 -3.740 -1.483
11 HD3 ARG 2 1HD ARG 2 -7.886 -3.888 -1.000
12 HE ARG 2 HE ARG 2 -7.777 -1.429 -0.595
13 HH11 ARG 2 1HH1 ARG 2 -5.653 -2.949 -3.045
14 HH12 ARG 2 2HH1 ARG 2 -5.634 -1.599 -4.070
15 HH21 ARG 2 1HH2 ARG 2 -7.729 0.430 -2.100
16 HH22 ARG 2 2HH2 ARG 2 -6.815 0.337 -3.529
17 H CYS 3 H CYS 3 -2.466 -3.692 2.929
18 HA CYS 3 HA CYS 3 -1.054 -1.228 2.226
19 HB2 CYS 3 2HB CYS 3 -0.321 -3.374 4.232
20 HB3 CYS 3 1HB CYS 3 0.710 -2.015 3.791
21 H THR 4 H THR 4 0.466 -1.336 0.706
22 HA THR 4 HA THR 4 0.744 -3.869 -0.658
23 HB THR 4 HB THR 4 1.733 -2.419 -2.448
24 HG1 THR 4 1HG THR 4 1.968 -0.355 -2.136
25 HG21 THR 4 1HG2 THR 4 -0.637 -3.031 -2.489
26 HG22 THR 4 2HG2 THR 4 -0.412 -1.385 -3.086
27 HG23 THR 4 3HG2 THR 4 -1.017 -1.657 -1.453
28 H LYS 5 H LYS 5 2.653 -4.962 -0.782
29 HA LYS 5 HA LYS 5 4.946 -3.750 0.521
30 HB2 LYS 5 2HB LYS 5 4.667 -6.544 -0.626
31 HB3 LYS 5 1HB LYS 5 6.004 -5.939 0.338
32 HG2 LYS 5 2HG LYS 5 4.469 -5.653 2.242
33 HG3 LYS 5 1HG LYS 5 3.179 -6.367 1.272
34 HD2 LYS 5 2HD LYS 5 4.563 -8.396 1.001
35 HD3 LYS 5 1HD LYS 5 5.770 -7.681 2.070
36 HE2 LYS 5 2HE LYS 5 4.440 -9.165 3.377
37 HE3 LYS 5 1HE LYS 5 4.006 -7.518 3.820
38 HZ1 LYS 5 1HZ LYS 5 2.053 -7.711 2.342
39 HZ2 LYS 5 2HZ LYS 5 2.036 -8.818 3.588
40 HZ3 LYS 5 3HZ LYS 5 2.449 -9.329 2.044
41 H SER 6 H SER 6 5.356 -2.228 -0.957
42 HA SER 6 HA SER 6 6.793 -2.996 -3.309
43 HB2 SER 6 2HB SER 6 5.316 -1.435 -4.685
44 HB3 SER 6 1HB SER 6 4.576 -2.972 -4.235
45 HG SER 6 HG SER 6 3.259 -1.080 -3.917
46 H ILE 7 H ILE 7 7.183 -0.511 -4.381
47 HA ILE 7 HA ILE 7 7.701 1.137 -2.068
48 HB ILE 7 HB ILE 7 9.652 2.120 -3.320
49 HG12 ILE 7 2HG1 ILE 7 9.333 -0.339 -5.066
50 HG13 ILE 7 1HG1 ILE 7 9.054 1.317 -5.583
51 HG21 ILE 7 1HG2 ILE 7 9.994 0.598 -1.480
52 HG22 ILE 7 2HG2 ILE 7 11.191 0.279 -2.738
53 HG23 ILE 7 3HG2 ILE 7 9.801 -0.788 -2.553
54 HD11 ILE 7 1HD1 ILE 7 11.674 0.158 -4.683
55 HD12 ILE 7 2HD1 ILE 7 11.409 1.823 -5.199
56 HD13 ILE 7 3HD1 ILE 7 11.208 0.500 -6.348
57 HA PRO 8 HA PRO 8 7.304 2.732 -1.185
58 HB2 PRO 8 2HB PRO 8 5.567 4.564 -0.356
59 HB3 PRO 8 1HB PRO 8 7.025 5.040 -1.234
60 HG2 PRO 8 2HG PRO 8 4.217 4.816 -2.213
61 HG3 PRO 8 1HG PRO 8 5.436 6.046 -2.579
62 HD2 PRO 8 2HD PRO 8 4.818 3.877 -4.202
63 HD3 PRO 8 1HD PRO 8 6.325 4.810 -4.267
64 HA PRO 9 HA PRO 9 3.986 -0.010 0.043
65 HB2 PRO 9 2HB PRO 9 4.315 0.114 2.763
66 HB3 PRO 9 1HB PRO 9 5.352 -0.850 1.710
67 HG2 PRO 9 2HG PRO 9 5.844 1.839 2.906
68 HG3 PRO 9 1HG PRO 9 6.969 0.487 2.687
69 HD2 PRO 9 2HD PRO 9 6.923 2.651 1.053
70 HD3 PRO 9 1HD PRO 9 7.385 1.032 0.495
71 H ARG 10 H ARG 10 1.990 0.771 -0.229
72 HA ARG 10 HA ARG 10 1.234 3.122 1.329
73 HB2 ARG 10 2HB ARG 10 0.264 2.195 -1.372
74 HB3 ARG 10 1HB ARG 10 -0.497 3.487 -0.453
75 HG2 ARG 10 2HG ARG 10 1.560 4.776 -0.526
76 HG3 ARG 10 1HG ARG 10 2.359 3.472 -1.401
77 HD2 ARG 10 2HD ARG 10 0.827 3.761 -3.265
78 HD3 ARG 10 1HD ARG 10 -0.049 5.007 -2.376
79 HE ARG 10 HE ARG 10 2.411 5.993 -2.370
80 HH11 ARG 10 1HH1 ARG 10 0.478 4.705 -5.056
81 HH12 ARG 10 2HH1 ARG 10 1.205 5.682 -6.235
82 HH21 ARG 10 1HH2 ARG 10 3.394 7.365 -4.028
83 HH22 ARG 10 2HH2 ARG 10 2.908 7.209 -5.645
84 H CYS 11 H CYS 11 -0.566 3.110 2.473
85 HA CYS 11 HA CYS 11 -2.003 0.578 2.590
86 HB2 CYS 11 2HB CYS 11 -1.437 2.565 4.788
87 HB3 CYS 11 1HB CYS 11 -2.537 1.198 4.945
88 H PHE 12 H PHE 12 -3.872 0.688 1.840
89 HA PHE 12 HA PHE 12 -5.185 3.220 1.406
90 HB2 PHE 12 2HB PHE 12 -5.976 0.392 0.672
