Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
27130 | 2p5h RC | 7389 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 HA VAL 1 HA VAL 1 1.395 0.055 -2.064
2 HB VAL 1 HB VAL 1 2.447 2.110 -1.192
3 H1 VAL 1 1H VAL 1 1.807 0.001 0.856
4 HG11 VAL 1 1HG1 VAL 1 4.981 0.712 -0.588
5 HG12 VAL 1 2HG1 VAL 1 4.282 2.162 0.135
6 HG13 VAL 1 3HG1 VAL 1 3.693 0.568 0.608
7 HG21 VAL 1 3HG2 VAL 1 4.388 0.447 -2.792
8 HG22 VAL 1 1HG2 VAL 1 2.954 1.228 -3.459
9 HG23 VAL 1 2HG2 VAL 1 4.253 2.206 -2.776
10 H ASP 2 H ASP 2 2.647 -1.273 -3.359
11 HA ASP 2 HA ASP 2 3.990 -3.468 -1.938
12 HB2 ASP 2 1HB ASP 2 3.668 -4.733 -4.076
13 HB3 ASP 2 2HB ASP 2 2.165 -4.247 -3.297
14 H ILE 3 H ILE 3 6.109 -3.085 -1.784
15 HA ILE 3 HA ILE 3 7.510 -1.979 -4.124
16 HB ILE 3 HB ILE 3 9.364 -1.481 -2.524
17 HG12 ILE 3 1HG1 ILE 3 7.404 -1.848 -0.288
18 HG13 ILE 3 2HG1 ILE 3 8.338 -3.230 -0.850
19 HG21 ILE 3 1HG2 ILE 3 6.651 -0.250 -2.251
20 HG22 ILE 3 2HG2 ILE 3 8.008 0.353 -1.302
21 HG23 ILE 3 3HG2 ILE 3 8.086 0.376 -3.063
22 HD11 ILE 3 3HD1 ILE 3 9.200 -0.830 0.636
23 HD12 ILE 3 1HD1 ILE 3 9.738 -2.504 0.765
24 HD13 ILE 3 2HD1 ILE 3 10.326 -1.488 -0.551
25 H HIS 4 H HIS 4 6.727 -4.778 -3.814
26 HA HIS 4 HA HIS 4 9.390 -5.954 -4.123
27 HD1 HIS 4 HD1 HIS 4 10.044 -8.147 -4.474
28 HD2 HIS 4 HD2 HIS 4 9.504 -8.430 -0.364
29 HE1 HIS 4 HE1 HIS 4 11.827 -9.727 -3.669
30 HB2 HIS 4 1HB HIS 4 8.201 -6.362 -1.792
31 HB3 HIS 4 2HB HIS 4 7.322 -7.582 -2.710
32 H VAL 5 H VAL 5 9.506 -6.935 -6.023
33 HA VAL 5 HA VAL 5 7.263 -7.321 -7.699
34 HB VAL 5 HB VAL 5 8.773 -8.364 -9.263
35 HG11 VAL 5 1HG1 VAL 5 10.499 -6.287 -7.989
36 HG12 VAL 5 2HG1 VAL 5 10.114 -6.539 -9.693
37 HG13 VAL 5 3HG1 VAL 5 8.911 -5.839 -8.610
38 HG21 VAL 5 3HG2 VAL 5 10.460 -8.754 -6.837
39 HG22 VAL 5 1HG2 VAL 5 10.093 -9.875 -8.148
40 HG23 VAL 5 2HG2 VAL 5 11.247 -8.566 -8.404
41 H TRP 6 H TRP 6 7.424 -9.708 -8.902
42 HA TRP 6 HA TRP 6 6.196 -11.455 -6.980
43 HD1 TRP 6 HD1 TRP 6 3.793 -13.569 -8.832
44 HE1 TRP 6 HE1 TRP 6 1.581 -12.256 -8.933
45 HE3 TRP 6 HE3 TRP 6 5.676 -8.851 -9.402
46 HZ2 TRP 6 HZ2 TRP 6 0.746 -9.575 -9.216
47 HZ3 TRP 6 HZ3 TRP 6 4.103 -6.967 -9.581
48 HH2 TRP 6 HH2 TRP 6 1.690 -7.323 -9.490
49 HB2 TRP 6 1HB TRP 6 6.607 -11.470 -9.934
50 HB3 TRP 6 2HB TRP 6 6.273 -13.006 -9.138
51 H ASP 7 H ASP 7 7.404 -12.596 -5.617
52 HA ASP 7 HA ASP 7 10.105 -13.191 -5.875
53 HB2 ASP 7 1HB ASP 7 8.492 -13.374 -3.825
54 HB3 ASP 7 2HB ASP 7 8.276 -15.034 -4.375
55 H GLY 8 H GLY 8 11.222 -14.625 -7.031
56 HA2 GLY 8 1HA GLY 8 11.717 -16.604 -8.138
57 HA3 GLY 8 2HA GLY 8 10.101 -17.183 -7.762
58 H VAL 9 H VAL 9 10.358 -14.085 -9.234
59 HA VAL 9 HA VAL 9 9.820 -15.221 -11.889
60 HB VAL 9 HB VAL 9 8.181 -13.033 -10.602
61 HG11 VAL 9 1HG1 VAL 9 8.190 -14.204 -13.370
62 HG12 VAL 9 2HG1 VAL 9 6.790 -13.358 -12.708
63 HG13 VAL 9 3HG1 VAL 9 8.326 -12.512 -12.892
64 HG21 VAL 9 3HG2 VAL 9 7.511 -15.888 -11.300
65 HG22 VAL 9 1HG2 VAL 9 7.557 -15.163 -9.693
66 HG23 VAL 9 2HG2 VAL 9 6.319 -14.670 -10.848
Start of MODEL 2
1 HA VAL 1 HA VAL 1 2.509 -0.030 -3.430
2 HB VAL 1 HB VAL 1 4.252 -0.541 -1.762
3 H1 VAL 1 1H VAL 1 0.657 -1.063 -1.769
4 HG11 VAL 1 1HG1 VAL 1 2.556 1.292 -1.463
5 HG12 VAL 1 2HG1 VAL 1 1.678 0.204 -0.387
6 HG13 VAL 1 3HG1 VAL 1 3.315 0.719 0.022
7 HG21 VAL 1 3HG2 VAL 1 4.117 -2.466 -0.650
8 HG22 VAL 1 1HG2 VAL 1 2.836 -1.736 0.318
9 HG23 VAL 1 2HG2 VAL 1 2.430 -2.686 -1.111
10 H ASP 2 H ASP 2 4.453 -0.731 -4.415
11 HA ASP 2 HA ASP 2 4.501 -3.607 -5.063
12 HB2 ASP 2 1HB ASP 2 5.536 -2.874 -7.256
13 HB3 ASP 2 2HB ASP 2 3.836 -2.467 -7.043
14 H ILE 3 H ILE 3 5.869 -2.603 -2.859
15 HA ILE 3 HA ILE 3 8.661 -2.377 -3.718
16 HB ILE 3 HB ILE 3 9.140 -1.827 -1.355
17 HG12 ILE 3 1HG1 ILE 3 6.179 -1.618 -0.891
18 HG13 ILE 3 2HG1 ILE 3 7.022 -3.133 -0.590
19 HG21 ILE 3 1HG2 ILE 3 7.079 -0.204 -2.821
20 HG22 ILE 3 2HG2 ILE 3 7.860 0.362 -1.345
21 HG23 ILE 3 3HG2 ILE 3 8.828 0.023 -2.780
22 HD11 ILE 3 3HD1 ILE 3 7.991 -2.367 1.279
23 HD12 ILE 3 1HD1 ILE 3 8.251 -0.755 0.614
24 HD13 ILE 3 2HD1 ILE 3 6.667 -1.203 1.249
25 H HIS 4 H HIS 4 7.258 -4.887 -3.956
26 HA HIS 4 HA HIS 4 9.193 -6.600 -2.799
27 HD1 HIS 4 HD1 HIS 4 8.212 -9.448 -2.331
28 HD2 HIS 4 HD2 HIS 4 8.671 -7.278 1.182
29 HE1 HIS 4 HE1 HIS 4 9.411 -10.985 -0.743
30 HB2 HIS 4 1HB HIS 4 7.508 -5.994 -0.880
31 HB3 HIS 4 2HB HIS 4 6.466 -7.159 -1.692
32 H VAL 5 H VAL 5 9.263 -8.524 -3.854
33 HA VAL 5 HA VAL 5 7.016 -9.146 -5.658
34 HB VAL 5 HB VAL 5 8.660 -10.049 -7.269
35 HG11 VAL 5 1HG1 VAL 5 8.293 -7.254 -6.575
36 HG12 VAL 5 2HG1 VAL 5 9.798 -7.537 -7.453
37 HG13 VAL 5 3HG1 VAL 5 8.259 -8.041 -8.153
38 HG21 VAL 5 3HG2 VAL 5 10.666 -8.880 -5.347
39 HG22 VAL 5 1HG2 VAL 5 10.496 -10.570 -5.821
40 HG23 VAL 5 2HG2 VAL 5 11.046 -9.375 -6.996
41 H TRP 6 H TRP 6 7.416 -11.515 -6.558
42 HA TRP 6 HA TRP 6 8.327 -13.282 -4.411
43 HD1 TRP 6 HD1 TRP 6 6.310 -16.470 -4.953
44 HE1 TRP 6 HE1 TRP 6 6.246 -17.623 -2.652
45 HE3 TRP 6 HE3 TRP 6 6.122 -12.322 -1.970
46 HZ2 TRP 6 HZ2 TRP 6 6.131 -16.874 0.067
47 HZ3 TRP 6 HZ3 TRP 6 6.037 -12.627 0.470
48 HH2 TRP 6 HH2 TRP 6 6.041 -14.856 1.465
49 HB2 TRP 6 1HB TRP 6 5.727 -12.722 -4.456
50 HB3 TRP 6 2HB TRP 6 5.728 -13.963 -5.707
51 H ASP 7 H ASP 7 9.787 -14.544 -5.346
52 HA ASP 7 HA ASP 7 10.801 -15.973 -6.797
53 HB2 ASP 7 1HB ASP 7 8.519 -17.092 -6.613
54 HB3 ASP 7 2HB ASP 7 8.121 -16.312 -8.141
55 H GLY 8 H GLY 8 10.427 -13.086 -7.419
56 HA2 GLY 8 1HA GLY 8 11.325 -11.767 -9.105
57 HA3 GLY 8 2HA GLY 8 11.458 -13.199 -10.114
58 H VAL 9 H VAL 9 8.401 -12.606 -8.666
59 HA VAL 9 HA VAL 9 7.281 -12.027 -11.298
60 HB VAL 9 HB VAL 9 5.893 -12.677 -8.694
61 HG11 VAL 9 1HG1 VAL 9 4.252 -11.555 -9.835
62 HG12 VAL 9 2HG1 VAL 9 4.897 -11.996 -11.418
63 HG13 VAL 9 3HG1 VAL 9 4.015 -13.187 -10.461
64 HG21 VAL 9 3HG2 VAL 9 5.680 -14.576 -10.896
65 HG22 VAL 9 1HG2 VAL 9 7.332 -14.366 -10.316
66 HG23 VAL 9 2HG2 VAL 9 6.059 -14.851 -9.196
Start of MODEL 3
1 HA VAL 1 HA VAL 1 0.615 -0.163 -0.629
2 HB VAL 1 HB VAL 1 1.483 -0.300 -2.947
3 H1 VAL 1 1H VAL 1 1.973 2.361 -0.119
4 HG11 VAL 1 1HG1 VAL 1 -0.703 1.325 -1.996
5 HG12 VAL 1 2HG1 VAL 1 -0.114 1.901 -3.557
6 HG13 VAL 1 3HG1 VAL 1 -0.636 0.226 -3.373
7 HG21 VAL 1 3HG2 VAL 1 1.803 2.636 -3.108
8 HG22 VAL 1 1HG2 VAL 1 3.104 1.738 -2.326
9 HG23 VAL 1 2HG2 VAL 1 2.638 1.353 -3.983
10 H ASP 2 H ASP 2 2.335 -1.711 -1.718
11 HA ASP 2 HA ASP 2 4.834 -1.376 -0.194
12 HB2 ASP 2 1HB ASP 2 3.154 -3.323 0.298
13 HB3 ASP 2 2HB ASP 2 3.859 -4.046 -1.145
14 H ILE 3 H ILE 3 6.714 -2.602 -1.160
15 HA ILE 3 HA ILE 3 6.804 -2.029 -4.035
16 HB ILE 3 HB ILE 3 9.266 -2.138 -3.781
17 HG12 ILE 3 1HG1 ILE 3 8.963 -2.044 -0.812
18 HG13 ILE 3 2HG1 ILE 3 8.906 -3.614 -1.605
19 HG21 ILE 3 1HG2 ILE 3 7.484 -0.173 -2.614
20 HG22 ILE 3 2HG2 ILE 3 9.082 -0.144 -1.870
21 HG23 ILE 3 3HG2 ILE 3 8.918 0.056 -3.615
22 HD11 ILE 3 3HD1 ILE 3 11.157 -1.622 -1.704
23 HD12 ILE 3 1HD1 ILE 3 11.141 -3.174 -0.866
24 HD13 ILE 3 2HD1 ILE 3 11.100 -3.122 -2.629
25 H HIS 4 H HIS 4 5.477 -4.368 -3.282
26 HA HIS 4 HA HIS 4 6.956 -6.703 -3.171
27 HD1 HIS 4 HD1 HIS 4 6.176 -8.945 -5.161
28 HD2 HIS 4 HD2 HIS 4 3.601 -8.581 -1.921
29 HE1 HIS 4 HE1 HIS 4 5.790 -11.291 -4.342
30 HB2 HIS 4 1HB HIS 4 4.371 -6.290 -3.104
31 HB3 HIS 4 2HB HIS 4 4.466 -6.586 -4.837
