Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
624075 | 6beq RC | 30359 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 H1 ALA 1 24.350 24.510 11.990
2 HA ALA 1 HA ALA 1 24.890 26.550 13.480
3 HB1 ALA 1 HB1 ALA 1 24.790 26.350 11.010
4 HB2 ALA 1 HB2 ALA 1 24.230 27.890 11.850
5 HB3 ALA 1 HB3 ALA 1 23.100 26.650 11.110
6 H ALA 2 H ALA 2 21.560 25.310 13.090
7 HA ALA 2 HA ALA 2 20.130 27.270 14.420
8 HB1 ALA 2 HB1 ALA 2 19.990 24.150 14.360
9 HB2 ALA 2 HB2 ALA 2 19.390 25.290 13.080
10 HB3 ALA 2 HB3 ALA 2 18.580 25.240 14.600
11 H ARG 3 H ARG 3 22.410 25.240 15.910
12 HA ARG 3 HA ARG 3 21.530 26.250 18.550
13 HB2 ARG 3 HB2 ARG 3 22.230 24.160 19.630
14 HB3 ARG 3 HB1 ARG 3 20.750 24.070 18.800
15 HG2 ARG 3 HG2 ARG 3 22.060 22.950 16.900
16 HG3 ARG 3 HG1 ARG 3 23.530 23.100 17.890
17 HD2 ARG 3 HD2 ARG 3 22.180 21.720 19.670
18 HD3 ARG 3 HD1 ARG 3 21.010 21.420 18.380
19 HE ARG 3 HE ARG 3 23.500 20.110 18.790
20 HH11 ARG 3 1HH1 ARG 3 24.410 18.780 17.230
21 HH12 ARG 3 2HH1 ARG 3 23.540 18.580 15.740
22 HH21 ARG 3 1HH2 ARG 3 21.230 21.000 16.170
23 HH22 ARG 3 2HH2 ARG 3 21.910 19.810 15.100
24 H DVA 4 H DVA 4 24.260 25.850 16.420
25 HA DVA 4 HA DVA 4 26.040 26.550 18.750
26 HB DVA 4 HB DVA 4 25.950 27.860 16.060
27 HG11 DVA 4 1HG1 DVA 4 25.540 30.040 17.630
28 HG12 DVA 4 2HG1 DVA 4 25.090 28.780 18.780
29 HG13 DVA 4 3HG1 DVA 4 24.270 28.880 17.200
30 HG21 DVA 4 1HG2 DVA 4 28.210 27.740 16.770
31 HG22 DVA 4 2HG2 DVA 4 27.800 28.400 18.370
32 HG23 DVA 4 3HG2 DVA 4 27.680 29.360 16.850
33 HA DPR 5 HA DPR 5 27.690 22.940 16.970
34 HB2 DPR 5 HB1 DPR 5 29.780 22.420 18.690
35 HB3 DPR 5 HB2 DPR 5 28.100 21.940 19.010
36 HG2 DPR 5 HG1 DPR 5 29.490 24.340 20.130
37 HG3 DPR 5 HG2 DPR 5 28.400 23.320 20.950
38 HD2 DPR 5 HD1 DPR 5 27.500 25.670 19.880
39 HD3 DPR 5 HD2 DPR 5 26.510 24.260 19.910
40 H ARG 6 H ARG 6 29.330 22.250 15.560
41 HA ARG 6 HA ARG 6 31.740 24.010 15.380
42 HB2 ARG 6 HB2 ARG 6 32.710 22.240 14.280
43 HB3 ARG 6 HB1 ARG 6 31.610 21.490 15.440
44 HG2 ARG 6 HG2 ARG 6 29.950 21.350 13.350
45 HG3 ARG 6 HG1 ARG 6 31.370 21.830 12.450
46 HD2 ARG 6 HD2 ARG 6 32.520 19.830 13.010
47 HD3 ARG 6 HD1 ARG 6 31.320 19.500 14.360
48 HE ARG 6 HE ARG 6 30.970 19.000 11.460
49 HH11 ARG 6 1HH1 ARG 6 29.550 17.370 11.040
50 HH12 ARG 6 2HH1 ARG 6 28.280 16.990 12.210
51 HH21 ARG 6 1HH2 ARG 6 29.230 19.270 14.590
52 HH22 ARG 6 2HH2 ARG 6 28.170 17.890 14.090
53 H DLE 7 H DLE 7 28.790 24.600 14.310
54 HA DLE 7 HA DLE 7 29.700 25.670 11.660
55 HB2 DLE 7 HB1 DLE 7 27.050 26.140 13.040
56 HB3 DLE 7 HB2 DLE 7 27.610 26.820 11.630
57 HG DLE 7 HG DLE 7 28.650 27.140 14.500
58 HD11 DLE 7 1HD1 DLE 7 30.350 28.100 12.260
59 HD12 DLE 7 2HD1 DLE 7 30.840 27.000 13.620
60 HD13 DLE 7 3HD1 DLE 7 30.490 28.740 13.780
61 HD21 DLE 7 1HD2 DLE 7 28.180 29.400 14.190
62 HD22 DLE 7 2HD2 DLE 7 26.810 28.580 13.460
63 HD23 DLE 7 3HD2 DLE 7 28.120 29.170 12.420
64 H DTH 8 H DTH 8 28.370 25.260 9.580
65 HA DTH 8 HA DTH 8 28.210 22.500 9.330
66 HB DTH 8 HB DTH 8 28.850 23.910 7.680
67 HG21 DTH 8 1HG2 DTH 8 26.130 22.590 7.000
68 HG22 DTH 8 2HG2 DTH 8 27.760 22.020 6.620
69 HG23 DTH 8 3HG2 DTH 8 27.230 23.360 5.760
70 HG1 DTH 8 HG1 DTH 8 28.000 25.560 7.150
71 HA PRO 9 HA PRO 9 23.840 21.600 9.490