91 HB3 PHE 12 1HB PHE 12 -6.876 1.833 0.213
92 HD1 PHE 12 1HD PHE 12 -6.083 3.307 -1.503
93 HD2 PHE 12 2HD PHE 12 -3.795 -0.094 -0.341
94 HE1 PHE 12 1HE PHE 12 -4.694 3.558 -3.505
95 HE2 PHE 12 2HE PHE 12 -2.400 0.157 -2.343
96 HZ PHE 12 HZ PHE 12 -2.844 1.982 -3.932
97 HA PRO 13 HA PRO 13 -7.541 3.399 5.080
98 HB2 PRO 13 2HB PRO 13 -9.962 4.287 4.058
99 HB3 PRO 13 1HB PRO 13 -8.575 5.310 4.435
100 HG2 PRO 13 2HG PRO 13 -9.414 4.153 1.811
101 HG3 PRO 13 1HG PRO 13 -8.797 5.777 2.171
102 HD2 PRO 13 2HD PRO 13 -7.222 3.948 1.072
103 HD3 PRO 13 1HD PRO 13 -6.594 5.027 2.337
104 H ASP 14 H ASP 14 -8.667 1.325 2.547
105 HA ASP 14 HA ASP 14 -10.816 0.254 4.176
106 HB2 ASP 14 2HB ASP 14 -11.417 -1.132 2.348
107 HB3 ASP 14 1HB ASP 14 -10.909 0.381 1.622
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -7.706 -0.362 3.993
2 HA2 GLY 1 2HA GLY 1 -6.911 -1.747 5.674
3 HA3 GLY 1 1HA GLY 1 -8.055 -2.978 5.164
4 H ARG 2 H ARG 2 -5.488 -1.287 3.392
5 HA ARG 2 HA ARG 2 -4.032 -3.780 3.234
6 HB2 ARG 2 2HB ARG 2 -3.831 -3.717 0.816
7 HB3 ARG 2 1HB ARG 2 -5.521 -3.873 1.289
8 HG2 ARG 2 2HG ARG 2 -5.946 -1.591 0.777
9 HG3 ARG 2 1HG ARG 2 -4.226 -1.270 0.554
10 HD2 ARG 2 2HD ARG 2 -4.199 -2.766 -1.355
11 HD3 ARG 2 1HD ARG 2 -5.922 -3.081 -1.153
12 HE ARG 2 HE ARG 2 -6.062 -0.554 -1.369
13 HH11 ARG 2 1HH1 ARG 2 -3.953 -2.727 -3.208
14 HH12 ARG 2 2HH1 ARG 2 -3.770 -1.666 -4.531
15 HH21 ARG 2 1HH2 ARG 2 -5.828 0.885 -3.227
16 HH22 ARG 2 2HH2 ARG 2 -4.875 0.382 -4.572
17 H CYS 3 H CYS 3 -1.888 -3.473 2.869
18 HA CYS 3 HA CYS 3 -0.982 -0.746 2.362
19 HB2 CYS 3 2HB CYS 3 0.323 -2.777 4.207
20 HB3 CYS 3 1HB CYS 3 0.881 -1.136 3.898
21 H THR 4 H THR 4 0.496 -0.625 0.734
22 HA THR 4 HA THR 4 0.788 -2.917 -0.870
23 HB THR 4 HB THR 4 2.305 -1.348 -2.227
24 HG1 THR 4 1HG THR 4 2.632 0.593 -1.478
25 HG21 THR 4 1HG2 THR 4 0.367 -0.061 -3.051
26 HG22 THR 4 2HG2 THR 4 -0.542 -0.542 -1.613
27 HG23 THR 4 3HG2 THR 4 -0.042 -1.755 -2.783
28 H LYS 5 H LYS 5 2.362 -4.295 -1.068
29 HA LYS 5 HA LYS 5 4.570 -4.214 0.792
30 HB2 LYS 5 2HB LYS 5 3.402 -6.336 0.389
31 HB3 LYS 5 1HB LYS 5 3.798 -6.236 -1.319
32 HG2 LYS 5 2HG LYS 5 6.138 -6.533 -0.847
33 HG3 LYS 5 1HG LYS 5 5.836 -6.459 0.883
34 HD2 LYS 5 2HD LYS 5 6.164 -8.752 0.291
35 HD3 LYS 5 1HD LYS 5 4.468 -8.529 0.672
36 HE2 LYS 5 2HE LYS 5 5.563 -8.583 -2.146
37 HE3 LYS 5 1HE LYS 5 4.974 -10.008 -1.313
38 HZ1 LYS 5 1HZ LYS 5 2.783 -8.778 -1.117
39 HZ2 LYS 5 2HZ LYS 5 3.229 -9.260 -2.638
40 HZ3 LYS 5 3HZ LYS 5 3.401 -7.654 -2.226
41 H SER 6 H SER 6 3.921 -3.635 -2.553
42 HA SER 6 HA SER 6 6.681 -3.437 -3.258
43 HB2 SER 6 2HB SER 6 5.608 -2.541 -5.411
44 HB3 SER 6 1HB SER 6 5.259 -4.219 -4.989
45 HG SER 6 HG SER 6 3.441 -2.778 -5.621
46 H ILE 7 H ILE 7 7.680 -1.437 -3.821
47 HA ILE 7 HA ILE 7 6.872 0.658 -2.065
48 HB ILE 7 HB ILE 7 8.849 1.906 -2.869
49 HG12 ILE 7 2HG1 ILE 7 9.337 -0.480 -4.676
50 HG13 ILE 7 1HG1 ILE 7 8.787 1.098 -5.226
51 HG21 ILE 7 1HG2 ILE 7 10.567 0.349 -2.043
52 HG22 ILE 7 2HG2 ILE 7 9.410 -0.975 -2.170
53 HG23 ILE 7 3HG2 ILE 7 9.121 0.341 -1.033
54 HD11 ILE 7 1HD1 ILE 7 11.155 0.785 -5.612
55 HD12 ILE 7 2HD1 ILE 7 11.410 0.500 -3.889
56 HD13 ILE 7 3HD1 ILE 7 10.876 2.084 -4.453
57 HA PRO 8 HA PRO 8 7.031 2.769 -1.773
58 HB2 PRO 8 2HB PRO 8 4.858 4.634 -1.575
59 HB3 PRO 8 1HB PRO 8 6.571 4.964 -1.850
60 HG2 PRO 8 2HG PRO 8 4.578 5.389 -3.710
61 HG3 PRO 8 1HG PRO 8 6.297 5.189 -4.087