32 H VAL 5 H VAL 5 8.222 -7.779 -4.545
33 HA VAL 5 HA VAL 5 8.372 -6.815 -7.320
34 HB VAL 5 HB VAL 5 10.619 -7.707 -7.409
35 HG11 VAL 5 1HG1 VAL 5 11.711 -6.212 -5.887
36 HG12 VAL 5 2HG1 VAL 5 10.221 -5.445 -6.439
37 HG13 VAL 5 3HG1 VAL 5 10.297 -6.173 -4.834
38 HG21 VAL 5 3HG2 VAL 5 9.975 -8.786 -4.677
39 HG22 VAL 5 1HG2 VAL 5 10.514 -9.667 -6.107
40 HG23 VAL 5 2HG2 VAL 5 11.631 -8.601 -5.256
41 H TRP 6 H TRP 6 9.533 -8.784 -8.655
42 HA TRP 6 HA TRP 6 7.449 -10.651 -9.068
43 HD1 TRP 6 HD1 TRP 6 7.794 -12.000 -12.408
44 HE1 TRP 6 HE1 TRP 6 6.657 -10.351 -14.025
45 HE3 TRP 6 HE3 TRP 6 9.191 -7.605 -10.201
46 HZ2 TRP 6 HZ2 TRP 6 6.389 -7.557 -14.326
47 HZ3 TRP 6 HZ3 TRP 6 8.453 -5.489 -11.217
48 HH2 TRP 6 HH2 TRP 6 7.081 -5.467 -13.236
49 HB2 TRP 6 1HB TRP 6 10.167 -10.199 -10.194
50 HB3 TRP 6 2HB TRP 6 9.441 -11.785 -10.441
51 H ASP 7 H ASP 7 7.316 -12.838 -8.624
52 HA ASP 7 HA ASP 7 8.260 -13.751 -6.184
53 HB2 ASP 7 1HB ASP 7 6.352 -14.686 -7.600
54 HB3 ASP 7 2HB ASP 7 7.584 -15.582 -8.483
55 H GLY 8 H GLY 8 9.692 -14.002 -9.378
56 HA2 GLY 8 1HA GLY 8 12.060 -14.155 -9.656
57 HA3 GLY 8 2HA GLY 8 12.155 -14.988 -8.112
58 H VAL 9 H VAL 9 9.679 -16.548 -9.172
59 HA VAL 9 HA VAL 9 11.288 -18.620 -10.475
60 HB VAL 9 HB VAL 9 8.503 -18.823 -9.319
61 HG11 VAL 9 1HG1 VAL 9 8.933 -21.262 -9.437
62 HG12 VAL 9 2HG1 VAL 9 8.871 -20.488 -11.022
63 HG13 VAL 9 3HG1 VAL 9 10.426 -20.923 -10.312
64 HG21 VAL 9 3HG2 VAL 9 10.085 -20.328 -7.711
65 HG22 VAL 9 1HG2 VAL 9 11.177 -19.003 -8.113
66 HG23 VAL 9 2HG2 VAL 9 9.615 -18.663 -7.368
Start of MODEL 4
1 HA VAL 1 HA VAL 1 1.349 0.690 -2.298
2 HB VAL 1 HB VAL 1 -0.366 -1.049 -2.456
3 H1 VAL 1 1H VAL 1 1.851 0.155 -5.117
4 HG11 VAL 1 1HG1 VAL 1 -1.285 1.001 -2.972
5 HG12 VAL 1 2HG1 VAL 1 -0.323 1.182 -4.441
6 HG13 VAL 1 3HG1 VAL 1 -1.688 0.065 -4.411
7 HG21 VAL 1 3HG2 VAL 1 -0.683 -1.626 -5.112
8 HG22 VAL 1 1HG2 VAL 1 1.070 -1.672 -4.923
9 HG23 VAL 1 2HG2 VAL 1 0.047 -2.697 -3.917
10 H ASP 2 H ASP 2 2.981 -1.624 -4.341
11 HA ASP 2 HA ASP 2 3.890 -3.041 -1.922
12 HB2 ASP 2 1HB ASP 2 4.100 -5.080 -3.340
13 HB3 ASP 2 2HB ASP 2 2.438 -4.522 -3.164
14 H ILE 3 H ILE 3 5.954 -2.611 -1.549
15 HA ILE 3 HA ILE 3 7.705 -1.873 -3.770
16 HB ILE 3 HB ILE 3 9.300 -1.161 -2.051
17 HG12 ILE 3 1HG1 ILE 3 7.881 -1.100 0.316
18 HG13 ILE 3 2HG1 ILE 3 7.479 -2.685 -0.336
19 HG21 ILE 3 1HG2 ILE 3 6.855 0.019 -2.680
20 HG22 ILE 3 2HG2 ILE 3 7.021 0.206 -0.935
21 HG23 ILE 3 3HG2 ILE 3 8.280 0.813 -2.010
22 HD11 ILE 3 3HD1 ILE 3 9.626 -2.192 1.191
23 HD12 ILE 3 1HD1 ILE 3 9.548 -3.489 -0.002
24 HD13 ILE 3 2HD1 ILE 3 10.327 -1.960 -0.411
25 H HIS 4 H HIS 4 6.816 -4.661 -3.201
26 HA HIS 4 HA HIS 4 9.463 -5.870 -3.309
27 HD1 HIS 4 HD1 HIS 4 9.027 -9.182 -2.678
28 HD2 HIS 4 HD2 HIS 4 10.782 -6.672 0.129
29 HE1 HIS 4 HE1 HIS 4 11.082 -10.394 -1.883
30 HB2 HIS 4 1HB HIS 4 8.410 -5.877 -0.895
31 HB3 HIS 4 2HB HIS 4 7.453 -7.206 -1.541
32 H VAL 5 H VAL 5 9.519 -7.872 -4.375
33 HA VAL 5 HA VAL 5 6.993 -8.722 -5.626
34 HB VAL 5 HB VAL 5 8.186 -9.166 -7.724
35 HG11 VAL 5 1HG1 VAL 5 8.436 -6.326 -6.739
36 HG12 VAL 5 2HG1 VAL 5 8.491 -6.825 -8.431
37 HG13 VAL 5 3HG1 VAL 5 7.017 -7.057 -7.489
38 HG21 VAL 5 3HG2 VAL 5 10.516 -7.995 -6.228
39 HG22 VAL 5 1HG2 VAL 5 10.411 -9.550 -7.053
40 HG23 VAL 5 2HG2 VAL 5 10.458 -8.056 -7.990
41 H TRP 6 H TRP 6 6.846 -10.929 -6.179
42 HA TRP 6 HA TRP 6 8.293 -12.663 -4.409
43 HD1 TRP 6 HD1 TRP 6 6.443 -15.826 -4.004
44 HE1 TRP 6 HE1 TRP 6 5.119 -15.558 -1.814
45 HE3 TRP 6 HE3 TRP 6 5.260 -10.866 -4.373
46 HZ2 TRP 6 HZ2 TRP 6 3.753 -13.514 -0.426
47 HZ3 TRP 6 HZ3 TRP 6 3.942 -9.831 -2.572
48 HH2 TRP 6 HH2 TRP 6 3.204 -11.130 -0.640
49 HB2 TRP 6 1HB TRP 6 5.951 -12.863 -6.178
50 HB3 TRP 6 2HB TRP 6 6.898 -14.343 -6.057
51 H ASP 7 H ASP 7 9.668 -14.369 -4.963
52 HA ASP 7 HA ASP 7 11.498 -13.846 -7.042
53 HB2 ASP 7 1HB ASP 7 11.069 -16.352 -5.402
54 HB3 ASP 7 2HB ASP 7 12.451 -16.073 -6.458
55 H GLY 8 H GLY 8 11.209 -14.136 -9.146
56 HA2 GLY 8 1HA GLY 8 10.973 -15.762 -10.942
57 HA3 GLY 8 2HA GLY 8 9.661 -16.491 -10.027
58 H VAL 9 H VAL 9 8.880 -13.540 -9.422
59 HA VAL 9 HA VAL 9 7.479 -13.090 -11.978
60 HB VAL 9 HB VAL 9 5.674 -12.015 -10.553
61 HG11 VAL 9 1HG1 VAL 9 6.268 -14.915 -10.757
62 HG12 VAL 9 2HG1 VAL 9 4.918 -14.421 -9.734
63 HG13 VAL 9 3HG1 VAL 9 4.940 -13.980 -11.442
64 HG21 VAL 9 3HG2 VAL 9 5.522 -12.647 -8.231
65 HG22 VAL 9 1HG2 VAL 9 7.008 -13.588 -8.353
66 HG23 VAL 9 2HG2 VAL 9 7.061 -11.832 -8.506
Start of MODEL 5
1 HA VAL 1 HA VAL 1 0.418 -2.687 -3.064
2 HB VAL 1 HB VAL 1 1.813 -1.250 -4.563
3 H1 VAL 1 1H VAL 1 0.206 -0.505 -1.129
4 HG11 VAL 1 1HG1 VAL 1 -1.109 -0.924 -4.162
5 HG12 VAL 1 2HG1 VAL 1 -0.312 0.148 -5.315
6 HG13 VAL 1 3HG1 VAL 1 -0.222 -1.601 -5.526
7 HG21 VAL 1 3HG2 VAL 1 0.539 1.163 -3.374
8 HG22 VAL 1 1HG2 VAL 1 1.988 0.509 -2.611
9 HG23 VAL 1 2HG2 VAL 1 2.032 1.016 -4.300
10 H ASP 2 H ASP 2 2.851 -2.875 -3.738
11 HA ASP 2 HA ASP 2 4.622 -2.231 -1.499
12 HB2 ASP 2 1HB ASP 2 4.147 -5.015 -2.577
13 HB3 ASP 2 2HB ASP 2 5.509 -4.583 -1.548
14 H ILE 3 H ILE 3 6.871 -2.343 -2.017
15 HA ILE 3 HA ILE 3 7.378 -2.142 -4.911
16 HB ILE 3 HB ILE 3 9.357 -0.766 -4.291
17 HG12 ILE 3 1HG1 ILE 3 8.163 -0.441 -1.560
18 HG13 ILE 3 2HG1 ILE 3 9.280 -1.766 -1.871
19 HG21 ILE 3 1HG2 ILE 3 6.552 0.038 -3.736
20 HG22 ILE 3 2HG2 ILE 3 7.839 1.173 -3.330
21 HG23 ILE 3 3HG2 ILE 3 7.663 0.596 -4.987
22 HD11 ILE 3 3HD1 ILE 3 9.775 1.157 -1.775
23 HD12 ILE 3 1HD1 ILE 3 10.725 -0.178 -1.122
24 HD13 ILE 3 2HD1 ILE 3 10.766 0.170 -2.850
25 H HIS 4 H HIS 4 7.359 -4.670 -3.855
26 HA HIS 4 HA HIS 4 10.210 -5.378 -3.972
27 HD1 HIS 4 HD1 HIS 4 11.525 -7.005 -3.719
28 HD2 HIS 4 HD2 HIS 4 9.491 -8.613 -0.474
29 HE1 HIS 4 HE1 HIS 4 12.889 -8.987 -2.986
30 HB2 HIS 4 1HB HIS 4 9.360 -5.561 -1.634
31 HB3 HIS 4 2HB HIS 4 8.177 -6.739 -2.193
32 H VAL 5 H VAL 5 10.676 -6.834 -5.489
33 HA VAL 5 HA VAL 5 8.699 -7.817 -7.254
34 HB VAL 5 HB VAL 5 10.556 -9.207 -8.203
35 HG11 VAL 5 1HG1 VAL 5 11.422 -7.431 -9.342
36 HG12 VAL 5 2HG1 VAL 5 10.045 -6.635 -8.577
37 HG13 VAL 5 3HG1 VAL 5 11.659 -6.468 -7.884
38 HG21 VAL 5 3HG2 VAL 5 11.713 -8.667 -5.658
39 HG22 VAL 5 1HG2 VAL 5 12.333 -9.682 -6.960
40 HG23 VAL 5 2HG2 VAL 5 12.748 -7.969 -6.904
41 H TRP 6 H TRP 6 7.353 -9.455 -6.962
42 HA TRP 6 HA TRP 6 7.454 -11.209 -4.770
43 HD1 TRP 6 HD1 TRP 6 4.222 -12.731 -4.380
44 HE1 TRP 6 HE1 TRP 6 2.733 -11.083 -3.079
45 HE3 TRP 6 HE3 TRP 6 5.808 -8.356 -6.498
46 HZ2 TRP 6 HZ2 TRP 6 2.289 -8.298 -2.966
47 HZ3 TRP 6 HZ3 TRP 6 4.800 -6.244 -5.738
48 HH2 TRP 6 HH2 TRP 6 3.076 -6.218 -4.009
49 HB2 TRP 6 1HB TRP 6 5.832 -11.005 -7.256
50 HB3 TRP 6 2HB TRP 6 5.812 -12.546 -6.403
51 H ASP 7 H ASP 7 8.499 -13.062 -4.435
52 HA ASP 7 HA ASP 7 10.549 -13.992 -6.034
53 HB2 ASP 7 1HB ASP 7 10.174 -14.576 -3.628
54 HB3 ASP 7 2HB ASP 7 8.910 -15.690 -4.144
55 H GLY 8 H GLY 8 10.422 -14.697 -8.060
56 HA2 GLY 8 1HA GLY 8 9.896 -16.621 -9.456
57 HA3 GLY 8 2HA GLY 8 8.306 -16.651 -8.708
58 H VAL 9 H VAL 9 9.671 -13.596 -9.571
59 HA VAL 9 HA VAL 9 7.721 -13.395 -11.768
60 HB VAL 9 HB VAL 9 7.855 -10.947 -11.448
61 HG11 VAL 9 1HG1 VAL 9 6.017 -11.859 -10.375
62 HG12 VAL 9 2HG1 VAL 9 7.006 -12.738 -9.207
63 HG13 VAL 9 3HG1 VAL 9 6.823 -10.989 -9.069
64 HG21 VAL 9 3HG2 VAL 9 8.918 -10.712 -8.877