72 HB2 PRO 9 HB2 PRO 9 23.850 19.420 11.060
73 HB3 PRO 9 HB1 PRO 9 24.190 19.370 9.330
74 HG2 PRO 9 HG2 PRO 9 26.140 19.370 11.790
75 HG3 PRO 9 HG1 PRO 9 26.290 18.430 10.240
76 HD2 PRO 9 HD2 PRO 9 27.550 20.810 10.810
77 HD3 PRO 9 HD1 PRO 9 27.170 20.030 9.200
78 H GLU 10 H GLU 10 25.990 22.330 12.190
79 HA GLU 10 HA GLU 10 23.750 22.020 14.140
80 HB2 GLU 10 HB2 GLU 10 26.670 22.820 14.680
81 HB3 GLU 10 HB1 GLU 10 25.400 22.550 15.820
82 HG2 GLU 10 HG2 GLU 10 25.390 20.080 14.580
83 HG3 GLU 10 HG1 GLU 10 26.860 20.690 13.930
Start of MODEL 2
1 H1 ALA 1 H1 ALA 1 24.062 24.476 12.022
2 HA ALA 1 HA ALA 1 24.970 26.394 13.966
3 HB1 ALA 1 HB1 ALA 1 25.184 26.146 11.398
4 HB2 ALA 1 HB2 ALA 1 25.018 27.739 12.104
5 HB3 ALA 1 HB3 ALA 1 23.578 26.872 11.336
6 H ALA 2 H ALA 2 21.814 25.014 13.597
7 HA ALA 2 HA ALA 2 20.279 27.365 14.171
8 HB1 ALA 2 HB1 ALA 2 19.650 24.463 14.306
9 HB2 ALA 2 HB2 ALA 2 19.199 25.565 13.022
10 HB3 ALA 2 HB3 ALA 2 18.550 25.869 14.662
11 H ARG 3 H ARG 3 22.311 25.050 15.853
12 HA ARG 3 HA ARG 3 21.676 26.205 18.547
13 HB2 ARG 3 HB2 ARG 3 21.840 24.031 19.552
14 HB3 ARG 3 HB1 ARG 3 20.510 24.202 18.458
15 HG2 ARG 3 HG2 ARG 3 21.640 22.742 16.792
16 HG3 ARG 3 HG1 ARG 3 23.190 23.064 17.625
17 HD2 ARG 3 HD2 ARG 3 22.353 21.767 19.565
18 HD3 ARG 3 HD1 ARG 3 20.878 21.483 18.785
19 HE ARG 3 HE ARG 3 21.939 19.799 17.488
20 HH11 ARG 3 1HH1 ARG 3 23.419 18.995 16.211
21 HH12 ARG 3 2HH1 ARG 3 25.159 19.454 16.447
22 HH21 ARG 3 1HH2 ARG 3 24.555 21.553 19.075
23 HH22 ARG 3 2HH2 ARG 3 25.741 20.900 17.913
24 H DVA 4 H DVA 4 24.040 26.643 16.621
25 HA DVA 4 HA DVA 4 25.949 26.661 18.817
26 HB DVA 4 HB DVA 4 26.108 27.930 16.096
27 HG11 DVA 4 1HG1 DVA 4 25.595 29.000 18.843
28 HG12 DVA 4 2HG1 DVA 4 24.488 29.039 17.431
29 HG13 DVA 4 3HG1 DVA 4 25.885 29.924 17.302
30 HG21 DVA 4 1HG2 DVA 4 28.039 29.158 17.231
31 HG22 DVA 4 2HG2 DVA 4 28.313 27.492 16.703
32 HG23 DVA 4 3HG2 DVA 4 27.962 27.834 18.466
33 HA DPR 5 HA DPR 5 27.750 22.928 17.019
34 HB2 DPR 5 HB1 DPR 5 29.797 22.540 18.729
35 HB3 DPR 5 HB2 DPR 5 28.006 22.241 19.112
36 HG2 DPR 5 HG1 DPR 5 29.746 24.738 19.648
37 HG3 DPR 5 HG2 DPR 5 28.846 23.713 20.838
38 HD2 DPR 5 HD1 DPR 5 27.660 25.963 19.736
39 HD3 DPR 5 HD2 DPR 5 26.716 24.478 19.956
40 H ARG 6 H ARG 6 29.482 22.394 15.734
41 HA ARG 6 HA ARG 6 31.662 24.190 15.491
42 HB2 ARG 6 HB2 ARG 6 32.738 22.585 14.181
43 HB3 ARG 6 HB1 ARG 6 31.984 21.694 15.285
44 HG2 ARG 6 HG2 ARG 6 30.100 21.861 13.140
45 HG3 ARG 6 HG1 ARG 6 31.668 21.813 12.354
46 HD2 ARG 6 HD2 ARG 6 32.263 19.686 13.485
47 HD3 ARG 6 HD1 ARG 6 30.818 19.713 14.383
48 HE ARG 6 HE ARG 6 31.016 19.340 11.420
49 HH11 ARG 6 1HH1 ARG 6 29.834 17.561 10.612
50 HH12 ARG 6 2HH1 ARG 6 28.300 17.241 11.442
51 HH21 ARG 6 1HH2 ARG 6 28.858 19.325 14.095
52 HH22 ARG 6 2HH2 ARG 6 27.734 18.152 13.417
53 H DLE 7 H DLE 7 28.565 24.047 14.026
54 HA DLE 7 HA DLE 7 29.452 25.516 11.578
55 HB2 DLE 7 HB1 DLE 7 27.082 26.161 13.302
56 HB3 DLE 7 HB2 DLE 7 27.507 26.933 11.841
57 HG DLE 7 HG DLE 7 29.089 27.184 14.349
58 HD11 DLE 7 1HD1 DLE 7 30.602 27.479 12.355
59 HD12 DLE 7 2HD1 DLE 7 30.389 28.852 13.279
60 HD13 DLE 7 3HD1 DLE 7 29.339 28.734 11.788
61 HD21 DLE 7 1HD2 DLE 7 28.085 29.332 14.391