62 HD2 PRO 8 2HD PRO 8 4.076 3.194 -4.237
63 HD3 PRO 8 1HD PRO 8 5.449 3.444 -5.339
64 HA PRO 9 HA PRO 9 3.984 0.247 0.422
65 HB2 PRO 9 2HB PRO 9 5.390 1.058 2.879
66 HB3 PRO 9 1HB PRO 9 5.226 -0.553 2.176
67 HG2 PRO 9 2HG PRO 9 7.570 0.757 2.182
68 HG3 PRO 9 1HG PRO 9 7.094 -0.315 0.853
69 HD2 PRO 9 2HD PRO 9 6.990 2.672 1.012
70 HD3 PRO 9 1HD PRO 9 7.534 1.621 -0.317
71 H ARG 10 H ARG 10 2.087 1.266 0.453
72 HA ARG 10 HA ARG 10 1.695 3.472 2.351
73 HB2 ARG 10 2HB ARG 10 0.498 3.155 -0.400
74 HB3 ARG 10 1HB ARG 10 0.037 4.395 0.750
75 HG2 ARG 10 2HG ARG 10 2.301 5.325 0.648
76 HG3 ARG 10 1HG ARG 10 2.761 4.068 -0.500
77 HD2 ARG 10 2HD ARG 10 2.238 6.149 -1.658
78 HD3 ARG 10 1HD ARG 10 1.075 4.891 -2.072
79 HE ARG 10 HE ARG 10 0.213 6.467 0.120
80 HH11 ARG 10 1HH1 ARG 10 0.401 6.480 -3.432
81 HH12 ARG 10 2HH1 ARG 10 -0.902 7.535 -3.642
82 HH21 ARG 10 1HH2 ARG 10 -1.627 7.965 -0.198
83 HH22 ARG 10 2HH2 ARG 10 -2.065 8.383 -1.780
84 H CYS 11 H CYS 11 -0.147 3.338 3.557
85 HA CYS 11 HA CYS 11 -1.730 0.917 3.241
86 HB2 CYS 11 2HB CYS 11 -1.415 2.798 5.579
87 HB3 CYS 11 1HB CYS 11 -2.541 1.446 5.566
88 H PHE 12 H PHE 12 -3.596 0.979 2.399
89 HA PHE 12 HA PHE 12 -4.886 3.532 1.820
90 HB2 PHE 12 2HB PHE 12 -5.167 0.759 0.639
91 HB3 PHE 12 1HB PHE 12 -6.205 2.097 0.178
92 HD1 PHE 12 1HD PHE 12 -5.395 3.872 -1.222
93 HD2 PHE 12 2HD PHE 12 -2.781 0.748 0.025
94 HE1 PHE 12 1HE PHE 12 -3.744 4.588 -2.895
95 HE2 PHE 12 2HE PHE 12 -1.131 1.463 -1.647
96 HZ PHE 12 HZ PHE 12 -1.611 3.384 -3.110
97 HA PRO 13 HA PRO 13 -8.124 2.907 4.709
98 HB2 PRO 13 2HB PRO 13 -10.315 3.925 3.577
99 HB3 PRO 13 1HB PRO 13 -8.919 4.940 3.958
100 HG2 PRO 13 2HG PRO 13 -9.714 3.728 1.338
101 HG3 PRO 13 1HG PRO 13 -9.165 5.377 1.682
102 HD2 PRO 13 2HD PRO 13 -7.546 3.455 0.688
103 HD3 PRO 13 1HD PRO 13 -6.955 4.768 1.719
104 H ASP 14 H ASP 14 -8.121 0.862 2.127
105 HA ASP 14 HA ASP 14 -10.649 -0.363 2.914
106 HB2 ASP 14 2HB ASP 14 -10.504 -1.715 0.896
107 HB3 ASP 14 1HB ASP 14 -10.314 -0.020 0.489
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -7.385 -0.294 3.801
2 HA2 GLY 1 2HA GLY 1 -6.505 -1.353 5.739
3 HA3 GLY 1 1HA GLY 1 -7.736 -2.602 5.558
4 H ARG 2 H ARG 2 -5.037 -1.227 3.718
5 HA ARG 2 HA ARG 2 -3.952 -3.838 3.231
6 HB2 ARG 2 2HB ARG 2 -5.827 -3.576 1.572
7 HB3 ARG 2 1HB ARG 2 -4.973 -2.197 0.915
8 HG2 ARG 2 2HG ARG 2 -3.109 -3.647 0.292
9 HG3 ARG 2 1HG ARG 2 -3.969 -5.033 0.970
10 HD2 ARG 2 2HD ARG 2 -4.824 -3.325 -1.363
11 HD3 ARG 2 1HD ARG 2 -4.308 -5.009 -1.412
12 HE ARG 2 HE ARG 2 -6.774 -4.048 -0.109
13 HH11 ARG 2 1HH1 ARG 2 -5.067 -6.566 -1.978
14 HH12 ARG 2 2HH1 ARG 2 -6.432 -7.575 -2.108
15 HH21 ARG 2 1HH2 ARG 2 -8.639 -5.483 -0.344
16 HH22 ARG 2 2HH2 ARG 2 -8.460 -6.964 -1.176
17 H CYS 3 H CYS 3 -1.814 -3.485 3.320
18 HA CYS 3 HA CYS 3 -0.793 -0.868 2.463
19 HB2 CYS 3 2HB CYS 3 0.478 -2.914 4.311
20 HB3 CYS 3 1HB CYS 3 1.225 -1.405 3.802
21 H THR 4 H THR 4 0.573 -0.770 0.796
22 HA THR 4 HA THR 4 0.696 -3.048 -0.857
23 HB THR 4 HB THR 4 1.995 -1.587 -2.400
24 HG1 THR 4 1HG THR 4 3.050 -0.097 -1.408
25 HG21 THR 4 1HG2 THR 4 0.182 -0.011 -2.833
26 HG22 THR 4 2HG2 THR 4 -0.471 -0.307 -1.222
27 HG23 THR 4 3HG2 THR 4 -0.465 -1.600 -2.420
28 H LYS 5 H LYS 5 2.240 -4.413 -1.238
29 HA LYS 5 HA LYS 5 4.576 -4.455 0.430
30 HB2 LYS 5 2HB LYS 5 5.076 -6.574 -0.877
31 HB3 LYS 5 1HB LYS 5 3.590 -6.573 0.060
32 HG2 LYS 5 2HG LYS 5 2.296 -6.158 -1.952
33 HG3 LYS 5 1HG LYS 5 3.778 -6.092 -2.910