65 HG22 VAL 9 1HG2 VAL 9 10.075 -11.698 -9.771
66 HG23 VAL 9 2HG2 VAL 9 9.617 -10.107 -10.379
Start of MODEL 6
1 HA VAL 1 HA VAL 1 4.272 2.225 -2.119
2 HB VAL 1 HB VAL 1 3.420 2.968 0.072
3 H1 VAL 1 1H VAL 1 2.159 1.066 -0.838
4 HG11 VAL 1 1HG1 VAL 1 5.086 0.774 1.285
5 HG12 VAL 1 2HG1 VAL 1 3.992 1.889 2.106
6 HG13 VAL 1 3HG1 VAL 1 3.345 0.641 1.040
7 HG21 VAL 1 3HG2 VAL 1 6.286 2.553 0.643
8 HG22 VAL 1 1HG2 VAL 1 5.901 3.282 -0.916
9 HG23 VAL 1 2HG2 VAL 1 5.345 4.043 0.575
10 H ASP 2 H ASP 2 4.141 -0.942 -0.707
11 HA ASP 2 HA ASP 2 6.979 -1.340 -1.398
12 HB2 ASP 2 1HB ASP 2 6.177 -1.509 1.093
13 HB3 ASP 2 2HB ASP 2 5.575 -3.087 0.590
14 H ILE 3 H ILE 3 4.833 -1.605 -3.238
15 HA ILE 3 HA ILE 3 3.796 -4.151 -3.568
16 HB ILE 3 HB ILE 3 3.819 -3.627 -6.046
17 HG12 ILE 3 1HG1 ILE 3 4.418 -0.813 -5.610
18 HG13 ILE 3 2HG1 ILE 3 5.814 -1.837 -5.292
19 HG21 ILE 3 1HG2 ILE 3 2.437 -2.279 -3.881
20 HG22 ILE 3 2HG2 ILE 3 2.487 -1.307 -5.351
21 HG23 ILE 3 3HG2 ILE 3 1.805 -2.933 -5.392
22 HD11 ILE 3 3HD1 ILE 3 4.198 -1.828 -7.830
23 HD12 ILE 3 1HD1 ILE 3 5.758 -1.041 -7.598
24 HD13 ILE 3 2HD1 ILE 3 5.635 -2.798 -7.510
25 H HIS 4 H HIS 4 4.922 -5.984 -3.469
26 HA HIS 4 HA HIS 4 7.529 -6.122 -4.820
27 HD1 HIS 4 HD1 HIS 4 8.296 -9.541 -4.575
28 HD2 HIS 4 HD2 HIS 4 9.855 -6.664 -2.016
29 HE1 HIS 4 HE1 HIS 4 10.760 -10.025 -4.442
30 HB2 HIS 4 1HB HIS 4 7.157 -6.723 -2.298
31 HB3 HIS 4 2HB HIS 4 6.533 -8.238 -2.945
32 H VAL 5 H VAL 5 7.822 -7.410 -6.537
33 HA VAL 5 HA VAL 5 5.607 -8.554 -7.871
34 HB VAL 5 HB VAL 5 7.180 -9.377 -9.503
35 HG11 VAL 5 1HG1 VAL 5 6.721 -6.829 -9.100
36 HG12 VAL 5 2HG1 VAL 5 8.436 -6.799 -8.686
37 HG13 VAL 5 3HG1 VAL 5 7.922 -7.347 -10.282
38 HG21 VAL 5 3HG2 VAL 5 9.124 -9.049 -7.273
39 HG22 VAL 5 1HG2 VAL 5 8.961 -10.354 -8.448
40 HG23 VAL 5 2HG2 VAL 5 9.694 -8.823 -8.927
41 H TRP 6 H TRP 6 6.272 -10.958 -8.844
42 HA TRP 6 HA TRP 6 5.739 -12.696 -6.618
43 HD1 TRP 6 HD1 TRP 6 3.829 -15.606 -8.006
44 HE1 TRP 6 HE1 TRP 6 1.346 -14.936 -7.885
45 HE3 TRP 6 HE3 TRP 6 4.282 -10.622 -9.050
46 HZ2 TRP 6 HZ2 TRP 6 -0.213 -12.603 -8.192
47 HZ3 TRP 6 HZ3 TRP 6 2.247 -9.242 -9.117
48 HH2 TRP 6 HH2 TRP 6 0.047 -10.213 -8.698
49 HB2 TRP 6 1HB TRP 6 5.825 -12.973 -9.583
50 HB3 TRP 6 2HB TRP 6 6.016 -14.435 -8.620
51 H ASP 7 H ASP 7 7.057 -14.189 -5.687
52 HA ASP 7 HA ASP 7 9.822 -13.777 -5.683
53 HB2 ASP 7 1HB ASP 7 8.051 -15.978 -4.672
54 HB3 ASP 7 2HB ASP 7 9.802 -16.155 -4.601
55 H GLY 8 H GLY 8 11.350 -14.330 -7.085
56 HA2 GLY 8 1HA GLY 8 12.493 -16.070 -8.320
57 HA3 GLY 8 2HA GLY 8 10.920 -16.719 -8.760
58 H VAL 9 H VAL 9 11.345 -13.298 -8.858
59 HA VAL 9 HA VAL 9 11.579 -13.418 -11.795
60 HB VAL 9 HB VAL 9 9.953 -11.446 -10.183
61 HG11 VAL 9 1HG1 VAL 9 10.215 -10.108 -11.945
62 HG12 VAL 9 2HG1 VAL 9 10.993 -11.381 -12.888
63 HG13 VAL 9 3HG1 VAL 9 9.234 -11.259 -12.851
64 HG21 VAL 9 3HG2 VAL 9 9.033 -13.606 -12.077
65 HG22 VAL 9 1HG2 VAL 9 8.961 -13.702 -10.317
66 HG23 VAL 9 2HG2 VAL 9 8.008 -12.490 -11.174
Start of MODEL 7
1 HA VAL 1 HA VAL 1 2.823 1.221 0.496
2 HB VAL 1 HB VAL 1 0.428 1.734 0.144
3 H1 VAL 1 1H VAL 1 1.846 1.262 -2.271
4 HG11 VAL 1 1HG1 VAL 1 0.334 -1.067 -0.969
5 HG12 VAL 1 2HG1 VAL 1 -1.083 -0.105 -0.543
6 HG13 VAL 1 3HG1 VAL 1 -0.008 0.430 -1.836
7 HG21 VAL 1 3HG2 VAL 1 1.172 0.724 2.236
8 HG22 VAL 1 1HG2 VAL 1 -0.441 0.158 1.803
9 HG23 VAL 1 2HG2 VAL 1 0.958 -0.885 1.547
10 H ASP 2 H ASP 2 2.429 -0.750 -2.334
11 HA ASP 2 HA ASP 2 3.719 -2.975 -0.912
12 HB2 ASP 2 1HB ASP 2 1.328 -3.506 -1.148
13 HB3 ASP 2 2HB ASP 2 1.443 -3.252 -2.887
14 H ILE 3 H ILE 3 5.678 -2.219 -1.851
15 HA ILE 3 HA ILE 3 5.879 -2.405 -4.767
16 HB ILE 3 HB ILE 3 8.092 -1.398 -4.524
17 HG12 ILE 3 1HG1 ILE 3 7.488 -1.273 -1.562
18 HG13 ILE 3 2HG1 ILE 3 8.603 -2.416 -2.303
19 HG21 ILE 3 1HG2 ILE 3 5.639 -0.169 -4.068
20 HG22 ILE 3 2HG2 ILE 3 6.714 0.504 -2.844
21 HG23 ILE 3 3HG2 ILE 3 7.143 0.614 -4.551
22 HD11 ILE 3 3HD1 ILE 3 8.889 0.576 -2.414
23 HD12 ILE 3 1HD1 ILE 3 9.725 -0.482 -1.278
24 HD13 ILE 3 2HD1 ILE 3 10.040 -0.621 -3.008
25 H HIS 4 H HIS 4 5.561 -4.772 -3.086
26 HA HIS 4 HA HIS 4 7.929 -6.148 -2.607
27 HD1 HIS 4 HD1 HIS 4 8.661 -8.239 -2.270
28 HD2 HIS 4 HD2 HIS 4 5.012 -9.989 -3.209
29 HE1 HIS 4 HE1 HIS 4 9.090 -10.717 -2.291
30 HB2 HIS 4 1HB HIS 4 5.769 -6.966 -1.827
31 HB3 HIS 4 2HB HIS 4 5.248 -7.242 -3.487
32 H VAL 5 H VAL 5 9.358 -7.241 -3.835
33 HA VAL 5 HA VAL 5 9.488 -6.744 -6.615
34 HB VAL 5 HB VAL 5 11.437 -8.165 -6.647
35 HG11 VAL 5 1HG1 VAL 5 12.793 -6.904 -5.273
36 HG12 VAL 5 2HG1 VAL 5 11.361 -5.880 -5.391
37 HG13 VAL 5 3HG1 VAL 5 11.618 -6.878 -3.959
38 HG21 VAL 5 3HG2 VAL 5 10.405 -9.143 -3.999
39 HG22 VAL 5 1HG2 VAL 5 10.781 -10.080 -5.445
40 HG23 VAL 5 2HG2 VAL 5 12.082 -9.361 -4.497
41 H TRP 6 H TRP 6 10.206 -8.976 -7.908
42 HA TRP 6 HA TRP 6 7.676 -10.318 -8.269
43 HD1 TRP 6 HD1 TRP 6 8.487 -13.162 -10.688
44 HE1 TRP 6 HE1 TRP 6 6.541 -13.137 -12.372
45 HE3 TRP 6 HE3 TRP 6 7.601 -8.129 -10.828
46 HZ2 TRP 6 HZ2 TRP 6 4.854 -11.235 -13.598
47 HZ3 TRP 6 HZ3 TRP 6 5.803 -7.288 -12.283
48 HH2 TRP 6 HH2 TRP 6 4.459 -8.811 -13.639
49 HB2 TRP 6 1HB TRP 6 9.584 -9.578 -10.020
50 HB3 TRP 6 2HB TRP 6 10.072 -11.249 -9.749
51 H ASP 7 H ASP 7 7.288 -12.529 -8.062
52 HA ASP 7 HA ASP 7 8.304 -13.819 -5.842
53 HB2 ASP 7 1HB ASP 7 6.944 -14.895 -8.308
54 HB3 ASP 7 2HB ASP 7 7.386 -15.933 -6.956
55 H GLY 8 H GLY 8 9.483 -13.828 -9.141
56 HA2 GLY 8 1HA GLY 8 11.748 -14.245 -9.692
57 HA3 GLY 8 2HA GLY 8 11.914 -15.169 -8.206
58 H VAL 9 H VAL 9 9.131 -15.785 -10.128
59 HA VAL 9 HA VAL 9 10.152 -18.447 -10.735
60 HB VAL 9 HB VAL 9 7.847 -18.992 -11.364
61 HG11 VAL 9 1HG1 VAL 9 8.551 -19.193 -9.022
62 HG12 VAL 9 2HG1 VAL 9 8.001 -17.544 -8.722
63 HG13 VAL 9 3HG1 VAL 9 6.839 -18.796 -9.160
64 HG21 VAL 9 3HG2 VAL 9 6.425 -16.748 -10.406
65 HG22 VAL 9 1HG2 VAL 9 7.612 -16.156 -11.569
66 HG23 VAL 9 2HG2 VAL 9 6.456 -17.400 -12.045
Start of MODEL 8
1 HA VAL 1 HA VAL 1 0.876 -1.598 -0.485
2 HB VAL 1 HB VAL 1 0.821 -0.380 -3.247
3 H1 VAL 1 1H VAL 1 2.067 0.853 -1.289
4 HG11 VAL 1 1HG1 VAL 1 -1.527 -1.489 -3.101
5 HG12 VAL 1 2HG1 VAL 1 -0.113 -2.483 -3.460
6 HG13 VAL 1 3HG1 VAL 1 -0.788 -2.462 -1.830
7 HG21 VAL 1 3HG2 VAL 1 0.164 1.304 -1.633
8 HG22 VAL 1 1HG2 VAL 1 -1.252 0.738 -2.518
9 HG23 VAL 1 2HG2 VAL 1 -0.957 0.175 -0.873
10 H ASP 2 H ASP 2 2.821 -0.890 -3.394
11 HA ASP 2 HA ASP 2 3.607 -3.715 -3.473
12 HB2 ASP 2 1HB ASP 2 2.621 -2.853 -5.528
13 HB3 ASP 2 2HB ASP 2 3.806 -1.551 -5.579
14 H ILE 3 H ILE 3 5.035 -3.174 -1.590
15 HA ILE 3 HA ILE 3 7.474 -1.739 -2.331
16 HB ILE 3 HB ILE 3 8.106 -1.971 0.038
17 HG12 ILE 3 1HG1 ILE 3 5.359 -3.135 0.493
18 HG13 ILE 3 2HG1 ILE 3 6.797 -4.138 0.329
19 HG21 ILE 3 1HG2 ILE 3 5.703 -0.813 0.765
20 HG22 ILE 3 2HG2 ILE 3 7.099 0.016 0.079
21 HG23 ILE 3 3HG2 ILE 3 5.798 -0.538 -0.974
22 HD11 ILE 3 3HD1 ILE 3 7.350 -3.797 2.442
23 HD12 ILE 3 1HD1 ILE 3 7.224 -2.048 2.257
24 HD13 ILE 3 2HD1 ILE 3 5.792 -2.998 2.653
25 H HIS 4 H HIS 4 6.968 -4.227 -3.613
26 HA HIS 4 HA HIS 4 9.459 -5.500 -3.228
27 HD1 HIS 4 HD1 HIS 4 9.233 -8.472 -4.149
28 HD2 HIS 4 HD2 HIS 4 9.752 -8.055 -0.048
29 HE1 HIS 4 HE1 HIS 4 10.965 -10.181 -3.513
30 HB2 HIS 4 1HB HIS 4 8.057 -6.323 -1.230
31 HB3 HIS 4 2HB HIS 4 7.151 -7.256 -2.418
32 H VAL 5 H VAL 5 10.004 -6.295 -5.147