62 HD22 DLE 7 2HD2 DLE 7 26.685 28.195 14.138
63 HD23 DLE 7 3HD2 DLE 7 27.343 29.177 12.862
64 H DTH 8 H DTH 8 27.656 25.799 9.926
65 HA DTH 8 HA DTH 8 27.616 23.253 8.939
66 HB DTH 8 HB DTH 8 26.133 25.827 8.216
67 HG21 DTH 8 1HG2 DTH 8 27.612 25.791 6.253
68 HG22 DTH 8 2HG2 DTH 8 28.479 24.330 6.984
69 HG23 DTH 8 3HG2 DTH 8 28.458 25.904 7.801
70 HG1 DTH 8 HG1 DTH 8 24.957 24.397 7.126
71 HA PRO 9 HA PRO 9 23.618 21.574 9.594
72 HB2 PRO 9 HB2 PRO 9 25.275 19.261 10.614
73 HB3 PRO 9 HB1 PRO 9 23.802 19.363 9.578
74 HG2 PRO 9 HG2 PRO 9 26.423 19.037 8.557
75 HG3 PRO 9 HG1 PRO 9 25.310 20.049 7.643
76 HD2 PRO 9 HD2 PRO 9 27.244 20.929 9.752
77 HD3 PRO 9 HD1 PRO 9 27.037 21.617 8.153
78 H GLU 10 H GLU 10 25.563 22.638 11.905
79 HA GLU 10 HA GLU 10 23.816 21.822 14.205
80 HB2 GLU 10 HB2 GLU 10 26.553 23.109 14.396
81 HB3 GLU 10 HB1 GLU 10 25.501 22.424 15.659
82 HG2 GLU 10 HG2 GLU 10 25.764 20.150 14.423
83 HG3 GLU 10 HG1 GLU 10 26.996 20.923 13.538
Start of MODEL 3
1 H1 ALA 1 H1 ALA 1 24.262 24.619 12.027
2 HA ALA 1 HA ALA 1 24.728 26.727 13.631
3 HB1 ALA 1 HB1 ALA 1 24.034 28.160 11.630
4 HB2 ALA 1 HB2 ALA 1 22.949 26.938 11.130
5 HB3 ALA 1 HB3 ALA 1 24.689 26.609 10.974
6 H ALA 2 H ALA 2 21.476 25.318 13.043
7 HA ALA 2 HA ALA 2 20.108 27.348 14.434
8 HB1 ALA 2 HB1 ALA 2 19.453 24.416 14.179
9 HB2 ALA 2 HB2 ALA 2 19.047 25.604 12.917
10 HB3 ALA 2 HB3 ALA 2 18.400 25.706 14.607
11 H ARG 3 H ARG 3 22.299 25.094 15.794
12 HA ARG 3 HA ARG 3 21.432 25.816 18.482
13 HB2 ARG 3 HB2 ARG 3 21.802 23.414 19.105
14 HB3 ARG 3 HB1 ARG 3 20.379 23.744 18.209
15 HG2 ARG 3 HG2 ARG 3 21.511 22.960 16.102
16 HG3 ARG 3 HG1 ARG 3 22.959 22.578 16.996
17 HD2 ARG 3 HD2 ARG 3 21.728 20.959 18.264
18 HD3 ARG 3 HD1 ARG 3 20.215 21.326 17.415
19 HE ARG 3 HE ARG 3 20.976 20.298 15.493
20 HH11 ARG 3 1HH1 ARG 3 22.200 18.890 14.372
21 HH12 ARG 3 2HH1 ARG 3 23.821 18.324 14.974
22 HH21 ARG 3 1HH2 ARG 3 23.347 19.460 18.052
23 HH22 ARG 3 2HH2 ARG 3 24.441 18.856 16.830
24 H DVA 4 H DVA 4 24.416 25.053 16.705
25 HA DVA 4 HA DVA 4 25.843 26.306 19.006
26 HB DVA 4 HB DVA 4 25.888 27.291 16.212
27 HG11 DVA 4 1HG1 DVA 4 23.749 27.890 17.318
28 HG12 DVA 4 2HG1 DVA 4 24.681 29.266 17.010
29 HG13 DVA 4 3HG1 DVA 4 24.730 28.592 18.690
30 HG21 DVA 4 1HG2 DVA 4 27.192 29.202 17.171
31 HG22 DVA 4 2HG2 DVA 4 28.064 27.686 17.392
32 HG23 DVA 4 3HG2 DVA 4 27.062 28.423 18.716
33 HA DPR 5 HA DPR 5 28.451 23.173 17.774
34 HB2 DPR 5 HB1 DPR 5 30.662 24.334 19.334
35 HB3 DPR 5 HB2 DPR 5 29.695 22.759 19.574
36 HG2 DPR 5 HG1 DPR 5 29.413 24.958 21.251
37 HG3 DPR 5 HG2 DPR 5 28.089 23.768 20.899
38 HD2 DPR 5 HD1 DPR 5 28.593 26.496 19.702
39 HD3 DPR 5 HD2 DPR 5 27.087 25.635 20.216
40 H ARG 6 H ARG 6 29.810 22.847 16.136
41 HA ARG 6 HA ARG 6 31.887 24.734 15.567
42 HB2 ARG 6 HB2 ARG 6 33.252 22.950 14.992
43 HB3 ARG 6 HB1 ARG 6 32.500 22.508 16.452
44 HG2 ARG 6 HG2 ARG 6 30.814 21.149 15.312
45 HG3 ARG 6 HG1 ARG 6 31.471 21.819 13.790
46 HD2 ARG 6 HD2 ARG 6 33.587 20.693 14.206
47 HD3 ARG 6 HD1 ARG 6 32.746 19.818 15.564
48 HE ARG 6 HE ARG 6 31.375 19.522 13.010
49 HH11 ARG 6 1HH1 ARG 6 31.605 17.717 11.578
50 HH12 ARG 6 2HH1 ARG 6 33.101 16.807 11.668
51 HH21 ARG 6 1HH2 ARG 6 34.464 18.478 14.326