34 HD2 LYS 5 2HD LYS 5 4.235 -8.388 -2.455
35 HD3 LYS 5 1HD LYS 5 2.909 -8.480 -1.296
36 HE2 LYS 5 2HE LYS 5 2.317 -9.502 -3.435
37 HE3 LYS 5 1HE LYS 5 1.301 -8.106 -3.083
38 HZ1 LYS 5 1HZ LYS 5 3.652 -8.082 -4.902
39 HZ2 LYS 5 2HZ LYS 5 2.580 -6.811 -4.677
40 HZ3 LYS 5 3HZ LYS 5 2.066 -8.227 -5.385
41 H SER 6 H SER 6 3.697 -3.432 -2.730
42 HA SER 6 HA SER 6 6.392 -3.249 -3.636
43 HB2 SER 6 2HB SER 6 5.215 -1.996 -5.536
44 HB3 SER 6 1HB SER 6 4.798 -3.696 -5.321
45 HG SER 6 HG SER 6 3.025 -2.219 -5.624
46 H ILE 7 H ILE 7 7.638 -1.506 -3.556
47 HA ILE 7 HA ILE 7 7.099 0.578 -1.692
48 HB ILE 7 HB ILE 7 9.318 0.257 -3.737
49 HG12 ILE 7 2HG1 ILE 7 9.294 -1.592 -2.158
50 HG13 ILE 7 1HG1 ILE 7 10.697 -0.571 -1.874
51 HG21 ILE 7 1HG2 ILE 7 10.642 1.826 -2.429
52 HG22 ILE 7 2HG2 ILE 7 9.290 2.074 -1.335
53 HG23 ILE 7 3HG2 ILE 7 9.162 2.587 -3.020
54 HD11 ILE 7 1HD1 ILE 7 9.719 -1.305 0.209
55 HD12 ILE 7 2HD1 ILE 7 8.159 -0.636 -0.254
56 HD13 ILE 7 3HD1 ILE 7 9.526 0.440 0.039
57 HA PRO 8 HA PRO 8 7.302 2.652 -1.193
58 HB2 PRO 8 2HB PRO 8 5.637 4.719 -0.707
59 HB3 PRO 8 1HB PRO 8 7.158 4.926 -1.580
60 HG2 PRO 8 2HG PRO 8 4.376 4.740 -2.644
61 HG3 PRO 8 1HG PRO 8 5.707 5.785 -3.165
62 HD2 PRO 8 2HD PRO 8 4.959 3.453 -4.432
63 HD3 PRO 8 1HD PRO 8 6.571 4.183 -4.543
64 HA PRO 9 HA PRO 9 3.926 0.261 0.513
65 HB2 PRO 9 2HB PRO 9 4.759 1.140 3.180
66 HB3 PRO 9 1HB PRO 9 4.802 -0.479 2.476
67 HG2 PRO 9 2HG PRO 9 7.043 0.943 2.967
68 HG3 PRO 9 1HG PRO 9 6.908 -0.193 1.613
69 HD2 PRO 9 2HD PRO 9 6.708 2.788 1.615
70 HD3 PRO 9 1HD PRO 9 7.509 1.697 0.458
71 H ARG 10 H ARG 10 2.092 1.294 0.038
72 HA ARG 10 HA ARG 10 1.287 3.596 1.660
73 HB2 ARG 10 2HB ARG 10 0.169 2.625 -0.967
74 HB3 ARG 10 1HB ARG 10 -0.310 4.080 -0.111
75 HG2 ARG 10 2HG ARG 10 1.982 4.957 -0.412
76 HG3 ARG 10 1HG ARG 10 2.363 3.528 -1.374
77 HD2 ARG 10 2HD ARG 10 1.803 5.318 -2.865
78 HD3 ARG 10 1HD ARG 10 0.497 4.138 -2.894
79 HE ARG 10 HE ARG 10 -0.026 6.118 -0.967
80 HH11 ARG 10 1HH1 ARG 10 -0.113 5.617 -4.479
81 HH12 ARG 10 2HH1 ARG 10 -1.274 6.839 -4.738
82 HH21 ARG 10 1HH2 ARG 10 -1.582 7.773 -1.346
83 HH22 ARG 10 2HH2 ARG 10 -2.109 8.101 -2.940
84 H CYS 11 H CYS 11 -0.522 3.397 2.904
85 HA CYS 11 HA CYS 11 -1.836 0.787 2.823
86 HB2 CYS 11 2HB CYS 11 -1.510 2.728 5.123
87 HB3 CYS 11 1HB CYS 11 -2.333 1.177 5.209
88 H PHE 12 H PHE 12 -3.772 0.864 2.024
89 HA PHE 12 HA PHE 12 -5.025 3.469 1.700
90 HB2 PHE 12 2HB PHE 12 -5.610 0.801 0.406
91 HB3 PHE 12 1HB PHE 12 -6.494 2.275 0.039
92 HD1 PHE 12 1HD PHE 12 -4.930 4.332 -0.604
93 HD2 PHE 12 2HD PHE 12 -3.848 0.229 -0.963
94 HE1 PHE 12 1HE PHE 12 -3.231 4.932 -2.277
95 HE2 PHE 12 2HE PHE 12 -2.149 0.825 -2.636
96 HZ PHE 12 HZ PHE 12 -1.835 3.173 -3.295
97 HA PRO 13 HA PRO 13 -8.198 3.196 4.713
98 HB2 PRO 13 2HB PRO 13 -10.499 3.708 3.261
99 HB3 PRO 13 1HB PRO 13 -9.388 4.936 3.872
100 HG2 PRO 13 2HG PRO 13 -9.525 3.694 1.152
101 HG3 PRO 13 1HG PRO 13 -9.293 5.395 1.595
102 HD2 PRO 13 2HD PRO 13 -7.223 3.942 0.834
103 HD3 PRO 13 1HD PRO 13 -7.063 5.052 2.208
104 H ASP 14 H ASP 14 -8.336 0.999 2.078
105 HA ASP 14 HA ASP 14 -10.666 -0.413 2.994
106 HB2 ASP 14 2HB ASP 14 -10.259 -1.957 1.240
107 HB3 ASP 14 1HB ASP 14 -9.884 -0.370 0.586
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -7.207 0.076 4.480
2 HA2 GLY 1 2HA GLY 1 -5.792 -0.977 6.069
3 HA3 GLY 1 1HA GLY 1 -7.050 -2.163 6.368
4 H ARG 2 H ARG 2 -5.520 -1.103 3.352
5 HA ARG 2 HA ARG 2 -4.409 -3.806 3.088