33 HA VAL 5 HA VAL 5 8.192 -6.374 -7.314
34 HB VAL 5 HB VAL 5 10.008 -7.256 -8.633
35 HG11 VAL 5 1HG1 VAL 5 11.653 -5.532 -6.943
36 HG12 VAL 5 2HG1 VAL 5 11.142 -5.325 -8.619
37 HG13 VAL 5 3HG1 VAL 5 10.061 -4.866 -7.303
38 HG21 VAL 5 3HG2 VAL 5 11.280 -7.853 -5.972
39 HG22 VAL 5 1HG2 VAL 5 10.890 -8.979 -7.273
40 HG23 VAL 5 2HG2 VAL 5 12.192 -7.807 -7.481
41 H TRP 6 H TRP 6 8.602 -8.586 -8.767
42 HA TRP 6 HA TRP 6 6.918 -10.502 -7.483
43 HD1 TRP 6 HD1 TRP 6 5.138 -12.336 -10.058
44 HE1 TRP 6 HE1 TRP 6 3.058 -10.959 -10.692
45 HE3 TRP 6 HE3 TRP 6 7.161 -7.648 -9.805
46 HZ2 TRP 6 HZ2 TRP 6 2.367 -8.245 -11.040
47 HZ3 TRP 6 HZ3 TRP 6 5.723 -5.715 -10.304
48 HH2 TRP 6 HH2 TRP 6 3.376 -6.009 -10.909
49 HB2 TRP 6 1HB TRP 6 8.173 -10.214 -10.171
50 HB3 TRP 6 2HB TRP 6 7.629 -11.817 -9.686
51 H ASP 7 H ASP 7 7.384 -12.610 -6.862
52 HA ASP 7 HA ASP 7 9.760 -13.087 -5.534
53 HB2 ASP 7 1HB ASP 7 7.653 -14.955 -6.601
54 HB3 ASP 7 2HB ASP 7 9.053 -15.556 -5.719
55 H GLY 8 H GLY 8 8.928 -13.693 -8.880
56 HA2 GLY 8 1HA GLY 8 10.536 -13.824 -10.609
57 HA3 GLY 8 2HA GLY 8 11.745 -14.280 -9.418
58 H VAL 9 H VAL 9 8.695 -15.875 -9.290
59 HA VAL 9 HA VAL 9 9.970 -18.316 -10.324
60 HB VAL 9 HB VAL 9 8.219 -19.548 -9.077
61 HG11 VAL 9 1HG1 VAL 9 9.298 -19.429 -7.024
62 HG12 VAL 9 2HG1 VAL 9 10.511 -18.805 -8.144
63 HG13 VAL 9 3HG1 VAL 9 9.567 -17.691 -7.153
64 HG21 VAL 9 3HG2 VAL 9 6.555 -17.686 -9.112
65 HG22 VAL 9 1HG2 VAL 9 6.768 -18.437 -7.531
66 HG23 VAL 9 2HG2 VAL 9 7.512 -16.875 -7.873
Start of MODEL 9
1 HA VAL 1 HA VAL 1 0.906 1.266 -1.532
2 HB VAL 1 HB VAL 1 2.634 1.578 -3.302
3 H1 VAL 1 1H VAL 1 2.520 3.126 -0.022
4 HG11 VAL 1 1HG1 VAL 1 1.032 3.749 -2.098
5 HG12 VAL 1 2HG1 VAL 1 2.221 4.225 -3.313
6 HG13 VAL 1 3HG1 VAL 1 0.966 3.052 -3.716
7 HG21 VAL 1 3HG2 VAL 1 4.554 2.755 -3.009
8 HG22 VAL 1 1HG2 VAL 1 3.840 3.829 -1.806
9 HG23 VAL 1 2HG2 VAL 1 4.345 2.203 -1.347
10 H ASP 2 H ASP 2 1.995 -0.566 -2.693
11 HA ASP 2 HA ASP 2 3.954 -1.900 -0.942
12 HB2 ASP 2 1HB ASP 2 2.857 -4.027 -1.371
13 HB3 ASP 2 2HB ASP 2 1.694 -2.884 -0.706
14 H ILE 3 H ILE 3 5.650 -2.903 -1.906
15 HA ILE 3 HA ILE 3 5.680 -3.028 -4.845
16 HB ILE 3 HB ILE 3 8.129 -2.405 -4.724
17 HG12 ILE 3 1HG1 ILE 3 7.477 -1.081 -2.115
18 HG13 ILE 3 2HG1 ILE 3 8.044 -2.747 -2.128
19 HG21 ILE 3 1HG2 ILE 3 5.811 -0.619 -4.356
20 HG22 ILE 3 2HG2 ILE 3 7.400 0.111 -4.136
21 HG23 ILE 3 3HG2 ILE 3 6.999 -0.686 -5.657
22 HD11 ILE 3 3HD1 ILE 3 9.485 -0.301 -3.103
23 HD12 ILE 3 1HD1 ILE 3 9.929 -1.372 -1.774
24 HD13 ILE 3 2HD1 ILE 3 10.028 -1.945 -3.439
25 H HIS 4 H HIS 4 5.077 -5.293 -4.110
26 HA HIS 4 HA HIS 4 6.966 -6.954 -2.834
27 HD1 HIS 4 HD1 HIS 4 7.236 -9.747 -4.373
28 HD2 HIS 4 HD2 HIS 4 4.084 -9.492 -1.678
29 HE1 HIS 4 HE1 HIS 4 7.297 -11.892 -3.061
30 HB2 HIS 4 1HB HIS 4 4.455 -7.371 -3.292
31 HB3 HIS 4 2HB HIS 4 4.987 -7.957 -4.865
32 H VAL 5 H VAL 5 8.854 -7.679 -3.539
33 HA VAL 5 HA VAL 5 9.827 -7.157 -6.141
34 HB VAL 5 HB VAL 5 11.802 -8.391 -5.510
35 HG11 VAL 5 1HG1 VAL 5 10.639 -6.770 -3.252
36 HG12 VAL 5 2HG1 VAL 5 12.327 -7.278 -3.333
37 HG13 VAL 5 3HG1 VAL 5 11.669 -6.201 -4.566
38 HG21 VAL 5 3HG2 VAL 5 10.079 -9.459 -3.287
39 HG22 VAL 5 1HG2 VAL 5 10.938 -10.363 -4.534
40 HG23 VAL 5 2HG2 VAL 5 11.840 -9.547 -3.257
41 H TRP 6 H TRP 6 11.121 -9.307 -7.078
42 HA TRP 6 HA TRP 6 9.005 -10.834 -8.271
43 HD1 TRP 6 HD1 TRP 6 10.232 -11.943 -11.599
44 HE1 TRP 6 HE1 TRP 6 9.630 -10.061 -13.249
45 HE3 TRP 6 HE3 TRP 6 11.013 -7.913 -8.552
46 HZ2 TRP 6 HZ2 TRP 6 9.503 -7.241 -13.257
47 HZ3 TRP 6 HZ3 TRP 6 10.629 -5.657 -9.458
48 HH2 TRP 6 HH2 TRP 6 9.890 -5.331 -11.762
49 HB2 TRP 6 1HB TRP 6 11.950 -10.591 -8.646
50 HB3 TRP 6 2HB TRP 6 11.173 -12.063 -9.221
51 H ASP 7 H ASP 7 8.487 -12.958 -7.976
52 HA ASP 7 HA ASP 7 9.673 -14.252 -5.620
53 HB2 ASP 7 1HB ASP 7 7.578 -15.697 -5.748
54 HB3 ASP 7 2HB ASP 7 7.337 -14.007 -5.314
55 H GLY 8 H GLY 8 10.899 -14.272 -8.273
56 HA2 GLY 8 1HA GLY 8 12.173 -15.866 -9.376
57 HA3 GLY 8 2HA GLY 8 11.357 -17.115 -8.449
58 H VAL 9 H VAL 9 9.433 -14.798 -10.139
59 HA VAL 9 HA VAL 9 9.103 -16.545 -12.451
60 HB VAL 9 HB VAL 9 6.765 -15.757 -10.707
61 HG11 VAL 9 1HG1 VAL 9 5.859 -15.792 -12.821
62 HG12 VAL 9 2HG1 VAL 9 6.992 -17.013 -13.403
63 HG13 VAL 9 3HG1 VAL 9 5.662 -17.477 -12.341
64 HG21 VAL 9 3HG2 VAL 9 8.044 -18.447 -11.187
65 HG22 VAL 9 1HG2 VAL 9 8.038 -17.537 -9.676
66 HG23 VAL 9 2HG2 VAL 9 6.530 -18.185 -10.322
Start of MODEL 10
1 HA VAL 1 HA VAL 1 4.334 -0.412 0.756
2 HB VAL 1 HB VAL 1 2.071 0.320 1.360
3 H1 VAL 1 1H VAL 1 2.807 0.677 -1.517
4 HG11 VAL 1 1HG1 VAL 1 1.062 -1.800 -0.528
5 HG12 VAL 1 2HG1 VAL 1 0.104 -0.673 0.436
6 HG13 VAL 1 3HG1 VAL 1 1.086 -0.077 -0.903
7 HG21 VAL 1 3HG2 VAL 1 1.396 -1.664 2.519
8 HG22 VAL 1 1HG2 VAL 1 2.249 -2.688 1.364
9 HG23 VAL 1 2HG2 VAL 1 3.158 -1.643 2.456
10 H ASP 2 H ASP 2 2.845 -1.122 -2.318
11 HA ASP 2 HA ASP 2 3.700 -3.927 -2.103
12 HB2 ASP 2 1HB ASP 2 1.304 -3.461 -2.676
13 HB3 ASP 2 2HB ASP 2 1.860 -2.703 -4.166
14 H ILE 3 H ILE 3 5.871 -2.602 -2.395
15 HA ILE 3 HA ILE 3 6.446 -2.248 -5.248
16 HB ILE 3 HB ILE 3 8.566 -1.220 -4.502
17 HG12 ILE 3 1HG1 ILE 3 7.500 -1.190 -1.698
18 HG13 ILE 3 2HG1 ILE 3 8.435 -2.571 -2.263
19 HG21 ILE 3 1HG2 ILE 3 5.938 -0.189 -4.234
20 HG22 ILE 3 2HG2 ILE 3 6.920 0.480 -2.932
21 HG23 ILE 3 3HG2 ILE 3 7.426 0.680 -4.610
22 HD11 ILE 3 3HD1 ILE 3 9.292 0.199 -1.689
23 HD12 ILE 3 1HD1 ILE 3 10.113 -1.333 -1.390
24 HD13 ILE 3 2HD1 ILE 3 10.095 -0.644 -3.013
25 H HIS 4 H HIS 4 6.126 -4.873 -3.927
26 HA HIS 4 HA HIS 4 8.849 -5.943 -4.241
27 HD1 HIS 4 HD1 HIS 4 9.188 -8.608 -4.484
28 HD2 HIS 4 HD2 HIS 4 8.797 -7.895 -0.410
29 HE1 HIS 4 HE1 HIS 4 10.929 -10.047 -3.380
30 HB2 HIS 4 1HB HIS 4 7.350 -6.312 -2.105
31 HB3 HIS 4 2HB HIS 4 6.606 -7.561 -3.099
32 H VAL 5 H VAL 5 9.314 -7.223 -5.914
33 HA VAL 5 HA VAL 5 7.475 -7.595 -8.029
34 HB VAL 5 HB VAL 5 9.195 -8.884 -9.124
35 HG11 VAL 5 1HG1 VAL 5 10.161 -6.931 -9.546
36 HG12 VAL 5 2HG1 VAL 5 9.627 -6.294 -7.989
37 HG13 VAL 5 3HG1 VAL 5 11.166 -7.148 -8.113
38 HG21 VAL 5 3HG2 VAL 5 10.151 -9.276 -6.355
39 HG22 VAL 5 1HG2 VAL 5 10.184 -10.374 -7.735
40 HG23 VAL 5 2HG2 VAL 5 11.390 -9.094 -7.597
41 H TRP 6 H TRP 6 7.680 -10.088 -8.987
42 HA TRP 6 HA TRP 6 5.926 -11.564 -7.242
43 HD1 TRP 6 HD1 TRP 6 3.710 -13.598 -9.397
44 HE1 TRP 6 HE1 TRP 6 1.694 -12.113 -9.992
45 HE3 TRP 6 HE3 TRP 6 6.117 -9.112 -9.861
46 HZ2 TRP 6 HZ2 TRP 6 1.191 -9.398 -10.580
47 HZ3 TRP 6 HZ3 TRP 6 4.796 -7.119 -10.442
48 HH2 TRP 6 HH2 TRP 6 2.384 -7.262 -10.795
49 HB2 TRP 6 1HB TRP 6 6.870 -11.835 -10.059
50 HB3 TRP 6 2HB TRP 6 6.247 -13.272 -9.253
51 H ASP 7 H ASP 7 6.339 -13.443 -6.167
52 HA ASP 7 HA ASP 7 8.899 -13.963 -5.223
53 HB2 ASP 7 1HB ASP 7 6.529 -14.755 -4.396
54 HB3 ASP 7 2HB ASP 7 6.893 -16.180 -5.366
55 H GLY 8 H GLY 8 10.566 -14.439 -6.521
56 HA2 GLY 8 1HA GLY 8 11.872 -16.041 -7.652
57 HA3 GLY 8 2HA GLY 8 10.402 -16.899 -8.089
58 H VAL 9 H VAL 9 10.503 -13.482 -8.568
59 HA VAL 9 HA VAL 9 11.054 -13.870 -11.434
60 HB VAL 9 HB VAL 9 8.854 -12.139 -10.297
61 HG11 VAL 9 1HG1 VAL 9 8.253 -11.737 -12.637
62 HG12 VAL 9 2HG1 VAL 9 9.881 -11.157 -12.278
63 HG13 VAL 9 3HG1 VAL 9 9.656 -12.670 -13.156
64 HG21 VAL 9 3HG2 VAL 9 7.516 -13.802 -11.833
65 HG22 VAL 9 1HG2 VAL 9 8.892 -14.858 -11.512