52 HH22 ARG 6 2HH2 ARG 6 34.684 17.332 12.992
53 H DLE 7 H DLE 7 29.270 23.348 13.800
54 HA DLE 7 HA DLE 7 29.925 25.019 11.418
55 HB2 DLE 7 HB1 DLE 7 27.641 24.922 13.342
56 HB3 DLE 7 HB2 DLE 7 27.488 25.759 11.800
57 HG DLE 7 HG DLE 7 29.560 26.608 13.779
58 HD11 DLE 7 1HD1 DLE 7 27.931 27.967 11.574
59 HD12 DLE 7 2HD1 DLE 7 29.667 27.538 11.388
60 HD13 DLE 7 3HD1 DLE 7 29.266 28.838 12.435
61 HD21 DLE 7 1HD2 DLE 7 28.141 28.245 14.635
62 HD22 DLE 7 2HD2 DLE 7 27.446 26.561 14.811
63 HD23 DLE 7 3HD2 DLE 7 26.743 27.714 13.647
64 H DTH 8 H DTH 8 28.612 24.637 9.640
65 HA DTH 8 HA DTH 8 27.811 21.958 9.152
66 HB DTH 8 HB DTH 8 27.221 24.466 7.484
67 HG21 DTH 8 1HG2 DTH 8 29.212 23.933 6.205
68 HG22 DTH 8 2HG2 DTH 8 29.605 22.498 7.164
69 HG23 DTH 8 3HG2 DTH 8 29.694 24.046 7.905
70 HG1 DTH 8 HG1 DTH 8 27.128 22.980 5.957
71 HA PRO 9 HA PRO 9 23.241 22.412 9.414
72 HB2 PRO 9 HB2 PRO 9 22.822 19.888 10.660
73 HB3 PRO 9 HB1 PRO 9 22.822 20.260 8.955
74 HG2 PRO 9 HG2 PRO 9 25.046 18.957 10.497
75 HG3 PRO 9 HG1 PRO 9 24.540 18.664 8.979
76 HD2 PRO 9 HD2 PRO 9 26.743 20.419 9.645
77 HD3 PRO 9 HD1 PRO 9 25.796 20.281 8.112
78 H GLU 10 H GLU 10 25.687 22.230 11.935
79 HA GLU 10 HA GLU 10 23.779 22.154 14.033
80 HB2 GLU 10 HB2 GLU 10 26.686 22.961 14.282
81 HB3 GLU 10 HB1 GLU 10 25.519 22.374 15.511
82 HG2 GLU 10 HG2 GLU 10 25.212 20.243 14.568
83 HG3 GLU 10 HG1 GLU 10 26.349 20.604 13.329
Start of MODEL 4
1 H1 ALA 1 H1 ALA 1 23.955 24.205 12.181
2 HA ALA 1 HA ALA 1 24.671 26.476 13.666
3 HB1 ALA 1 HB1 ALA 1 24.795 26.035 11.142
4 HB2 ALA 1 HB2 ALA 1 24.187 27.658 11.573
5 HB3 ALA 1 HB3 ALA 1 23.080 26.440 11.037
6 H ALA 2 H ALA 2 21.404 25.218 13.448
7 HA ALA 2 HA ALA 2 20.281 27.539 14.670
8 HB1 ALA 2 HB1 ALA 2 18.297 25.995 15.099
9 HB2 ALA 2 HB2 ALA 2 19.253 24.684 14.610
10 HB3 ALA 2 HB3 ALA 2 18.882 25.992 13.424
11 H ARG 3 H ARG 3 22.471 25.542 15.995
12 HA ARG 3 HA ARG 3 21.583 26.338 18.647
13 HB2 ARG 3 HB2 ARG 3 21.863 24.125 19.704
14 HB3 ARG 3 HB1 ARG 3 20.655 24.166 18.466
15 HG2 ARG 3 HG2 ARG 3 21.847 22.938 16.929
16 HG3 ARG 3 HG1 ARG 3 23.380 23.135 17.858
17 HD2 ARG 3 HD2 ARG 3 22.573 21.589 19.559
18 HD3 ARG 3 HD1 ARG 3 20.954 21.675 18.941
19 HE ARG 3 HE ARG 3 21.317 20.286 17.304
20 HH11 ARG 3 1HH1 ARG 3 22.805 18.727 15.985
21 HH12 ARG 3 2HH1 ARG 3 24.544 18.902 16.294
22 HH21 ARG 3 1HH2 ARG 3 24.449 21.042 18.881
23 HH22 ARG 3 2HH2 ARG 3 25.404 19.949 17.945
24 H DVA 4 H DVA 4 24.220 25.878 16.578
25 HA DVA 4 HA DVA 4 26.135 26.428 18.749
26 HB DVA 4 HB DVA 4 25.876 27.676 15.953
27 HG11 DVA 4 1HG1 DVA 4 25.742 28.910 18.799
28 HG12 DVA 4 2HG1 DVA 4 24.553 29.056 17.430
29 HG13 DVA 4 3HG1 DVA 4 26.106 29.862 17.400
30 HG21 DVA 4 1HG2 DVA 4 27.926 28.846 16.272
31 HG22 DVA 4 2HG2 DVA 4 28.221 27.186 16.452
32 HG23 DVA 4 3HG2 DVA 4 28.137 28.155 17.934
33 HA DPR 5 HA DPR 5 27.592 22.758 16.643
34 HB2 DPR 5 HB1 DPR 5 29.189 21.777 18.504
35 HB3 DPR 5 HB2 DPR 5 27.435 21.836 18.709
36 HG2 DPR 5 HG1 DPR 5 29.376 23.688 20.072
37 HG3 DPR 5 HG2 DPR 5 27.829 22.921 20.635
38 HD2 DPR 5 HD1 DPR 5 28.007 25.527 19.415
39 HD3 DPR 5 HD2 DPR 5 26.621 24.412 19.888
40 H ARG 6 H ARG 6 29.247 22.594 15.285
41 HA ARG 6 HA ARG 6 31.589 24.442 15.619
42 HB2 ARG 6 HB2 ARG 6 31.327 21.779 14.260