6 HB2 ARG 2 2HB ARG 2 -5.850 -2.273 0.919
7 HB3 ARG 2 1HB ARG 2 -4.925 -3.739 0.650
8 HG2 ARG 2 2HG ARG 2 -6.446 -4.977 2.087
9 HG3 ARG 2 1HG ARG 2 -7.353 -3.496 2.399
10 HD2 ARG 2 2HD ARG 2 -8.481 -4.808 0.719
11 HD3 ARG 2 1HD ARG 2 -7.857 -3.326 0.007
12 HE ARG 2 HE ARG 2 -5.930 -5.271 -0.363
13 HH11 ARG 2 1HH1 ARG 2 -9.259 -4.698 -1.410
14 HH12 ARG 2 2HH1 ARG 2 -9.061 -5.513 -2.896
15 HH21 ARG 2 1HH2 ARG 2 -5.676 -6.375 -2.325
16 HH22 ARG 2 2HH2 ARG 2 -6.960 -6.510 -3.451
17 H CYS 3 H CYS 3 -2.284 -3.650 2.889
18 HA CYS 3 HA CYS 3 -1.180 -1.254 1.576
19 HB2 CYS 3 2HB CYS 3 0.147 -3.020 3.649
20 HB3 CYS 3 1HB CYS 3 0.857 -1.601 2.893
21 H THR 4 H THR 4 0.005 -1.559 -0.200
22 HA THR 4 HA THR 4 0.446 -4.233 -1.169
23 HB THR 4 HB THR 4 1.400 -3.000 -3.147
24 HG1 THR 4 1HG THR 4 2.107 -1.080 -2.447
25 HG21 THR 4 1HG2 THR 4 -1.346 -2.100 -2.244
26 HG22 THR 4 2HG2 THR 4 -0.981 -3.603 -3.091
27 HG23 THR 4 3HG2 THR 4 -0.751 -2.054 -3.905
28 H LYS 5 H LYS 5 2.540 -5.147 -1.465
29 HA LYS 5 HA LYS 5 4.574 -3.969 0.221
30 HB2 LYS 5 2HB LYS 5 4.738 -6.483 -1.458
31 HB3 LYS 5 1HB LYS 5 5.932 -5.939 -0.292
32 HG2 LYS 5 2HG LYS 5 4.234 -6.182 1.492
33 HG3 LYS 5 1HG LYS 5 3.130 -6.839 0.280
34 HD2 LYS 5 2HD LYS 5 4.768 -8.623 -0.199
35 HD3 LYS 5 1HD LYS 5 5.796 -7.988 1.080
36 HE2 LYS 5 2HE LYS 5 4.513 -9.875 1.903
37 HE3 LYS 5 1HE LYS 5 4.014 -8.389 2.711
38 HZ1 LYS 5 1HZ LYS 5 2.133 -9.793 2.043
39 HZ2 LYS 5 2HZ LYS 5 2.576 -9.612 0.417
40 HZ3 LYS 5 3HZ LYS 5 2.089 -8.278 1.314
41 H SER 6 H SER 6 4.733 -2.113 -0.983
42 HA SER 6 HA SER 6 6.419 -2.364 -3.350
43 HB2 SER 6 2HB SER 6 5.217 -0.218 -4.063
44 HB3 SER 6 1HB SER 6 4.280 -1.711 -4.162
45 HG SER 6 HG SER 6 4.088 0.444 -2.387
46 H ILE 7 H ILE 7 7.427 -0.030 -3.706
47 HA ILE 7 HA ILE 7 8.193 1.054 -1.106
48 HB ILE 7 HB ILE 7 9.935 0.949 -3.607
49 HG12 ILE 7 2HG1 ILE 7 11.511 -0.424 -2.102
50 HG13 ILE 7 1HG1 ILE 7 10.133 -0.630 -1.032
51 HG21 ILE 7 1HG2 ILE 7 10.342 2.964 -2.373
52 HG22 ILE 7 2HG2 ILE 7 11.726 1.886 -2.205
53 HG23 ILE 7 3HG2 ILE 7 10.571 2.055 -0.881
54 HD11 ILE 7 1HD1 ILE 7 8.917 -1.715 -2.818
55 HD12 ILE 7 2HD1 ILE 7 10.435 -2.565 -2.471
56 HD13 ILE 7 3HD1 ILE 7 10.294 -1.515 -3.894
57 HA PRO 8 HA PRO 8 7.430 2.424 -0.050
58 HB2 PRO 8 2HB PRO 8 5.603 4.234 0.682
59 HB3 PRO 8 1HB PRO 8 7.273 4.711 0.356
60 HG2 PRO 8 2HG PRO 8 4.849 5.011 -1.359
61 HG3 PRO 8 1HG PRO 8 6.202 6.130 -1.124
62 HD2 PRO 8 2HD PRO 8 5.923 4.353 -3.272
63 HD3 PRO 8 1HD PRO 8 7.442 5.121 -2.773
64 HA PRO 9 HA PRO 9 3.734 -0.157 -0.142
65 HB2 PRO 9 2HB PRO 9 3.292 0.588 2.696
66 HB3 PRO 9 1HB PRO 9 3.525 -1.015 1.987
67 HG2 PRO 9 2HG PRO 9 5.463 0.094 3.420
68 HG3 PRO 9 1HG PRO 9 5.830 -0.798 1.931
69 HD2 PRO 9 2HD PRO 9 5.662 2.164 2.350
70 HD3 PRO 9 1HD PRO 9 6.886 1.210 1.483
71 H ARG 10 H ARG 10 1.763 0.375 -0.877
72 HA ARG 10 HA ARG 10 0.699 2.974 -0.121
73 HB2 ARG 10 2HB ARG 10 -0.131 1.080 -2.331
74 HB3 ARG 10 1HB ARG 10 -0.808 2.678 -2.048
75 HG2 ARG 10 2HG ARG 10 2.049 2.080 -2.813
76 HG3 ARG 10 1HG ARG 10 0.794 2.710 -3.882
77 HD2 ARG 10 2HD ARG 10 1.871 4.094 -1.417
78 HD3 ARG 10 1HD ARG 10 2.286 4.490 -3.079
79 HE ARG 10 HE ARG 10 -0.412 4.623 -3.020
80 HH11 ARG 10 1HH1 ARG 10 2.143 6.253 -1.116
81 HH12 ARG 10 2HH1 ARG 10 1.233 7.663 -0.901
82 HH21 ARG 10 1HH2 ARG 10 -1.616 6.571 -2.684
83 HH22 ARG 10 2HH2 ARG 10 -0.936 7.849 -1.786
84 H CYS 11 H CYS 11 -0.584 2.953 1.512