66 HG23 VAL 9 2HG2 VAL 9 7.928 -14.234 -10.174
Start of MODEL 11
1 HA VAL 1 HA VAL 1 2.464 0.147 -0.349
2 HB VAL 1 HB VAL 1 1.667 -2.430 1.014
3 H1 VAL 1 1H VAL 1 0.613 -1.938 -1.246
4 HG11 VAL 1 1HG1 VAL 1 3.457 -0.160 1.819
5 HG12 VAL 1 2HG1 VAL 1 2.672 -1.190 3.019
6 HG13 VAL 1 3HG1 VAL 1 3.786 -1.892 1.845
7 HG21 VAL 1 3HG2 VAL 1 0.782 -0.270 2.517
8 HG22 VAL 1 1HG2 VAL 1 0.399 0.167 0.852
9 HG23 VAL 1 2HG2 VAL 1 -0.210 -1.343 1.530
10 H ASP 2 H ASP 2 2.475 -3.371 -0.931
11 HA ASP 2 HA ASP 2 5.221 -3.771 -0.716
12 HB2 ASP 2 1HB ASP 2 3.449 -5.554 -0.852
13 HB3 ASP 2 2HB ASP 2 3.382 -5.268 -2.589
14 H ILE 3 H ILE 3 6.678 -2.567 -1.763
15 HA ILE 3 HA ILE 3 6.227 -1.872 -4.569
16 HB ILE 3 HB ILE 3 8.165 -0.371 -4.314
17 HG12 ILE 3 1HG1 ILE 3 8.117 -1.089 -1.382
18 HG13 ILE 3 2HG1 ILE 3 9.248 -1.812 -2.521
19 HG21 ILE 3 1HG2 ILE 3 5.636 0.009 -3.420
20 HG22 ILE 3 2HG2 ILE 3 6.567 0.394 -1.973
21 HG23 ILE 3 3HG2 ILE 3 6.872 1.266 -3.475
22 HD11 ILE 3 3HD1 ILE 3 9.402 0.977 -2.873
23 HD12 ILE 3 1HD1 ILE 3 9.430 0.667 -1.137
24 HD13 ILE 3 2HD1 ILE 3 10.612 -0.109 -2.191
25 H HIS 4 H HIS 4 6.885 -4.593 -3.807
26 HA HIS 4 HA HIS 4 9.540 -4.856 -5.058
27 HD1 HIS 4 HD1 HIS 4 9.772 -8.777 -4.665
28 HD2 HIS 4 HD2 HIS 4 11.856 -5.606 -2.975
29 HE1 HIS 4 HE1 HIS 4 12.195 -9.445 -4.749
30 HB2 HIS 4 1HB HIS 4 9.043 -5.756 -2.644
31 HB3 HIS 4 2HB HIS 4 8.266 -7.081 -3.506
32 H VAL 5 H VAL 5 9.845 -6.561 -6.581
33 HA VAL 5 HA VAL 5 7.718 -6.839 -8.423
34 HB VAL 5 HB VAL 5 9.181 -8.273 -9.697
35 HG11 VAL 5 1HG1 VAL 5 9.679 -5.918 -9.810
36 HG12 VAL 5 2HG1 VAL 5 10.679 -6.024 -8.360
37 HG13 VAL 5 3HG1 VAL 5 11.187 -6.831 -9.844
38 HG21 VAL 5 3HG2 VAL 5 10.620 -8.552 -7.093
39 HG22 VAL 5 1HG2 VAL 5 10.128 -9.796 -8.242
40 HG23 VAL 5 2HG2 VAL 5 11.499 -8.749 -8.609
41 H TRP 6 H TRP 6 7.617 -9.359 -9.326
42 HA TRP 6 HA TRP 6 6.009 -10.666 -7.325
43 HD1 TRP 6 HD1 TRP 6 5.359 -14.125 -8.823
44 HE1 TRP 6 HE1 TRP 6 2.866 -14.566 -8.359
45 HE3 TRP 6 HE3 TRP 6 3.593 -9.349 -9.275
46 HZ2 TRP 6 HZ2 TRP 6 0.468 -13.084 -8.205
47 HZ3 TRP 6 HZ3 TRP 6 1.187 -8.946 -8.955
48 HH2 TRP 6 HH2 TRP 6 -0.342 -10.776 -8.432
49 HB2 TRP 6 1HB TRP 6 5.774 -10.523 -9.994
50 HB3 TRP 6 2HB TRP 6 6.646 -12.049 -9.876
51 H ASP 7 H ASP 7 6.788 -12.019 -5.862
52 HA ASP 7 HA ASP 7 9.434 -12.983 -5.857
53 HB2 ASP 7 1HB ASP 7 6.995 -13.807 -4.277
54 HB3 ASP 7 2HB ASP 7 8.601 -14.469 -3.985
55 H GLY 8 H GLY 8 10.346 -14.701 -6.784
56 HA2 GLY 8 1HA GLY 8 10.314 -17.055 -7.323
57 HA3 GLY 8 2HA GLY 8 8.601 -16.900 -7.682
58 H VAL 9 H VAL 9 10.744 -14.431 -8.794
59 HA VAL 9 HA VAL 9 10.328 -15.369 -11.547
60 HB VAL 9 HB VAL 9 10.847 -13.062 -12.237
61 HG11 VAL 9 1HG1 VAL 9 8.571 -13.332 -12.070
62 HG12 VAL 9 2HG1 VAL 9 8.625 -13.640 -10.333
63 HG13 VAL 9 3HG1 VAL 9 8.830 -11.999 -10.946
64 HG21 VAL 9 3HG2 VAL 9 11.823 -12.875 -9.560
65 HG22 VAL 9 1HG2 VAL 9 11.960 -11.708 -10.875
66 HG23 VAL 9 2HG2 VAL 9 10.563 -11.664 -9.800
Start of MODEL 12
1 HA VAL 1 HA VAL 1 1.466 -0.463 -1.565
2 HB VAL 1 HB VAL 1 3.317 -1.026 0.020
3 H1 VAL 1 1H VAL 1 0.367 -3.151 -1.387
4 HG11 VAL 1 1HG1 VAL 1 0.501 -0.861 1.077
5 HG12 VAL 1 2HG1 VAL 1 1.938 -0.660 2.082
6 HG13 VAL 1 3HG1 VAL 1 1.616 0.469 0.765
7 HG21 VAL 1 3HG2 VAL 1 3.508 -3.067 0.877
8 HG22 VAL 1 1HG2 VAL 1 1.910 -2.930 1.612
9 HG23 VAL 1 2HG2 VAL 1 2.077 -3.565 -0.025
10 H ASP 2 H ASP 2 3.078 -0.337 -3.013
11 HA ASP 2 HA ASP 2 4.004 -2.846 -4.218
12 HB2 ASP 2 1HB ASP 2 4.420 -0.086 -5.353
13 HB3 ASP 2 2HB ASP 2 4.454 -1.631 -6.197
14 H ILE 3 H ILE 3 5.345 -2.909 -2.121
15 HA ILE 3 HA ILE 3 7.914 -1.555 -2.626
16 HB ILE 3 HB ILE 3 8.320 -1.764 -0.150
17 HG12 ILE 3 1HG1 ILE 3 5.331 -2.206 -0.042
18 HG13 ILE 3 2HG1 ILE 3 6.525 -3.473 0.216
19 HG21 ILE 3 1HG2 ILE 3 6.624 0.101 -1.571
20 HG22 ILE 3 2HG2 ILE 3 6.238 0.043 0.148
21 HG23 ILE 3 3HG2 ILE 3 7.883 0.407 -0.374
22 HD11 ILE 3 3HD1 ILE 3 7.300 -2.464 2.201
23 HD12 ILE 3 1HD1 ILE 3 6.420 -0.972 1.871
24 HD13 ILE 3 2HD1 ILE 3 5.539 -2.444 2.282
25 H HIS 4 H HIS 4 6.999 -4.147 -3.606
26 HA HIS 4 HA HIS 4 9.292 -5.693 -2.806
27 HD1 HIS 4 HD1 HIS 4 9.878 -7.885 -3.129
28 HD2 HIS 4 HD2 HIS 4 7.673 -8.507 0.337
29 HE1 HIS 4 HE1 HIS 4 11.049 -9.748 -1.912
30 HB2 HIS 4 1HB HIS 4 7.251 -6.144 -1.184
31 HB3 HIS 4 2HB HIS 4 6.707 -7.163 -2.514
32 H VAL 5 H VAL 5 10.081 -6.515 -4.618
33 HA VAL 5 HA VAL 5 8.667 -6.500 -7.065
34 HB VAL 5 HB VAL 5 10.594 -7.577 -8.037
35 HG11 VAL 5 1HG1 VAL 5 12.238 -6.028 -6.296
36 HG12 VAL 5 2HG1 VAL 5 11.660 -5.634 -7.917
37 HG13 VAL 5 3HG1 VAL 5 10.693 -5.205 -6.505
38 HG21 VAL 5 3HG2 VAL 5 11.241 -8.274 -5.194
39 HG22 VAL 5 1HG2 VAL 5 11.148 -9.329 -6.604
40 HG23 VAL 5 2HG2 VAL 5 12.500 -8.210 -6.427
41 H TRP 6 H TRP 6 9.116 -8.782 -8.393
42 HA TRP 6 HA TRP 6 7.136 -10.552 -7.260
43 HD1 TRP 6 HD1 TRP 6 7.219 -13.609 -9.534
44 HE1 TRP 6 HE1 TRP 6 4.740 -14.182 -9.924
45 HE3 TRP 6 HE3 TRP 6 5.283 -8.877 -9.542
46 HZ2 TRP 6 HZ2 TRP 6 2.289 -12.810 -10.199
47 HZ3 TRP 6 HZ3 TRP 6 2.862 -8.594 -9.875
48 HH2 TRP 6 HH2 TRP 6 1.398 -10.521 -10.197
49 HB2 TRP 6 1HB TRP 6 7.667 -9.836 -9.803
50 HB3 TRP 6 2HB TRP 6 8.586 -11.337 -9.726
51 H ASP 7 H ASP 7 7.422 -12.725 -6.734
52 HA ASP 7 HA ASP 7 9.693 -13.425 -5.324
53 HB2 ASP 7 1HB ASP 7 8.830 -15.837 -5.695
54 HB3 ASP 7 2HB ASP 7 7.790 -14.697 -4.846
55 H GLY 8 H GLY 8 8.982 -13.836 -8.730
56 HA2 GLY 8 1HA GLY 8 10.818 -13.886 -10.299
57 HA3 GLY 8 2HA GLY 8 11.750 -14.779 -9.107
58 H VAL 9 H VAL 9 8.431 -15.615 -9.625
59 HA VAL 9 HA VAL 9 9.274 -17.964 -11.193
60 HB VAL 9 HB VAL 9 7.178 -17.934 -9.017
61 HG11 VAL 9 1HG1 VAL 9 6.365 -19.712 -10.083
62 HG12 VAL 9 2HG1 VAL 9 7.734 -19.760 -11.196
63 HG13 VAL 9 3HG1 VAL 9 7.845 -20.554 -9.625
64 HG21 VAL 9 3HG2 VAL 9 8.955 -19.707 -8.141
65 HG22 VAL 9 1HG2 VAL 9 10.050 -18.674 -9.059
66 HG23 VAL 9 2HG2 VAL 9 9.075 -17.990 -7.758
Start of MODEL 13
1 HA VAL 1 HA VAL 1 3.523 1.352 0.648
2 HB VAL 1 HB VAL 1 3.015 -1.314 1.976
3 H1 VAL 1 1H VAL 1 1.445 -0.622 0.051
4 HG11 VAL 1 1HG1 VAL 1 5.210 -0.808 2.484
5 HG12 VAL 1 2HG1 VAL 1 4.920 0.933 2.480
6 HG13 VAL 1 3HG1 VAL 1 4.345 -0.056 3.823
7 HG21 VAL 1 3HG2 VAL 1 1.311 -0.361 3.036
8 HG22 VAL 1 1HG2 VAL 1 2.419 0.842 3.696
9 HG23 VAL 1 2HG2 VAL 1 1.586 1.152 2.173
10 H ASP 2 H ASP 2 3.453 -2.182 0.147
11 HA ASP 2 HA ASP 2 6.123 -1.998 -1.052
12 HB2 ASP 2 1HB ASP 2 4.572 -4.241 0.215
13 HB3 ASP 2 2HB ASP 2 5.949 -4.578 -0.832
14 H ILE 3 H ILE 3 6.468 -2.364 -3.154
15 HA ILE 3 HA ILE 3 4.279 -3.529 -4.743
16 HB ILE 3 HB ILE 3 4.930 -2.016 -6.606
17 HG12 ILE 3 1HG1 ILE 3 6.380 -0.353 -4.561
18 HG13 ILE 3 2HG1 ILE 3 7.231 -1.569 -5.506
19 HG21 ILE 3 1HG2 ILE 3 3.810 -0.998 -4.036
20 HG22 ILE 3 2HG2 ILE 3 4.039 0.114 -5.384
21 HG23 ILE 3 3HG2 ILE 3 3.002 -1.300 -5.574
22 HD11 ILE 3 3HD1 ILE 3 5.616 0.634 -6.750
23 HD12 ILE 3 1HD1 ILE 3 7.335 0.778 -6.384
24 HD13 ILE 3 2HD1 ILE 3 6.776 -0.441 -7.530
25 H HIS 4 H HIS 4 6.619 -4.828 -3.636
26 HA HIS 4 HA HIS 4 8.711 -5.145 -5.450
27 HD1 HIS 4 HD1 HIS 4 9.551 -8.578 -5.584
28 HD2 HIS 4 HD2 HIS 4 11.026 -5.906 -2.766
29 HE1 HIS 4 HE1 HIS 4 12.032 -8.982 -5.509
30 HB2 HIS 4 1HB HIS 4 8.317 -6.086 -3.011
31 HB3 HIS 4 2HB HIS 4 7.749 -7.504 -3.887
32 H VAL 5 H VAL 5 9.176 -6.883 -6.924
33 HA VAL 5 HA VAL 5 7.080 -7.374 -8.755