43 HB3 ARG 6 HB1 ARG 6 32.712 22.854 14.025
44 HG2 ARG 6 HG2 ARG 6 33.351 22.715 16.276
45 HG3 ARG 6 HG1 ARG 6 31.727 22.055 16.722
46 HD2 ARG 6 HD2 ARG 6 33.221 20.171 16.777
47 HD3 ARG 6 HD1 ARG 6 32.139 20.091 15.420
48 HE ARG 6 HE ARG 6 33.956 20.257 13.795
49 HH11 ARG 6 1HH1 ARG 6 35.984 19.657 13.263
50 HH12 ARG 6 2HH1 ARG 6 37.202 20.084 14.394
51 HH21 ARG 6 1HH2 ARG 6 35.400 20.916 17.065
52 HH22 ARG 6 2HH2 ARG 6 36.922 20.890 16.377
53 H DLE 7 H DLE 7 28.754 24.917 14.136
54 HA DLE 7 HA DLE 7 29.773 25.697 11.493
55 HB2 DLE 7 HB1 DLE 7 27.122 25.981 12.868
56 HB3 DLE 7 HB2 DLE 7 27.511 26.599 11.232
57 HG DLE 7 HG DLE 7 28.573 27.630 13.854
58 HD11 DLE 7 1HD1 DLE 7 29.074 28.568 11.096
59 HD12 DLE 7 2HD1 DLE 7 30.295 27.623 12.084
60 HD13 DLE 7 3HD1 DLE 7 29.785 29.256 12.556
61 HD21 DLE 7 1HD2 DLE 7 27.264 29.574 13.285
62 HD22 DLE 7 2HD2 DLE 7 26.198 28.125 13.394
63 HD23 DLE 7 3HD2 DLE 7 26.671 28.829 11.841
64 H DTH 8 H DTH 8 28.528 25.114 9.640
65 HA DTH 8 HA DTH 8 28.550 22.216 9.439
66 HB DTH 8 HB DTH 8 27.572 24.296 7.513
67 HG21 DTH 8 1HG2 DTH 8 30.030 24.275 7.480
68 HG22 DTH 8 2HG2 DTH 8 29.428 23.524 6.082
69 HG23 DTH 8 3HG2 DTH 8 29.999 22.466 7.339
70 HG1 DTH 8 HG1 DTH 8 27.820 21.571 6.891
71 HA PRO 9 HA PRO 9 24.104 21.859 9.360
72 HB2 PRO 9 HB2 PRO 9 23.583 19.429 10.331
73 HB3 PRO 9 HB1 PRO 9 24.542 19.662 8.790
74 HG2 PRO 9 HG2 PRO 9 25.790 19.132 11.586
75 HG3 PRO 9 HG1 PRO 9 25.916 18.352 9.979
76 HD2 PRO 9 HD2 PRO 9 27.573 20.389 10.728
77 HD3 PRO 9 HD1 PRO 9 27.065 20.300 9.021
78 H GLU 10 H GLU 10 25.788 22.225 12.214
79 HA GLU 10 HA GLU 10 23.578 21.829 14.068
80 HB2 GLU 10 HB2 GLU 10 26.436 22.865 14.430
81 HB3 GLU 10 HB1 GLU 10 25.285 22.128 15.655
82 HG2 GLU 10 HG2 GLU 10 25.420 20.060 14.284
83 HG3 GLU 10 HG1 GLU 10 26.794 20.704 13.556
Start of MODEL 5
1 H1 ALA 1 H1 ALA 1 23.747 24.315 11.694
2 HA ALA 1 HA ALA 1 24.198 26.790 11.920
3 HB1 ALA 1 HB1 ALA 1 21.480 25.960 10.940
4 HB2 ALA 1 HB2 ALA 1 22.914 25.517 10.088
5 HB3 ALA 1 HB3 ALA 1 22.507 27.280 10.386
6 H ALA 2 H ALA 2 21.209 25.466 13.495
7 HA ALA 2 HA ALA 2 20.858 28.106 14.771
8 HB1 ALA 2 HB1 ALA 2 18.514 27.455 15.047
9 HB2 ALA 2 HB2 ALA 2 18.834 25.920 14.406
10 HB3 ALA 2 HB3 ALA 2 18.807 27.359 13.335
11 H ARG 3 H ARG 3 22.681 25.549 15.606
12 HA ARG 3 HA ARG 3 21.614 25.400 18.346
13 HB2 ARG 3 HB2 ARG 3 22.892 23.218 16.720
14 HB3 ARG 3 HB1 ARG 3 22.720 23.234 18.489
15 HG2 ARG 3 HG2 ARG 3 20.204 23.624 18.133
16 HG3 ARG 3 HG1 ARG 3 20.451 23.385 16.390
17 HD2 ARG 3 HD2 ARG 3 21.340 21.271 18.365
18 HD3 ARG 3 HD1 ARG 3 19.704 21.425 17.684
19 HE ARG 3 HE ARG 3 22.266 20.655 16.379
20 HH11 ARG 3 1HH1 ARG 3 22.281 19.853 14.383
21 HH12 ARG 3 2HH1 ARG 3 20.856 19.700 13.430
22 HH21 ARG 3 1HH2 ARG 3 18.744 21.260 15.815
23 HH22 ARG 3 2HH2 ARG 3 18.808 20.610 14.230
24 H DVA 4 H DVA 4 24.701 25.065 16.529
25 HA DVA 4 HA DVA 4 26.007 25.908 19.050
26 HB DVA 4 HB DVA 4 26.338 27.286 16.406
27 HG11 DVA 4 1HG1 DVA 4 24.456 28.147 17.407
28 HG12 DVA 4 2HG1 DVA 4 25.772 29.269 17.686
29 HG13 DVA 4 3HG1 DVA 4 25.247 28.220 19.069
30 HG21 DVA 4 1HG2 DVA 4 27.901 28.678 17.645
31 HG22 DVA 4 2HG2 DVA 4 28.603 27.131 17.832
32 HG23 DVA 4 3HG2 DVA 4 27.740 27.957 19.143