85 HA CYS 11 HA CYS 11 -2.099 0.531 2.086
86 HB2 CYS 11 2HB CYS 11 -1.317 2.829 3.872
87 HB3 CYS 11 1HB CYS 11 -2.315 1.462 4.359
88 H PHE 12 H PHE 12 -4.047 0.539 1.518
89 HA PHE 12 HA PHE 12 -5.518 2.933 0.932
90 HB2 PHE 12 2HB PHE 12 -6.317 0.011 0.883
91 HB3 PHE 12 1HB PHE 12 -7.331 1.333 0.321
92 HD1 PHE 12 1HD PHE 12 -6.875 2.455 -1.760
93 HD2 PHE 12 2HD PHE 12 -4.340 -0.681 -0.386
94 HE1 PHE 12 1HE PHE 12 -5.843 2.306 -3.987
95 HE2 PHE 12 2HE PHE 12 -3.311 -0.828 -2.610
96 HZ PHE 12 HZ PHE 12 -4.061 0.668 -4.412
97 HA PRO 13 HA PRO 13 -7.347 3.841 4.874
98 HB2 PRO 13 2HB PRO 13 -9.870 3.855 3.279
99 HB3 PRO 13 1HB PRO 13 -9.279 5.034 4.452
100 HG2 PRO 13 2HG PRO 13 -9.070 5.488 1.832
101 HG3 PRO 13 1HG PRO 13 -7.798 5.988 2.956
102 HD2 PRO 13 2HD PRO 13 -7.790 3.797 0.965
103 HD3 PRO 13 1HD PRO 13 -6.440 4.704 1.664
104 H ASP 14 H ASP 14 -8.889 1.336 2.916
105 HA ASP 14 HA ASP 14 -10.390 0.334 5.153
106 HB2 ASP 14 2HB ASP 14 -11.204 -1.436 3.707
107 HB3 ASP 14 1HB ASP 14 -11.299 0.108 2.875
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -7.531 -0.400 3.915
2 HA2 GLY 1 2HA GLY 1 -6.401 -1.786 5.404
3 HA3 GLY 1 1HA GLY 1 -7.549 -3.076 5.053
4 H ARG 2 H ARG 2 -5.394 -1.068 3.155
5 HA ARG 2 HA ARG 2 -4.195 -3.497 2.082
6 HB2 ARG 2 2HB ARG 2 -5.906 -2.815 0.479
7 HB3 ARG 2 1HB ARG 2 -5.230 -1.199 0.425
8 HG2 ARG 2 2HG ARG 2 -4.582 -2.443 -1.542
9 HG3 ARG 2 1HG ARG 2 -3.164 -2.102 -0.552
10 HD2 ARG 2 2HD ARG 2 -3.130 -4.391 -1.415
11 HD3 ARG 2 1HD ARG 2 -3.234 -4.372 0.343
12 HE ARG 2 HE ARG 2 -5.807 -4.480 -0.796
13 HH11 ARG 2 1HH1 ARG 2 -2.981 -6.536 -0.192
14 HH12 ARG 2 2HH1 ARG 2 -3.836 -7.992 -0.235
15 HH21 ARG 2 1HH2 ARG 2 -7.024 -6.474 -0.755
16 HH22 ARG 2 2HH2 ARG 2 -6.228 -7.955 -0.517
17 H CYS 3 H CYS 3 -2.214 -3.242 2.848
18 HA CYS 3 HA CYS 3 -0.883 -0.702 2.320
19 HB2 CYS 3 2HB CYS 3 -0.064 -3.035 4.072
20 HB3 CYS 3 1HB CYS 3 0.857 -1.548 3.865
21 H THR 4 H THR 4 0.628 -0.669 0.764
22 HA THR 4 HA THR 4 0.846 -3.015 -0.824
23 HB THR 4 HB THR 4 2.314 -1.468 -2.231
24 HG1 THR 4 1HG THR 4 2.612 0.500 -1.549
25 HG21 THR 4 1HG2 THR 4 -0.032 -1.948 -2.760
26 HG22 THR 4 2HG2 THR 4 0.336 -0.257 -3.098
27 HG23 THR 4 3HG2 THR 4 -0.550 -0.693 -1.638
28 H LYS 5 H LYS 5 2.427 -4.446 -0.781
29 HA LYS 5 HA LYS 5 4.631 -4.036 1.034
30 HB2 LYS 5 2HB LYS 5 5.266 -6.332 0.577
31 HB3 LYS 5 1HB LYS 5 3.541 -6.261 0.842
32 HG2 LYS 5 2HG LYS 5 3.120 -6.458 -1.531
33 HG3 LYS 5 1HG LYS 5 4.854 -6.417 -1.863
34 HD2 LYS 5 2HD LYS 5 5.121 -8.471 -0.495
35 HD3 LYS 5 1HD LYS 5 3.371 -8.527 -0.290
36 HE2 LYS 5 2HE LYS 5 4.063 -10.045 -2.058
37 HE3 LYS 5 1HE LYS 5 3.107 -8.721 -2.721
38 HZ1 LYS 5 1HZ LYS 5 5.157 -7.655 -3.440
39 HZ2 LYS 5 2HZ LYS 5 5.032 -9.181 -4.097
40 HZ3 LYS 5 3HZ LYS 5 6.073 -8.908 -2.803
41 H SER 6 H SER 6 3.969 -3.623 -2.257
42 HA SER 6 HA SER 6 6.690 -3.537 -3.094
43 HB2 SER 6 2HB SER 6 5.482 -2.734 -5.213
44 HB3 SER 6 1HB SER 6 5.172 -4.386 -4.682
45 HG SER 6 HG SER 6 3.534 -2.129 -4.611
46 H ILE 7 H ILE 7 7.716 -1.586 -3.670
47 HA ILE 7 HA ILE 7 6.899 0.604 -2.064
48 HB ILE 7 HB ILE 7 8.840 1.836 -2.783
49 HG12 ILE 7 2HG1 ILE 7 8.837 1.225 -5.225
50 HG13 ILE 7 1HG1 ILE 7 10.425 1.148 -4.488
51 HG21 ILE 7 1HG2 ILE 7 10.635 0.303 -2.133
52 HG22 ILE 7 2HG2 ILE 7 9.504 -1.040 -2.292
53 HG23 ILE 7 3HG2 ILE 7 9.218 0.214 -1.086
54 HD11 ILE 7 1HD1 ILE 7 10.208 -1.304 -4.379
55 HD12 ILE 7 2HD1 ILE 7 10.111 -0.672 -6.021
56 HD13 ILE 7 3HD1 ILE 7 8.643 -1.176 -5.188