34 HB VAL 5 HB VAL 5 8.653 -8.714 -9.999
35 HG11 VAL 5 1HG1 VAL 5 10.511 -7.118 -10.217
36 HG12 VAL 5 2HG1 VAL 5 8.946 -6.307 -10.126
37 HG13 VAL 5 3HG1 VAL 5 10.006 -6.342 -8.716
38 HG21 VAL 5 3HG2 VAL 5 10.280 -8.680 -7.464
39 HG22 VAL 5 1HG2 VAL 5 9.619 -10.080 -8.309
40 HG23 VAL 5 2HG2 VAL 5 10.933 -9.153 -9.033
41 H TRP 6 H TRP 6 7.182 -9.913 -9.599
42 HA TRP 6 HA TRP 6 5.659 -11.295 -7.593
43 HD1 TRP 6 HD1 TRP 6 3.330 -13.582 -9.443
44 HE1 TRP 6 HE1 TRP 6 1.198 -12.204 -9.870
45 HE3 TRP 6 HE3 TRP 6 5.466 -9.005 -10.236
46 HZ2 TRP 6 HZ2 TRP 6 0.513 -9.531 -10.465
47 HZ3 TRP 6 HZ3 TRP 6 4.002 -7.090 -10.729
48 HH2 TRP 6 HH2 TRP 6 1.577 -7.350 -10.842
49 HB2 TRP 6 1HB TRP 6 6.318 -11.728 -10.464
50 HB3 TRP 6 2HB TRP 6 5.846 -13.136 -9.517
51 H ASP 7 H ASP 7 6.234 -13.016 -6.371
52 HA ASP 7 HA ASP 7 8.961 -13.489 -5.842
53 HB2 ASP 7 1HB ASP 7 6.688 -15.341 -5.121
54 HB3 ASP 7 2HB ASP 7 8.223 -15.143 -4.281
55 H GLY 8 H GLY 8 10.390 -14.928 -6.620
56 HA2 GLY 8 1HA GLY 8 10.871 -17.142 -7.501
57 HA3 GLY 8 2HA GLY 8 9.376 -17.037 -8.419
58 H VAL 9 H VAL 9 11.424 -14.255 -8.228
59 HA VAL 9 HA VAL 9 12.074 -14.595 -11.072
60 HB VAL 9 HB VAL 9 12.525 -12.162 -11.071
61 HG11 VAL 9 1HG1 VAL 9 10.418 -12.369 -11.841
62 HG12 VAL 9 2HG1 VAL 9 9.910 -13.380 -10.486
63 HG13 VAL 9 3HG1 VAL 9 9.992 -11.627 -10.299
64 HG21 VAL 9 3HG2 VAL 9 12.778 -11.010 -9.187
65 HG22 VAL 9 1HG2 VAL 9 11.168 -11.481 -8.642
66 HG23 VAL 9 2HG2 VAL 9 12.557 -12.506 -8.279
Start of MODEL 14
1 HA VAL 1 HA VAL 1 1.036 -0.501 -3.664
2 HB VAL 1 HB VAL 1 0.906 1.239 -1.916
3 H1 VAL 1 1H VAL 1 -0.356 -1.772 -1.437
4 HG11 VAL 1 1HG1 VAL 1 1.464 0.930 0.246
5 HG12 VAL 1 2HG1 VAL 1 1.144 -0.766 -0.123
6 HG13 VAL 1 3HG1 VAL 1 2.798 -0.154 -0.143
7 HG21 VAL 1 3HG2 VAL 1 3.072 0.501 -3.399
8 HG22 VAL 1 1HG2 VAL 1 2.951 1.986 -2.456
9 HG23 VAL 1 2HG2 VAL 1 3.755 0.572 -1.775
10 H ASP 2 H ASP 2 3.087 -1.336 -4.068
11 HA ASP 2 HA ASP 2 3.711 -3.805 -2.592
12 HB2 ASP 2 1HB ASP 2 5.035 -4.358 -4.716
13 HB3 ASP 2 2HB ASP 2 3.277 -4.397 -4.831
14 H ILE 3 H ILE 3 5.651 -4.056 -1.638
15 HA ILE 3 HA ILE 3 7.631 -1.905 -2.016
16 HB ILE 3 HB ILE 3 8.356 -2.316 0.316
17 HG12 ILE 3 1HG1 ILE 3 5.843 -3.988 0.522
18 HG13 ILE 3 2HG1 ILE 3 7.472 -4.650 0.445
19 HG21 ILE 3 1HG2 ILE 3 6.030 -0.983 -0.590
20 HG22 ILE 3 2HG2 ILE 3 5.665 -1.681 0.987
21 HG23 ILE 3 3HG2 ILE 3 7.042 -0.596 0.802
22 HD11 ILE 3 3HD1 ILE 3 6.415 -2.836 2.601
23 HD12 ILE 3 1HD1 ILE 3 6.627 -4.582 2.726
24 HD13 ILE 3 2HD1 ILE 3 8.033 -3.535 2.530
25 H HIS 4 H HIS 4 7.343 -4.552 -3.362
26 HA HIS 4 HA HIS 4 10.087 -5.278 -3.341
27 HD1 HIS 4 HD1 HIS 4 10.058 -8.809 -3.971
28 HD2 HIS 4 HD2 HIS 4 11.618 -7.056 -0.543
29 HE1 HIS 4 HE1 HIS 4 12.285 -9.916 -3.604
30 HB2 HIS 4 1HB HIS 4 9.074 -6.384 -1.222
31 HB3 HIS 4 2HB HIS 4 8.308 -7.492 -2.356
32 H VAL 5 H VAL 5 10.603 -6.159 -5.255
33 HA VAL 5 HA VAL 5 8.650 -6.419 -7.282
34 HB VAL 5 HB VAL 5 10.434 -7.158 -8.727
35 HG11 VAL 5 1HG1 VAL 5 11.496 -5.169 -8.786
36 HG12 VAL 5 2HG1 VAL 5 10.342 -4.748 -7.519
37 HG13 VAL 5 3HG1 VAL 5 11.978 -5.254 -7.092
38 HG21 VAL 5 3HG2 VAL 5 11.939 -7.617 -6.162
39 HG22 VAL 5 1HG2 VAL 5 11.563 -8.781 -7.432
40 HG23 VAL 5 2HG2 VAL 5 12.738 -7.500 -7.730
41 H TRP 6 H TRP 6 9.142 -8.605 -8.748
42 HA TRP 6 HA TRP 6 7.747 -10.649 -7.311
43 HD1 TRP 6 HD1 TRP 6 5.878 -12.621 -9.776
44 HE1 TRP 6 HE1 TRP 6 3.643 -11.409 -10.176
45 HE3 TRP 6 HE3 TRP 6 7.524 -7.786 -9.545
46 HZ2 TRP 6 HZ2 TRP 6 2.703 -8.754 -10.369
47 HZ3 TRP 6 HZ3 TRP 6 5.893 -5.969 -9.848
48 HH2 TRP 6 HH2 TRP 6 3.533 -6.445 -10.252
49 HB2 TRP 6 1HB TRP 6 8.706 -10.274 -10.111
50 HB3 TRP 6 2HB TRP 6 8.335 -11.910 -9.575
51 H ASP 7 H ASP 7 8.455 -12.722 -6.781
52 HA ASP 7 HA ASP 7 11.377 -12.983 -6.552
53 HB2 ASP 7 1HB ASP 7 9.763 -12.966 -4.486
54 HB3 ASP 7 2HB ASP 7 9.457 -14.636 -4.952
55 H GLY 8 H GLY 8 10.416 -13.626 -8.998
56 HA2 GLY 8 1HA GLY 8 10.759 -15.342 -10.516
57 HA3 GLY 8 2HA GLY 8 11.094 -16.421 -9.170
58 H VAL 9 H VAL 9 8.167 -14.582 -9.138
59 HA VAL 9 HA VAL 9 6.646 -17.062 -9.461
60 HB VAL 9 HB VAL 9 5.631 -14.375 -8.530
61 HG11 VAL 9 1HG1 VAL 9 4.481 -17.141 -8.617
62 HG12 VAL 9 2HG1 VAL 9 3.897 -15.948 -7.456
63 HG13 VAL 9 3HG1 VAL 9 3.780 -15.626 -9.186
64 HG21 VAL 9 3HG2 VAL 9 6.614 -16.718 -6.903
65 HG22 VAL 9 1HG2 VAL 9 7.371 -15.130 -7.021
66 HG23 VAL 9 2HG2 VAL 9 5.793 -15.299 -6.252
Start of MODEL 15
1 HA VAL 1 HA VAL 1 0.254 -0.774 -1.265
2 HB VAL 1 HB VAL 1 0.486 -1.243 -4.240
3 H1 VAL 1 1H VAL 1 2.015 0.538 -3.208
4 HG11 VAL 1 1HG1 VAL 1 -0.638 -2.843 -2.230
5 HG12 VAL 1 2HG1 VAL 1 -1.993 -2.064 -3.050
6 HG13 VAL 1 3HG1 VAL 1 -0.829 -3.013 -3.975
7 HG21 VAL 1 3HG2 VAL 1 -1.213 0.572 -2.599
8 HG22 VAL 1 1HG2 VAL 1 -0.468 0.840 -4.175
9 HG23 VAL 1 2HG2 VAL 1 -1.907 -0.170 -4.040
10 H ASP 2 H ASP 2 2.662 -1.676 -3.737
11 HA ASP 2 HA ASP 2 3.552 -3.841 -1.963
12 HB2 ASP 2 1HB ASP 2 3.840 -5.278 -4.024
13 HB3 ASP 2 2HB ASP 2 2.172 -4.980 -3.540
14 H ILE 3 H ILE 3 5.504 -3.056 -1.407
15 HA ILE 3 HA ILE 3 7.242 -1.940 -3.481
16 HB ILE 3 HB ILE 3 8.688 -1.210 -1.644
17 HG12 ILE 3 1HG1 ILE 3 7.191 -1.488 0.658
18 HG13 ILE 3 2HG1 ILE 3 6.979 -3.047 -0.132
19 HG21 ILE 3 1HG2 ILE 3 5.800 -0.476 -1.687
20 HG22 ILE 3 2HG2 ILE 3 6.845 0.226 -0.453
21 HG23 ILE 3 3HG2 ILE 3 7.211 0.470 -2.160
22 HD11 ILE 3 3HD1 ILE 3 8.963 -2.596 1.529
23 HD12 ILE 3 1HD1 ILE 3 9.168 -3.618 0.107
24 HD13 ILE 3 2HD1 ILE 3 9.725 -1.945 0.078
25 H HIS 4 H HIS 4 6.627 -4.840 -3.168
26 HA HIS 4 HA HIS 4 9.343 -5.835 -2.619
27 HD1 HIS 4 HD1 HIS 4 10.445 -7.685 -2.502
28 HD2 HIS 4 HD2 HIS 4 7.095 -10.048 -1.830
29 HE1 HIS 4 HE1 HIS 4 11.304 -10.044 -2.362
30 HB2 HIS 4 1HB HIS 4 7.578 -6.812 -1.194
31 HB3 HIS 4 2HB HIS 4 6.737 -7.372 -2.636
32 H VAL 5 H VAL 5 10.506 -6.628 -4.250
33 HA VAL 5 HA VAL 5 9.606 -6.457 -6.924
34 HB VAL 5 HB VAL 5 11.725 -7.418 -7.562
35 HG11 VAL 5 1HG1 VAL 5 12.676 -5.893 -5.237
36 HG12 VAL 5 2HG1 VAL 5 12.936 -5.619 -6.961
37 HG13 VAL 5 3HG1 VAL 5 11.434 -5.094 -6.200
38 HG21 VAL 5 3HG2 VAL 5 11.844 -8.292 -4.693
39 HG22 VAL 5 1HG2 VAL 5 12.016 -9.265 -6.153
40 HG23 VAL 5 2HG2 VAL 5 13.298 -8.151 -5.679
41 H TRP 6 H TRP 6 10.391 -8.623 -8.290
42 HA TRP 6 HA TRP 6 8.252 -10.465 -7.825
43 HD1 TRP 6 HD1 TRP 6 7.356 -11.946 -11.013
44 HE1 TRP 6 HE1 TRP 6 5.746 -10.331 -12.206
45 HE3 TRP 6 HE3 TRP 6 9.511 -7.510 -9.666
46 HZ2 TRP 6 HZ2 TRP 6 5.431 -7.545 -12.533
47 HZ3 TRP 6 HZ3 TRP 6 8.494 -5.415 -10.461
48 HH2 TRP 6 HH2 TRP 6 6.496 -5.435 -11.865
49 HB2 TRP 6 1HB TRP 6 10.390 -10.145 -9.885
50 HB3 TRP 6 2HB TRP 6 9.585 -11.706 -9.752
51 H ASP 7 H ASP 7 8.333 -12.583 -7.156
52 HA ASP 7 HA ASP 7 10.826 -13.382 -5.815
53 HB2 ASP 7 1HB ASP 7 9.434 -14.806 -4.393
54 HB3 ASP 7 2HB ASP 7 8.873 -13.137 -4.340
55 H GLY 8 H GLY 8 10.243 -13.751 -8.672
56 HA2 GLY 8 1HA GLY 8 11.009 -15.457 -10.090
57 HA3 GLY 8 2HA GLY 8 10.819 -16.606 -8.774
58 H VAL 9 H VAL 9 8.185 -14.485 -9.398
59 HA VAL 9 HA VAL 9 6.615 -16.756 -10.364
60 HB VAL 9 HB VAL 9 4.645 -15.383 -9.873
61 HG11 VAL 9 1HG1 VAL 9 5.415 -14.962 -7.316
62 HG12 VAL 9 2HG1 VAL 9 4.989 -16.544 -7.973
63 HG13 VAL 9 3HG1 VAL 9 6.682 -16.060 -7.861
64 HG21 VAL 9 3HG2 VAL 9 6.673 -13.278 -9.670
65 HG22 VAL 9 1HG2 VAL 9 4.956 -13.168 -10.059
66 HG23 VAL 9 2HG2 VAL 9 5.475 -13.261 -8.376