33 HA DPR 5 HA DPR 5 28.397 22.483 17.210
34 HB2 DPR 5 HB1 DPR 5 30.508 22.358 18.953
35 HB3 DPR 5 HB2 DPR 5 28.713 21.845 19.270
36 HG2 DPR 5 HG1 DPR 5 30.128 24.433 20.048
37 HG3 DPR 5 HG2 DPR 5 29.173 23.255 21.109
38 HD2 DPR 5 HD1 DPR 5 28.081 25.428 19.972
39 HD3 DPR 5 HD2 DPR 5 27.273 23.878 20.153
40 H ARG 6 H ARG 6 29.573 22.724 15.329
41 HA ARG 6 HA ARG 6 31.549 24.917 15.080
42 HB2 ARG 6 HB2 ARG 6 31.848 22.063 14.038
43 HB3 ARG 6 HB1 ARG 6 32.893 23.398 13.663
44 HG2 ARG 6 HG2 ARG 6 33.562 23.637 16.109
45 HG3 ARG 6 HG1 ARG 6 32.655 22.174 16.442
46 HD2 ARG 6 HD2 ARG 6 34.929 21.527 16.094
47 HD3 ARG 6 HD1 ARG 6 34.025 21.036 14.662
48 HE ARG 6 HE ARG 6 35.130 23.561 14.091
49 HH11 ARG 6 1HH1 ARG 6 36.720 23.590 12.671
50 HH12 ARG 6 2HH1 ARG 6 38.021 22.368 12.560
51 HH21 ARG 6 1HH2 ARG 6 36.191 20.077 14.389
52 HH22 ARG 6 2HH2 ARG 6 37.575 20.456 13.379
53 H DLE 7 H DLE 7 28.651 24.892 14.533
54 HA DLE 7 HA DLE 7 29.056 25.989 11.864
55 HB2 DLE 7 HB1 DLE 7 26.741 25.742 13.893
56 HB3 DLE 7 HB2 DLE 7 26.494 26.265 12.218
57 HG DLE 7 HG DLE 7 28.091 27.557 14.474
58 HD11 DLE 7 1HD1 DLE 7 28.701 29.391 12.916
59 HD12 DLE 7 2HD1 DLE 7 28.136 28.304 11.588
60 HD13 DLE 7 3HD1 DLE 7 29.531 27.893 12.660
61 HD21 DLE 7 1HD2 DLE 7 26.452 29.498 14.202
62 HD22 DLE 7 2HD2 DLE 7 25.625 28.003 14.389
63 HD23 DLE 7 3HD2 DLE 7 25.771 28.612 12.796
64 H DTH 8 H DTH 8 28.452 24.919 9.901
65 HA DTH 8 HA DTH 8 28.473 22.066 10.068
66 HB DTH 8 HB DTH 8 27.483 23.926 7.818
67 HG21 DTH 8 1HG2 DTH 8 29.557 23.804 6.802
68 HG22 DTH 8 2HG2 DTH 8 30.029 22.526 7.950
69 HG23 DTH 8 3HG2 DTH 8 29.913 24.308 8.405
70 HG1 DTH 8 HG1 DTH 8 27.918 22.333 6.530
71 HA PRO 9 HA PRO 9 23.923 21.648 9.523
72 HB2 PRO 9 HB2 PRO 9 23.372 19.513 11.122
73 HB3 PRO 9 HB1 PRO 9 23.993 19.290 9.445
74 HG2 PRO 9 HG2 PRO 9 25.485 19.342 12.026
75 HG3 PRO 9 HG1 PRO 9 25.830 18.217 10.668
76 HD2 PRO 9 HD2 PRO 9 27.416 20.414 10.994
77 HD3 PRO 9 HD1 PRO 9 26.879 19.785 9.365
78 H GLU 10 H GLU 10 25.716 22.299 12.396
79 HA GLU 10 HA GLU 10 23.392 22.488 14.158
80 HB2 GLU 10 HB2 GLU 10 26.353 23.037 14.587
81 HB3 GLU 10 HB1 GLU 10 25.058 23.045 15.826
82 HG2 GLU 10 HG2 GLU 10 26.148 20.761 14.328
83 HG3 GLU 10 HG1 GLU 10 26.430 21.162 16.036
Start of MODEL 6
1 H1 ALA 1 H1 ALA 1 24.544 24.568 12.068
2 HA ALA 1 HA ALA 1 24.647 26.738 14.001
3 HB1 ALA 1 HB1 ALA 1 25.521 26.674 11.738
4 HB2 ALA 1 HB2 ALA 1 24.483 28.132 12.073
5 HB3 ALA 1 HB3 ALA 1 23.880 26.866 11.022
6 H ALA 2 H ALA 2 22.201 24.856 13.359
7 HA ALA 2 HA ALA 2 19.934 26.550 13.987
8 HB1 ALA 2 HB1 ALA 2 19.488 24.329 13.396
9 HB2 ALA 2 HB2 ALA 2 18.917 24.528 15.007
10 HB3 ALA 2 HB3 ALA 2 20.359 23.565 14.682
11 H ARG 3 H ARG 3 22.617 25.254 16.006
12 HA ARG 3 HA ARG 3 21.582 26.272 18.558
13 HB2 ARG 3 HB2 ARG 3 21.992 23.862 19.386
14 HB3 ARG 3 HB1 ARG 3 20.687 24.035 18.215
15 HG2 ARG 3 HG2 ARG 3 22.074 22.969 16.564
16 HG3 ARG 3 HG1 ARG 3 23.469 23.137 17.581
17 HD2 ARG 3 HD2 ARG 3 22.573 21.752 19.396
18 HD3 ARG 3 HD1 ARG 3 21.174 21.413 18.479
19 HE ARG 3 HE ARG 3 22.441 20.100 16.889
20 HH11 ARG 3 1HH1 ARG 3 24.038 18.644 16.478
21 HH12 ARG 3 2HH1 ARG 3 25.649 18.922 17.093
22 HH21 ARG 3 1HH2 ARG 3 24.609 21.197 19.549