57 HA PRO 8 HA PRO 8 7.068 2.684 -1.813
58 HB2 PRO 8 2HB PRO 8 4.877 4.589 -1.759
59 HB3 PRO 8 1HB PRO 8 6.610 4.907 -1.864
60 HG2 PRO 8 2HG PRO 8 4.903 5.401 -3.920
61 HG3 PRO 8 1HG PRO 8 6.601 4.954 -4.155
62 HD2 PRO 8 2HD PRO 8 4.156 3.220 -4.304
63 HD3 PRO 8 1HD PRO 8 5.539 3.306 -5.421
64 HA PRO 9 HA PRO 9 3.964 0.259 0.422
65 HB2 PRO 9 2HB PRO 9 5.352 1.033 2.884
66 HB3 PRO 9 1HB PRO 9 5.200 -0.568 2.157
67 HG2 PRO 9 2HG PRO 9 7.541 0.771 2.213
68 HG3 PRO 9 1HG PRO 9 7.098 -0.319 0.888
69 HD2 PRO 9 2HD PRO 9 6.991 2.668 1.002
70 HD3 PRO 9 1HD PRO 9 7.536 1.591 -0.307
71 H ARG 10 H ARG 10 2.097 1.320 0.427
72 HA ARG 10 HA ARG 10 1.712 3.469 2.396
73 HB2 ARG 10 2HB ARG 10 0.585 3.296 -0.403
74 HB3 ARG 10 1HB ARG 10 0.130 4.500 0.794
75 HG2 ARG 10 2HG ARG 10 2.361 5.405 0.804
76 HG3 ARG 10 1HG ARG 10 2.916 4.128 -0.277
77 HD2 ARG 10 2HD ARG 10 1.429 4.943 -2.007
78 HD3 ARG 10 1HD ARG 10 0.842 6.204 -0.924
79 HE ARG 10 HE ARG 10 3.411 6.743 -0.896
80 HH11 ARG 10 1HH1 ARG 10 1.361 5.948 -3.653
81 HH12 ARG 10 2HH1 ARG 10 2.262 6.834 -4.782
82 HH21 ARG 10 1HH2 ARG 10 4.685 7.969 -2.447
83 HH22 ARG 10 2HH2 ARG 10 4.218 7.996 -4.075
84 H CYS 11 H CYS 11 -0.451 3.551 3.274
85 HA CYS 11 HA CYS 11 -1.855 1.003 2.959
86 HB2 CYS 11 2HB CYS 11 -1.538 2.683 5.441
87 HB3 CYS 11 1HB CYS 11 -2.589 1.277 5.323
88 H PHE 12 H PHE 12 -3.730 1.081 2.194
89 HA PHE 12 HA PHE 12 -5.172 3.598 1.956
90 HB2 PHE 12 2HB PHE 12 -5.571 0.904 0.624
91 HB3 PHE 12 1HB PHE 12 -6.510 2.348 0.275
92 HD1 PHE 12 1HD PHE 12 -5.598 4.148 -1.019
93 HD2 PHE 12 2HD PHE 12 -3.230 0.732 -0.104
94 HE1 PHE 12 1HE PHE 12 -3.943 4.842 -2.701
95 HE2 PHE 12 2HE PHE 12 -1.576 1.423 -1.783
96 HZ PHE 12 HZ PHE 12 -1.931 3.482 -3.084
97 HA PRO 13 HA PRO 13 -8.097 2.819 5.139
98 HB2 PRO 13 2HB PRO 13 -10.491 3.478 3.928
99 HB3 PRO 13 1HB PRO 13 -9.349 4.629 4.624
100 HG2 PRO 13 2HG PRO 13 -9.718 3.803 1.778
101 HG3 PRO 13 1HG PRO 13 -9.387 5.411 2.445
102 HD2 PRO 13 2HD PRO 13 -7.457 3.965 1.287
103 HD3 PRO 13 1HD PRO 13 -7.124 4.977 2.706
104 H ASP 14 H ASP 14 -8.562 1.063 2.190
105 HA ASP 14 HA ASP 14 -10.710 -0.569 3.231
106 HB2 ASP 14 2HB ASP 14 -10.580 -1.839 1.197
107 HB3 ASP 14 1HB ASP 14 -10.400 -0.143 0.770
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -7.270 -0.473 4.064
2 HA2 GLY 1 2HA GLY 1 -6.178 -1.937 5.644
3 HA3 GLY 1 1HA GLY 1 -7.397 -3.145 5.285
4 H ARG 2 H ARG 2 -5.492 -1.204 3.034
5 HA ARG 2 HA ARG 2 -4.149 -3.670 2.198
6 HB2 ARG 2 2HB ARG 2 -5.435 -1.653 0.361
7 HB3 ARG 2 1HB ARG 2 -4.240 -2.814 -0.177
8 HG2 ARG 2 2HG ARG 2 -5.749 -4.634 0.510
9 HG3 ARG 2 1HG ARG 2 -6.944 -3.415 0.971
10 HD2 ARG 2 2HD ARG 2 -7.393 -4.319 -1.273
11 HD3 ARG 2 1HD ARG 2 -7.031 -2.593 -1.312
12 HE ARG 2 HE ARG 2 -4.728 -4.237 -1.717
13 HH11 ARG 2 1HH1 ARG 2 -7.521 -2.895 -3.438
14 HH12 ARG 2 2HH1 ARG 2 -6.717 -2.767 -4.931
15 HH21 ARG 2 1HH2 ARG 2 -3.624 -4.045 -3.754
16 HH22 ARG 2 2HH2 ARG 2 -4.435 -3.411 -5.112
17 H CYS 3 H CYS 3 -2.083 -3.291 2.750
18 HA CYS 3 HA CYS 3 -0.974 -0.709 1.920
19 HB2 CYS 3 2HB CYS 3 0.220 -2.753 3.835
20 HB3 CYS 3 1HB CYS 3 0.928 -1.212 3.397
21 H THR 4 H THR 4 0.524 -0.698 0.328
22 HA THR 4 HA THR 4 0.751 -3.013 -1.246
23 HB THR 4 HB THR 4 2.406 -1.622 -2.544
24 HG1 THR 4 1HG THR 4 3.285 -0.081 -1.480
25 HG21 THR 4 1HG2 THR 4 -0.203 -0.266 -1.846
26 HG22 THR 4 2HG2 THR 4 0.016 -1.519 -3.070
27 HG23 THR 4 3HG2 THR 4 0.768 0.062 -3.280
28 H LYS 5 H LYS 5 2.318 -4.540 -1.300