Start of MODEL 16
1 HA VAL 1 HA VAL 1 0.562 -0.088 -1.166
2 HB VAL 1 HB VAL 1 1.712 -0.098 -3.333
3 H1 VAL 1 1H VAL 1 1.354 2.664 -1.005
4 HG11 VAL 1 1HG1 VAL 1 0.227 1.333 -4.457
5 HG12 VAL 1 2HG1 VAL 1 -0.604 0.905 -2.961
6 HG13 VAL 1 3HG1 VAL 1 0.181 2.477 -3.117
7 HG21 VAL 1 3HG2 VAL 1 3.510 1.200 -3.563
8 HG22 VAL 1 1HG2 VAL 1 2.397 2.550 -3.785
9 HG23 VAL 1 2HG2 VAL 1 3.051 2.201 -2.185
10 H ASP 2 H ASP 2 2.095 -1.837 -1.673
11 HA ASP 2 HA ASP 2 4.661 -1.503 -0.262
12 HB2 ASP 2 1HB ASP 2 3.091 -2.807 1.105
13 HB3 ASP 2 2HB ASP 2 2.860 -3.934 -0.229
14 H ILE 3 H ILE 3 5.520 -1.056 -2.404
15 HA ILE 3 HA ILE 3 5.401 -2.742 -4.598
16 HB ILE 3 HB ILE 3 7.696 -1.828 -5.171
17 HG12 ILE 3 1HG1 ILE 3 7.487 0.259 -3.132
18 HG13 ILE 3 2HG1 ILE 3 7.824 -1.330 -2.456
19 HG21 ILE 3 1HG2 ILE 3 5.992 0.494 -4.493
20 HG22 ILE 3 2HG2 ILE 3 6.741 0.044 -6.024
21 HG23 ILE 3 3HG2 ILE 3 5.270 -0.769 -5.490
22 HD11 ILE 3 3HD1 ILE 3 9.678 -1.455 -4.227
23 HD12 ILE 3 1HD1 ILE 3 9.459 0.289 -4.362
24 HD13 ILE 3 2HD1 ILE 3 9.924 -0.424 -2.817
25 H HIS 4 H HIS 4 5.692 -4.882 -4.478
26 HA HIS 4 HA HIS 4 8.011 -5.907 -2.989
27 HD1 HIS 4 HD1 HIS 4 7.722 -9.533 -3.746
28 HD2 HIS 4 HD2 HIS 4 6.673 -7.528 -0.262
29 HE1 HIS 4 HE1 HIS 4 8.667 -10.911 -1.867
30 HB2 HIS 4 1HB HIS 4 5.516 -6.699 -2.635
31 HB3 HIS 4 2HB HIS 4 5.865 -7.703 -4.039
32 H VAL 5 H VAL 5 9.453 -7.342 -3.946
33 HA VAL 5 HA VAL 5 9.980 -6.933 -6.693
34 HB VAL 5 HB VAL 5 11.787 -8.511 -6.449
35 HG11 VAL 5 1HG1 VAL 5 12.864 -6.872 -5.410
36 HG12 VAL 5 2HG1 VAL 5 11.359 -6.297 -4.690
37 HG13 VAL 5 3HG1 VAL 5 12.319 -7.526 -3.865
38 HG21 VAL 5 3HG2 VAL 5 10.231 -9.400 -4.063
39 HG22 VAL 5 1HG2 VAL 5 11.001 -10.361 -5.326
40 HG23 VAL 5 2HG2 VAL 5 11.983 -9.595 -4.077
41 H TRP 6 H TRP 6 10.663 -9.251 -7.846
42 HA TRP 6 HA TRP 6 8.095 -10.388 -8.511
43 HD1 TRP 6 HD1 TRP 6 8.874 -13.299 -10.817
44 HE1 TRP 6 HE1 TRP 6 7.184 -13.052 -12.743
45 HE3 TRP 6 HE3 TRP 6 8.635 -8.197 -11.039
46 HZ2 TRP 6 HZ2 TRP 6 5.918 -10.970 -14.168
47 HZ3 TRP 6 HZ3 TRP 6 7.161 -7.157 -12.712
48 HH2 TRP 6 HH2 TRP 6 5.831 -8.516 -14.243
49 HB2 TRP 6 1HB TRP 6 10.307 -9.873 -9.989
50 HB3 TRP 6 2HB TRP 6 10.541 -11.588 -9.661
51 H ASP 7 H ASP 7 7.453 -12.515 -8.253
52 HA ASP 7 HA ASP 7 8.129 -13.830 -5.917
53 HB2 ASP 7 1HB ASP 7 6.911 -14.904 -8.464
54 HB3 ASP 7 2HB ASP 7 7.031 -15.842 -6.978
55 H GLY 8 H GLY 8 9.572 -14.069 -9.097
56 HA2 GLY 8 1HA GLY 8 11.866 -14.717 -9.339
57 HA3 GLY 8 2HA GLY 8 11.684 -15.751 -7.929
58 H VAL 9 H VAL 9 9.203 -15.750 -10.341
59 HA VAL 9 HA VAL 9 10.199 -18.336 -11.346
60 HB VAL 9 HB VAL 9 7.291 -17.613 -10.980
61 HG11 VAL 9 1HG1 VAL 9 8.086 -20.422 -11.151
62 HG12 VAL 9 2HG1 VAL 9 6.779 -19.559 -11.965
63 HG13 VAL 9 3HG1 VAL 9 8.419 -19.493 -12.613
64 HG21 VAL 9 3HG2 VAL 9 9.260 -18.725 -9.105
65 HG22 VAL 9 1HG2 VAL 9 7.720 -17.922 -8.794
66 HG23 VAL 9 2HG2 VAL 9 7.752 -19.632 -9.224
Start of MODEL 17
1 HA VAL 1 HA VAL 1 2.058 -1.421 1.108
2 HB VAL 1 HB VAL 1 1.107 -2.829 -1.390
3 H1 VAL 1 1H VAL 1 2.304 -0.404 -1.648
4 HG11 VAL 1 1HG1 VAL 1 1.665 -4.536 0.061
5 HG12 VAL 1 2HG1 VAL 1 1.252 -3.595 1.495
6 HG13 VAL 1 3HG1 VAL 1 -0.026 -4.252 0.472
7 HG21 VAL 1 3HG2 VAL 1 -0.519 -1.227 -1.111
8 HG22 VAL 1 1HG2 VAL 1 -1.142 -2.514 -0.078
9 HG23 VAL 1 2HG2 VAL 1 -0.291 -1.144 0.636
10 H ASP 2 H ASP 2 3.480 -1.865 -2.090
11 HA ASP 2 HA ASP 2 5.859 -2.989 -0.884
12 HB2 ASP 2 1HB ASP 2 4.001 -4.588 -2.606
13 HB3 ASP 2 2HB ASP 2 5.735 -4.887 -2.691
14 H ILE 3 H ILE 3 7.547 -3.432 -2.623
15 HA ILE 3 HA ILE 3 7.205 -1.624 -4.916
16 HB ILE 3 HB ILE 3 9.613 -0.940 -4.606
17 HG12 ILE 3 1HG1 ILE 3 9.226 -1.869 -1.763
18 HG13 ILE 3 2HG1 ILE 3 10.045 -2.857 -2.968
19 HG21 ILE 3 1HG2 ILE 3 7.325 -0.126 -2.918
20 HG22 ILE 3 2HG2 ILE 3 8.911 0.494 -2.465
21 HG23 ILE 3 3HG2 ILE 3 8.271 0.808 -4.077
22 HD11 ILE 3 3HD1 ILE 3 10.952 -0.058 -2.516
23 HD12 ILE 3 1HD1 ILE 3 11.405 -1.320 -1.371
24 HD13 ILE 3 2HD1 ILE 3 11.862 -1.464 -3.069
25 H HIS 4 H HIS 4 7.005 -4.479 -4.831
26 HA HIS 4 HA HIS 4 8.691 -5.139 -7.004
27 HD1 HIS 4 HD1 HIS 4 9.376 -8.600 -6.572
28 HD2 HIS 4 HD2 HIS 4 12.322 -5.671 -6.611
29 HE1 HIS 4 HE1 HIS 4 11.187 -9.488 -8.075
30 HB2 HIS 4 1HB HIS 4 10.234 -5.284 -4.927
31 HB3 HIS 4 2HB HIS 4 9.338 -6.752 -4.550
32 H VAL 5 H VAL 5 7.727 -6.688 -8.166
33 HA VAL 5 HA VAL 5 5.250 -7.779 -7.351
34 HB VAL 5 HB VAL 5 5.249 -8.999 -9.430
35 HG11 VAL 5 1HG1 VAL 5 4.983 -7.174 -10.713
36 HG12 VAL 5 2HG1 VAL 5 5.351 -6.293 -9.229
37 HG13 VAL 5 3HG1 VAL 5 6.623 -6.599 -10.413
38 HG21 VAL 5 3HG2 VAL 5 8.168 -8.263 -9.640
39 HG22 VAL 5 1HG2 VAL 5 7.514 -9.878 -9.367
40 HG23 VAL 5 2HG2 VAL 5 7.219 -9.054 -10.898
41 H TRP 6 H TRP 6 5.118 -10.361 -8.054
42 HA TRP 6 HA TRP 6 7.108 -11.777 -6.422
43 HD1 TRP 6 HD1 TRP 6 5.335 -15.001 -5.542
44 HE1 TRP 6 HE1 TRP 6 6.401 -15.801 -3.340
45 HE3 TRP 6 HE3 TRP 6 6.162 -10.460 -3.345
46 HZ2 TRP 6 HZ2 TRP 6 7.452 -14.657 -0.983
47 HZ3 TRP 6 HZ3 TRP 6 7.202 -10.400 -1.116
48 HH2 TRP 6 HH2 TRP 6 7.832 -12.456 0.039
49 HB2 TRP 6 1HB TRP 6 4.763 -11.217 -5.313
50 HB3 TRP 6 2HB TRP 6 4.253 -12.629 -6.234
51 H ASP 7 H ASP 7 8.078 -13.065 -7.853
52 HA ASP 7 HA ASP 7 6.518 -15.059 -9.239
53 HB2 ASP 7 1HB ASP 7 7.867 -12.813 -10.675
54 HB3 ASP 7 2HB ASP 7 7.888 -14.414 -11.410
55 H GLY 8 H GLY 8 8.680 -14.795 -7.192
56 HA2 GLY 8 1HA GLY 8 10.301 -16.380 -6.602
57 HA3 GLY 8 2HA GLY 8 10.385 -16.887 -8.283
58 H VAL 9 H VAL 9 10.565 -13.512 -7.606
59 HA VAL 9 HA VAL 9 13.452 -13.581 -8.195
60 HB VAL 9 HB VAL 9 11.497 -11.349 -8.767
61 HG11 VAL 9 1HG1 VAL 9 14.449 -11.654 -9.149
62 HG12 VAL 9 2HG1 VAL 9 13.509 -10.612 -10.219
63 HG13 VAL 9 3HG1 VAL 9 13.543 -10.295 -8.484
64 HG21 VAL 9 3HG2 VAL 9 12.654 -12.356 -11.131
65 HG22 VAL 9 1HG2 VAL 9 12.083 -13.747 -10.209
66 HG23 VAL 9 2HG2 VAL 9 10.967 -12.446 -10.625
Start of MODEL 18
1 HA VAL 1 HA VAL 1 1.370 0.120 -2.249
2 HB VAL 1 HB VAL 1 2.251 0.385 0.629
3 H1 VAL 1 1H VAL 1 0.038 -1.283 -0.048
4 HG11 VAL 1 1HG1 VAL 1 3.798 2.096 -0.354
5 HG12 VAL 1 2HG1 VAL 1 4.145 0.430 -0.819
6 HG13 VAL 1 3HG1 VAL 1 3.329 1.510 -1.949
7 HG21 VAL 1 3HG2 VAL 1 0.292 1.708 0.369
8 HG22 VAL 1 1HG2 VAL 1 1.669 2.806 0.276
9 HG23 VAL 1 2HG2 VAL 1 0.831 2.315 -1.196
10 H ASP 2 H ASP 2 3.253 -0.822 -2.952
11 HA ASP 2 HA ASP 2 4.404 -3.033 -1.451
12 HB2 ASP 2 1HB ASP 2 2.867 -3.339 -3.981
13 HB3 ASP 2 2HB ASP 2 4.339 -4.292 -3.807
14 H ILE 3 H ILE 3 6.549 -3.352 -1.863
15 HA ILE 3 HA ILE 3 7.754 -1.791 -4.047
16 HB ILE 3 HB ILE 3 9.703 -1.359 -2.493
17 HG12 ILE 3 1HG1 ILE 3 7.753 -1.766 -0.249
18 HG13 ILE 3 2HG1 ILE 3 8.725 -3.116 -0.825
19 HG21 ILE 3 1HG2 ILE 3 7.042 -0.088 -2.417
20 HG22 ILE 3 2HG2 ILE 3 8.165 0.380 -1.142
21 HG23 ILE 3 3HG2 ILE 3 8.615 0.591 -2.834
22 HD11 ILE 3 3HD1 ILE 3 10.149 -0.602 -0.205
23 HD12 ILE 3 1HD1 ILE 3 9.498 -1.523 1.151
24 HD13 ILE 3 2HD1 ILE 3 10.639 -2.278 0.037
25 H HIS 4 H HIS 4 7.096 -4.640 -3.801
26 HA HIS 4 HA HIS 4 9.741 -5.679 -4.450
27 HD1 HIS 4 HD1 HIS 4 10.357 -7.963 -4.907
28 HD2 HIS 4 HD2 HIS 4 10.693 -8.000 -0.766
29 HE1 HIS 4 HE1 HIS 4 12.352 -9.411 -4.407
30 HB2 HIS 4 1HB HIS 4 8.978 -6.134 -1.958
31 HB3 HIS 4 2HB HIS 4 8.025 -7.406 -2.717
32 H VAL 5 H VAL 5 9.657 -6.813 -6.273
33 HA VAL 5 HA VAL 5 7.228 -7.262 -7.649