23 HH22 ARG 3 2HH2 ARG 3 25.792 20.142 18.957
24 H DVA 4 H DVA 4 24.343 25.912 16.611
25 HA DVA 4 HA DVA 4 25.948 26.843 18.947
26 HB DVA 4 HB DVA 4 25.637 28.175 16.301
27 HG11 DVA 4 1HG1 DVA 4 25.043 29.126 18.971
28 HG12 DVA 4 2HG1 DVA 4 23.798 28.621 17.827
29 HG13 DVA 4 3HG1 DVA 4 24.876 29.956 17.364
30 HG21 DVA 4 1HG2 DVA 4 27.403 29.052 18.581
31 HG22 DVA 4 2HG2 DVA 4 27.085 29.784 16.999
32 HG23 DVA 4 3HG2 DVA 4 27.999 28.245 17.039
33 HA DPR 5 HA DPR 5 27.464 23.465 16.384
34 HB2 DPR 5 HB1 DPR 5 29.127 22.207 18.417
35 HB3 DPR 5 HB2 DPR 5 27.426 21.784 17.973
36 HG2 DPR 5 HG1 DPR 5 28.409 22.951 20.401
37 HG3 DPR 5 HG2 DPR 5 26.777 22.695 20.004
38 HD2 DPR 5 HD1 DPR 5 28.307 25.166 19.815
39 HD3 DPR 5 HD2 DPR 5 26.488 25.020 19.758
40 H ARG 6 H ARG 6 29.698 22.316 15.877
41 HA ARG 6 HA ARG 6 31.908 24.146 15.691
42 HB2 ARG 6 HB2 ARG 6 32.133 21.777 15.938
43 HB3 ARG 6 HB1 ARG 6 31.391 21.436 14.414
44 HG2 ARG 6 HG2 ARG 6 33.212 22.897 13.247
45 HG3 ARG 6 HG1 ARG 6 33.852 23.071 14.865
46 HD2 ARG 6 HD2 ARG 6 35.061 21.369 13.618
47 HD3 ARG 6 HD1 ARG 6 34.179 20.542 14.934
48 HE ARG 6 HE ARG 6 32.485 19.952 13.231
49 HH11 ARG 6 1HH1 ARG 6 32.651 18.123 11.696
50 HH12 ARG 6 2HH1 ARG 6 34.165 17.753 10.936
51 HH21 ARG 6 1HH2 ARG 6 36.009 20.030 12.712
52 HH22 ARG 6 2HH2 ARG 6 35.908 18.883 11.382
53 H DLE 7 H DLE 7 29.013 23.624 14.052
54 HA DLE 7 HA DLE 7 29.866 25.223 11.784
55 HB2 DLE 7 HB1 DLE 7 27.231 25.529 13.335
56 HB3 DLE 7 HB2 DLE 7 27.626 26.388 11.894
57 HG DLE 7 HG DLE 7 28.930 26.658 14.544
58 HD11 DLE 7 1HD1 DLE 7 30.168 28.643 13.564
59 HD12 DLE 7 2HD1 DLE 7 29.560 28.162 11.970
60 HD13 DLE 7 3HD1 DLE 7 30.707 27.128 12.824
61 HD21 DLE 7 1HD2 DLE 7 26.681 27.754 14.185
62 HD22 DLE 7 2HD2 DLE 7 27.377 28.751 12.895
63 HD23 DLE 7 3HD2 DLE 7 27.980 28.898 14.552
64 H DTH 8 H DTH 8 28.136 25.219 9.850
65 HA DTH 8 HA DTH 8 28.007 22.474 9.222
66 HB DTH 8 HB DTH 8 27.185 24.841 7.582
67 HG21 DTH 8 1HG2 DTH 8 29.636 24.508 8.030
68 HG22 DTH 8 2HG2 DTH 8 29.324 24.196 6.288
69 HG23 DTH 8 3HG2 DTH 8 29.530 22.867 7.434
70 HG1 DTH 8 HG1 DTH 8 27.130 23.419 5.991
71 HA PRO 9 HA PRO 9 23.460 21.837 9.503
72 HB2 PRO 9 HB2 PRO 9 24.352 19.783 11.353
73 HB3 PRO 9 HB1 PRO 9 23.035 19.737 10.146
74 HG2 PRO 9 HG2 PRO 9 25.305 18.520 9.369
75 HG3 PRO 9 HG1 PRO 9 24.668 19.706 8.274
76 HD2 PRO 9 HD2 PRO 9 26.904 20.415 10.250
77 HD3 PRO 9 HD1 PRO 9 26.793 20.730 8.523
78 H GLU 10 H GLU 10 25.923 22.048 12.148
79 HA GLU 10 HA GLU 10 23.942 22.064 14.184
80 HB2 GLU 10 HB2 GLU 10 26.865 22.952 14.568
81 HB3 GLU 10 HB1 GLU 10 25.714 22.406 15.712
82 HG2 GLU 10 HG2 GLU 10 25.658 20.104 14.531
83 HG3 GLU 10 HG1 GLU 10 26.912 20.709 13.529
Start of MODEL 7
1 H1 ALA 1 H1 ALA 1 23.541 24.484 11.692
2 HA ALA 1 HA ALA 1 24.499 26.531 13.231
3 HB1 ALA 1 HB1 ALA 1 22.645 26.773 10.898
4 HB2 ALA 1 HB2 ALA 1 24.315 26.559 10.871
5 HB3 ALA 1 HB3 ALA 1 23.738 28.049 11.640
6 H ALA 2 H ALA 2 21.232 25.335 13.457
7 HA ALA 2 HA ALA 2 20.272 27.533 14.749
8 HB1 ALA 2 HB1 ALA 2 19.338 24.614 15.129
9 HB2 ALA 2 HB2 ALA 2 18.906 25.750 13.824
10 HB3 ALA 2 HB3 ALA 2 18.408 26.069 15.511
11 H ARG 3 H ARG 3 22.319 25.143 16.182
12 HA ARG 3 HA ARG 3 21.521 26.115 18.851