29 HA LYS 5 HA LYS 5 4.366 -4.424 0.732
30 HB2 LYS 5 2HB LYS 5 3.527 -6.595 -1.205
31 HB3 LYS 5 1HB LYS 5 4.982 -6.739 -0.238
32 HG2 LYS 5 2HG LYS 5 3.237 -7.970 0.849
33 HG3 LYS 5 1HG LYS 5 3.568 -6.537 1.810
34 HD2 LYS 5 2HD LYS 5 1.591 -5.443 0.791
35 HD3 LYS 5 1HD LYS 5 1.257 -6.930 -0.096
36 HE2 LYS 5 2HE LYS 5 -0.147 -6.813 1.888
37 HE3 LYS 5 1HE LYS 5 1.011 -8.130 2.042
38 HZ1 LYS 5 1HZ LYS 5 1.322 -5.447 3.285
39 HZ2 LYS 5 2HZ LYS 5 2.340 -6.774 3.531
40 HZ3 LYS 5 3HZ LYS 5 0.751 -6.812 4.076
41 H SER 6 H SER 6 3.923 -3.569 -2.420
42 HA SER 6 HA SER 6 6.670 -3.498 -3.184
43 HB2 SER 6 2HB SER 6 5.403 -2.150 -5.075
44 HB3 SER 6 1HB SER 6 5.245 -3.906 -4.981
45 HG SER 6 HG SER 6 3.306 -2.175 -4.928
46 H ILE 7 H ILE 7 7.823 -1.468 -3.310
47 HA ILE 7 HA ILE 7 6.773 0.495 -1.437
48 HB ILE 7 HB ILE 7 9.052 1.499 -1.447
49 HG12 ILE 7 2HG1 ILE 7 9.777 -0.857 -3.218
50 HG13 ILE 7 1HG1 ILE 7 9.723 0.827 -3.726
51 HG21 ILE 7 1HG2 ILE 7 8.476 -0.137 0.239
52 HG22 ILE 7 2HG2 ILE 7 10.166 -0.325 -0.228
53 HG23 ILE 7 3HG2 ILE 7 8.953 -1.450 -0.837
54 HD11 ILE 7 1HD1 ILE 7 12.001 0.086 -3.337
55 HD12 ILE 7 2HD1 ILE 7 11.590 -0.344 -1.676
56 HD13 ILE 7 3HD1 ILE 7 11.542 1.343 -2.188
57 HA PRO 8 HA PRO 8 7.286 2.693 -0.884
58 HB2 PRO 8 2HB PRO 8 5.215 4.689 -1.175
59 HB3 PRO 8 1HB PRO 8 6.930 4.924 -0.836
60 HG2 PRO 8 2HG PRO 8 5.735 5.672 -3.179
61 HG3 PRO 8 1HG PRO 8 7.449 5.255 -3.036
62 HD2 PRO 8 2HD PRO 8 5.170 3.595 -4.033
63 HD3 PRO 8 1HD PRO 8 6.828 3.725 -4.657
64 HA PRO 9 HA PRO 9 3.731 0.443 0.561
65 HB2 PRO 9 2HB PRO 9 3.850 1.042 3.203
66 HB3 PRO 9 1HB PRO 9 4.971 -0.088 2.439
67 HG2 PRO 9 2HG PRO 9 5.357 2.794 3.130
68 HG3 PRO 9 1HG PRO 9 6.483 1.439 3.330
69 HD2 PRO 9 2HD PRO 9 6.664 3.209 1.286
70 HD3 PRO 9 1HD PRO 9 7.140 1.507 1.119
71 H ARG 10 H ARG 10 2.015 1.494 -0.317
72 HA ARG 10 HA ARG 10 0.977 3.861 1.069
73 HB2 ARG 10 2HB ARG 10 1.158 3.853 -1.430
74 HB3 ARG 10 1HB ARG 10 0.011 2.528 -1.465
75 HG2 ARG 10 2HG ARG 10 -1.268 4.427 -1.967
76 HG3 ARG 10 1HG ARG 10 -1.605 4.103 -0.273
77 HD2 ARG 10 2HD ARG 10 0.442 6.118 -1.215
78 HD3 ARG 10 1HD ARG 10 -1.228 6.529 -0.883
79 HE ARG 10 HE ARG 10 -0.377 5.399 1.439
80 HH11 ARG 10 1HH1 ARG 10 0.947 8.020 -0.572
81 HH12 ARG 10 2HH1 ARG 10 1.530 8.907 0.751
82 HH21 ARG 10 1HH2 ARG 10 0.459 6.665 3.245
83 HH22 ARG 10 2HH2 ARG 10 1.277 8.123 2.929
84 H CYS 11 H CYS 11 -0.422 3.438 2.652
85 HA CYS 11 HA CYS 11 -1.890 0.949 2.580
86 HB2 CYS 11 2HB CYS 11 -1.466 2.973 4.776
87 HB3 CYS 11 1HB CYS 11 -2.484 1.551 4.933
88 H PHE 12 H PHE 12 -3.748 0.928 1.774
89 HA PHE 12 HA PHE 12 -5.316 3.330 1.459
90 HB2 PHE 12 2HB PHE 12 -5.852 0.463 0.608
91 HB3 PHE 12 1HB PHE 12 -6.810 1.861 0.139
92 HD1 PHE 12 1HD PHE 12 -3.764 -0.037 -0.470
93 HD2 PHE 12 2HD PHE 12 -5.877 3.539 -1.418
94 HE1 PHE 12 1HE PHE 12 -2.308 0.302 -2.423
95 HE2 PHE 12 2HE PHE 12 -4.420 3.880 -3.370
96 HZ PHE 12 HZ PHE 12 -2.634 2.265 -3.876
97 HA PRO 13 HA PRO 13 -7.350 2.958 5.290
98 HB2 PRO 13 2HB PRO 13 -9.857 3.886 4.616
99 HB3 PRO 13 1HB PRO 13 -8.449 4.899 4.946
100 HG2 PRO 13 2HG PRO 13 -9.567 3.994 2.331
101 HG3 PRO 13 1HG PRO 13 -8.937 5.584 2.782
102 HD2 PRO 13 2HD PRO 13 -7.467 3.897 1.337
103 HD3 PRO 13 1HD PRO 13 -6.719 4.900 2.597
104 H ASP 14 H ASP 14 -8.525 1.065 2.707
105 HA ASP 14 HA ASP 14 -10.561 -0.220 4.318
106 HB2 ASP 14 2HB ASP 14 -10.981 -1.654 2.381
107 HB3 ASP 14 1HB ASP 14 -10.985 0.044 1.923