34 HB VAL 5 HB VAL 5 8.542 -8.376 -9.338
35 HG11 VAL 5 1HG1 VAL 5 8.766 -5.820 -8.779
36 HG12 VAL 5 2HG1 VAL 5 10.429 -6.271 -8.398
37 HG13 VAL 5 3HG1 VAL 5 9.781 -6.568 -10.012
38 HG21 VAL 5 3HG2 VAL 5 10.529 -8.646 -7.126
39 HG22 VAL 5 1HG2 VAL 5 9.977 -9.846 -8.296
40 HG23 VAL 5 2HG2 VAL 5 11.091 -8.573 -8.796
41 H TRP 6 H TRP 6 7.247 -9.699 -8.759
42 HA TRP 6 HA TRP 6 6.290 -11.363 -6.614
43 HD1 TRP 6 HD1 TRP 6 3.683 -13.569 -7.951
44 HE1 TRP 6 HE1 TRP 6 1.455 -12.298 -7.739
45 HE3 TRP 6 HE3 TRP 6 5.330 -8.853 -9.042
46 HZ2 TRP 6 HZ2 TRP 6 0.519 -9.648 -8.000
47 HZ3 TRP 6 HZ3 TRP 6 3.704 -7.006 -9.040
48 HH2 TRP 6 HH2 TRP 6 1.349 -7.398 -8.530
49 HB2 TRP 6 1HB TRP 6 6.230 -11.452 -9.589
50 HB3 TRP 6 2HB TRP 6 6.058 -12.979 -8.727
51 H ASP 7 H ASP 7 7.628 -12.548 -5.431
52 HA ASP 7 HA ASP 7 10.274 -13.182 -6.141
53 HB2 ASP 7 1HB ASP 7 9.143 -13.110 -3.804
54 HB3 ASP 7 2HB ASP 7 8.708 -14.784 -4.138
55 H GLY 8 H GLY 8 11.058 -14.687 -7.456
56 HA2 GLY 8 1HA GLY 8 11.192 -17.039 -8.052
57 HA3 GLY 8 2HA GLY 8 9.440 -17.109 -7.931
58 H VAL 9 H VAL 9 9.558 -14.337 -9.340
59 HA VAL 9 HA VAL 9 9.534 -15.477 -12.042
60 HB VAL 9 HB VAL 9 8.441 -12.811 -11.137
61 HG11 VAL 9 1HG1 VAL 9 8.983 -13.774 -13.686
62 HG12 VAL 9 2HG1 VAL 9 7.247 -14.013 -13.481
63 HG13 VAL 9 3HG1 VAL 9 7.948 -12.408 -13.271
64 HG21 VAL 9 3HG2 VAL 9 7.149 -15.516 -11.348
65 HG22 VAL 9 1HG2 VAL 9 7.152 -14.398 -9.983
66 HG23 VAL 9 2HG2 VAL 9 6.214 -14.023 -11.428
Start of MODEL 19
1 HA VAL 1 HA VAL 1 2.263 1.685 -1.760
2 HB VAL 1 HB VAL 1 1.077 2.101 0.328
3 H1 VAL 1 1H VAL 1 -0.084 0.627 -1.323
4 HG11 VAL 1 1HG1 VAL 1 1.202 0.613 2.214
5 HG12 VAL 1 2HG1 VAL 1 0.564 -0.276 0.830
6 HG13 VAL 1 3HG1 VAL 1 2.244 -0.495 1.322
7 HG21 VAL 1 3HG2 VAL 1 3.710 1.276 1.375
8 HG22 VAL 1 1HG2 VAL 1 3.729 2.312 -0.052
9 HG23 VAL 1 2HG2 VAL 1 2.913 2.849 1.417
10 H ASP 2 H ASP 2 1.878 -1.666 -0.824
11 HA ASP 2 HA ASP 2 4.531 -2.305 -0.229
12 HB2 ASP 2 1HB ASP 2 2.227 -3.913 -1.301
13 HB3 ASP 2 2HB ASP 2 3.813 -4.645 -1.071
14 H ILE 3 H ILE 3 6.312 -2.456 -1.423
15 HA ILE 3 HA ILE 3 6.026 -2.400 -4.352
16 HB ILE 3 HB ILE 3 8.370 -1.521 -4.358
17 HG12 ILE 3 1HG1 ILE 3 8.009 -0.836 -1.465
18 HG13 ILE 3 2HG1 ILE 3 8.665 -2.410 -1.901
19 HG21 ILE 3 1HG2 ILE 3 6.148 0.003 -3.035
20 HG22 ILE 3 2HG2 ILE 3 7.688 0.761 -3.438
21 HG23 ILE 3 3HG2 ILE 3 6.686 0.070 -4.713
22 HD11 ILE 3 3HD1 ILE 3 10.010 0.057 -1.695
23 HD12 ILE 3 1HD1 ILE 3 10.663 -1.512 -2.165
24 HD13 ILE 3 2HD1 ILE 3 10.031 -0.416 -3.394
25 H HIS 4 H HIS 4 5.827 -4.843 -2.957
26 HA HIS 4 HA HIS 4 8.252 -6.264 -2.806
27 HD1 HIS 4 HD1 HIS 4 8.251 -9.133 -3.818
28 HD2 HIS 4 HD2 HIS 4 6.421 -8.668 -0.118
29 HE1 HIS 4 HE1 HIS 4 9.161 -10.985 -2.380
30 HB2 HIS 4 1HB HIS 4 5.798 -6.848 -2.000
31 HB3 HIS 4 2HB HIS 4 5.728 -7.675 -3.553
32 H VAL 5 H VAL 5 9.559 -7.008 -4.338
33 HA VAL 5 HA VAL 5 9.076 -6.551 -7.085
34 HB VAL 5 HB VAL 5 11.157 -7.696 -7.508
35 HG11 VAL 5 1HG1 VAL 5 11.399 -5.474 -6.650
36 HG12 VAL 5 2HG1 VAL 5 11.217 -6.042 -4.989
37 HG13 VAL 5 3HG1 VAL 5 12.649 -6.482 -5.921
38 HG21 VAL 5 3HG2 VAL 5 10.819 -8.743 -4.709
39 HG22 VAL 5 1HG2 VAL 5 10.999 -9.658 -6.206
40 HG23 VAL 5 2HG2 VAL 5 12.369 -8.761 -5.551
41 H TRP 6 H TRP 6 9.828 -8.690 -8.511
42 HA TRP 6 HA TRP 6 7.471 -10.317 -8.485
43 HD1 TRP 6 HD1 TRP 6 6.888 -11.430 -11.913
44 HE1 TRP 6 HE1 TRP 6 5.613 -9.555 -13.131
45 HE3 TRP 6 HE3 TRP 6 9.218 -7.382 -9.835
46 HZ2 TRP 6 HZ2 TRP 6 5.597 -6.733 -13.201
47 HZ3 TRP 6 HZ3 TRP 6 8.514 -5.130 -10.531
48 HH2 TRP 6 HH2 TRP 6 6.741 -4.814 -12.180
49 HB2 TRP 6 1HB TRP 6 9.884 -10.077 -10.228
50 HB3 TRP 6 2HB TRP 6 8.913 -11.542 -10.339
51 H ASP 7 H ASP 7 7.291 -12.517 -8.088
52 HA ASP 7 HA ASP 7 8.688 -13.583 -5.952
53 HB2 ASP 7 1HB ASP 7 7.797 -15.832 -6.863
54 HB3 ASP 7 2HB ASP 7 6.628 -14.594 -6.412
55 H GLY 8 H GLY 8 9.391 -13.756 -9.383
56 HA2 GLY 8 1HA GLY 8 11.570 -14.072 -10.243
57 HA3 GLY 8 2HA GLY 8 12.031 -14.839 -8.730
58 H VAL 9 H VAL 9 9.341 -16.369 -9.065
59 HA VAL 9 HA VAL 9 10.503 -18.486 -10.744
60 HB VAL 9 HB VAL 9 8.912 -20.005 -9.564
61 HG11 VAL 9 1HG1 VAL 9 10.325 -20.347 -7.768
62 HG12 VAL 9 2HG1 VAL 9 11.347 -19.415 -8.864
63 HG13 VAL 9 3HG1 VAL 9 10.566 -18.622 -7.495
64 HG21 VAL 9 3HG2 VAL 9 8.471 -18.300 -7.282
65 HG22 VAL 9 1HG2 VAL 9 7.747 -17.608 -8.734
66 HG23 VAL 9 2HG2 VAL 9 7.310 -19.238 -8.222
Start of MODEL 20
1 HA VAL 1 HA VAL 1 0.001 -2.107 -1.678
2 HB VAL 1 HB VAL 1 0.418 -2.520 -4.641
3 H1 VAL 1 1H VAL 1 0.931 -0.193 -3.510
4 HG11 VAL 1 1HG1 VAL 1 -1.693 -3.957 -4.225
5 HG12 VAL 1 2HG1 VAL 1 -0.115 -4.601 -3.764
6 HG13 VAL 1 3HG1 VAL 1 -1.184 -3.921 -2.537
7 HG21 VAL 1 3HG2 VAL 1 -1.406 -0.780 -3.185
8 HG22 VAL 1 1HG2 VAL 1 -1.016 -0.828 -4.904
9 HG23 VAL 1 2HG2 VAL 1 -2.241 -1.913 -4.247
10 H ASP 2 H ASP 2 2.633 -2.353 -4.072
11 HA ASP 2 HA ASP 2 3.766 -4.540 -2.453
12 HB2 ASP 2 1HB ASP 2 4.015 -4.105 -5.437
13 HB3 ASP 2 2HB ASP 2 4.766 -5.412 -4.526
14 H ILE 3 H ILE 3 5.718 -4.214 -1.608
15 HA ILE 3 HA ILE 3 7.317 -1.965 -2.644
16 HB ILE 3 HB ILE 3 8.325 -1.860 -0.355
17 HG12 ILE 3 1HG1 ILE 3 5.962 -3.521 0.511
18 HG13 ILE 3 2HG1 ILE 3 7.545 -4.229 0.212
19 HG21 ILE 3 1HG2 ILE 3 5.384 -1.351 -0.721
20 HG22 ILE 3 2HG2 ILE 3 6.284 -0.806 0.693
21 HG23 ILE 3 3HG2 ILE 3 6.718 -0.215 -0.911
22 HD11 ILE 3 3HD1 ILE 3 7.943 -2.018 1.909
23 HD12 ILE 3 1HD1 ILE 3 6.572 -2.927 2.546
24 HD13 ILE 3 2HD1 ILE 3 8.120 -3.732 2.284
25 H HIS 4 H HIS 4 7.415 -4.690 -3.617
26 HA HIS 4 HA HIS 4 10.262 -5.110 -3.344
27 HD1 HIS 4 HD1 HIS 4 10.231 -8.792 -4.189
28 HD2 HIS 4 HD2 HIS 4 11.692 -7.000 -0.738
29 HE1 HIS 4 HE1 HIS 4 12.448 -9.894 -3.746
30 HB2 HIS 4 1HB HIS 4 9.115 -6.419 -1.470
31 HB3 HIS 4 2HB HIS 4 8.448 -7.441 -2.739
32 H VAL 5 H VAL 5 11.158 -6.266 -5.053
33 HA VAL 5 HA VAL 5 9.729 -6.192 -7.490
34 HB VAL 5 HB VAL 5 11.672 -7.192 -8.510
35 HG11 VAL 5 1HG1 VAL 5 12.953 -5.531 -6.409
36 HG12 VAL 5 2HG1 VAL 5 13.102 -5.449 -8.165
37 HG13 VAL 5 3HG1 VAL 5 11.667 -4.802 -7.369
38 HG21 VAL 5 3HG2 VAL 5 12.486 -7.871 -5.690
39 HG22 VAL 5 1HG2 VAL 5 12.156 -8.986 -7.016
40 HG23 VAL 5 2HG2 VAL 5 13.581 -7.948 -7.070
41 H TRP 6 H TRP 6 10.218 -8.415 -8.902
42 HA TRP 6 HA TRP 6 8.234 -10.232 -7.909
43 HD1 TRP 6 HD1 TRP 6 6.683 -11.824 -10.857
44 HE1 TRP 6 HE1 TRP 6 4.798 -10.257 -11.643
45 HE3 TRP 6 HE3 TRP 6 8.928 -7.326 -9.929
46 HZ2 TRP 6 HZ2 TRP 6 4.327 -7.481 -11.844
47 HZ3 TRP 6 HZ3 TRP 6 7.693 -5.262 -10.447
48 HH2 TRP 6 HH2 TRP 6 5.440 -5.340 -11.385
49 HB2 TRP 6 1HB TRP 6 9.827 -9.963 -10.418
50 HB3 TRP 6 2HB TRP 6 9.099 -11.527 -10.059
51 H ASP 7 H ASP 7 8.502 -12.133 -6.904
52 HA ASP 7 HA ASP 7 11.257 -13.016 -6.391
53 HB2 ASP 7 1HB ASP 7 10.343 -14.193 -4.443
54 HB3 ASP 7 2HB ASP 7 9.926 -12.482 -4.398
55 H GLY 8 H GLY 8 10.041 -13.633 -8.875
56 HA2 GLY 8 1HA GLY 8 10.292 -15.581 -10.177
57 HA3 GLY 8 2HA GLY 8 10.164 -16.547 -8.715
58 H VAL 9 H VAL 9 7.731 -14.707 -8.101
59 HA VAL 9 HA VAL 9 5.829 -16.218 -9.773
60 HB VAL 9 HB VAL 9 4.227 -15.911 -7.830
61 HG11 VAL 9 1HG1 VAL 9 6.357 -17.794 -8.216
62 HG12 VAL 9 2HG1 VAL 9 6.013 -17.614 -6.494
63 HG13 VAL 9 3HG1 VAL 9 4.723 -18.065 -7.610
64 HG21 VAL 9 3HG2 VAL 9 4.958 -15.232 -5.745
65 HG22 VAL 9 1HG2 VAL 9 6.651 -15.554 -6.119
66 HG23 VAL 9 2HG2 VAL 9 5.848 -14.145 -6.811