13 HB2 ARG 3 HB2 ARG 3 21.420 23.907 19.659
14 HB3 ARG 3 HB1 ARG 3 20.413 24.147 18.182
15 HG2 ARG 3 HG2 ARG 3 22.203 22.998 16.860
16 HG3 ARG 3 HG1 ARG 3 23.241 23.025 18.203
17 HD2 ARG 3 HD2 ARG 3 21.533 21.599 19.391
18 HD3 ARG 3 HD1 ARG 3 20.545 21.512 17.896
19 HE ARG 3 HE ARG 3 23.086 20.688 17.081
20 HH11 ARG 3 1HH1 ARG 3 24.193 18.930 17.171
21 HH12 ARG 3 2HH1 ARG 3 23.746 17.564 18.141
22 HH21 ARG 3 1HH2 ARG 3 20.984 19.323 19.552
23 HH22 ARG 3 2HH2 ARG 3 21.891 17.816 19.632
24 H DVA 4 H DVA 4 24.235 25.838 16.664
25 HA DVA 4 HA DVA 4 26.012 26.510 18.935
26 HB DVA 4 HB DVA 4 25.782 27.704 16.072
27 HG11 DVA 4 1HG1 DVA 4 24.043 28.639 17.498
28 HG12 DVA 4 2HG1 DVA 4 25.421 29.723 17.161
29 HG13 DVA 4 3HG1 DVA 4 25.141 28.883 18.753
30 HG21 DVA 4 1HG2 DVA 4 27.892 28.059 18.236
31 HG22 DVA 4 2HG2 DVA 4 27.538 29.134 16.786
32 HG23 DVA 4 3HG2 DVA 4 28.094 27.616 16.480
33 HA DPR 5 HA DPR 5 28.077 23.080 17.360
34 HB2 DPR 5 HB1 DPR 5 30.000 23.672 19.583
35 HB3 DPR 5 HB2 DPR 5 29.461 22.076 19.026
36 HG2 DPR 5 HG1 DPR 5 28.265 23.206 21.183
37 HG3 DPR 5 HG2 DPR 5 27.275 22.423 19.871
38 HD2 DPR 5 HD1 DPR 5 27.855 25.381 20.308
39 HD3 DPR 5 HD2 DPR 5 26.279 24.536 19.899
40 H ARG 6 H ARG 6 29.824 22.728 16.184
41 HA ARG 6 HA ARG 6 31.978 24.518 15.718
42 HB2 ARG 6 HB2 ARG 6 32.451 22.159 15.803
43 HB3 ARG 6 HB1 ARG 6 31.327 21.821 14.486
44 HG2 ARG 6 HG2 ARG 6 32.750 23.072 12.876
45 HG3 ARG 6 HG1 ARG 6 33.753 23.570 14.274
46 HD2 ARG 6 HD2 ARG 6 34.809 21.754 13.198
47 HD3 ARG 6 HD1 ARG 6 34.160 21.201 14.799
48 HE ARG 6 HE ARG 6 32.328 20.634 12.587
49 HH11 ARG 6 1HH1 ARG 6 31.681 18.487 12.387
50 HH12 ARG 6 2HH1 ARG 6 32.906 17.273 12.428
51 HH21 ARG 6 1HH2 ARG 6 35.380 19.377 13.804
52 HH22 ARG 6 2HH2 ARG 6 34.806 17.730 13.567
53 H DLE 7 H DLE 7 29.113 23.485 13.883
54 HA DLE 7 HA DLE 7 29.952 25.226 11.713
55 HB2 DLE 7 HB1 DLE 7 27.238 25.306 12.994
56 HB3 DLE 7 HB2 DLE 7 27.546 26.136 11.414
57 HG DLE 7 HG DLE 7 29.021 26.834 13.848
58 HD11 DLE 7 1HD1 DLE 7 28.384 28.218 11.244
59 HD12 DLE 7 2HD1 DLE 7 29.990 27.740 11.898
60 HD13 DLE 7 3HD1 DLE 7 29.123 29.089 12.655
61 HD21 DLE 7 1HD2 DLE 7 27.257 28.648 14.128
62 HD22 DLE 7 2HD2 DLE 7 26.662 26.999 14.316
63 HD23 DLE 7 3HD2 DLE 7 26.237 27.906 12.890
64 H DTH 8 H DTH 8 28.671 24.763 9.656
65 HA DTH 8 HA DTH 8 28.286 21.908 9.308
66 HB DTH 8 HB DTH 8 27.618 24.262 7.365
67 HG21 DTH 8 1HG2 DTH 8 29.819 22.273 7.256
68 HG22 DTH 8 2HG2 DTH 8 29.931 24.114 7.376
69 HG23 DTH 8 3HG2 DTH 8 29.384 23.323 5.914
70 HG1 DTH 8 HG1 DTH 8 27.086 22.792 6.059
71 HA PRO 9 HA PRO 9 23.673 21.818 8.891
72 HB2 PRO 9 HB2 PRO 9 24.173 19.457 10.538
73 HB3 PRO 9 HB1 PRO 9 23.140 19.712 9.082
74 HG2 PRO 9 HG2 PRO 9 25.379 18.413 8.813
75 HG3 PRO 9 HG1 PRO 9 24.923 19.684 7.570
76 HD2 PRO 9 HD2 PRO 9 26.927 20.001 9.854
77 HD3 PRO 9 HD1 PRO 9 27.091 20.419 8.236
78 H GLU 10 H GLU 10 25.610 22.632 11.661
79 HA GLU 10 HA GLU 10 23.523 21.935 13.550
80 HB2 GLU 10 HB2 GLU 10 26.427 22.922 13.771
81 HB3 GLU 10 HB1 GLU 10 25.417 22.716 15.165
82 HG2 GLU 10 HG2 GLU 10 25.682 20.405 13.174
83 HG3 GLU 10 HG1 GLU 10 26.826 20.648 14.487
Start of MODEL 8
1 H1 ALA 1 H1 ALA 1 23.811 24.343 12.032
2 HA ALA 1 HA ALA 1 24.525 26.657 13.384
3 HB1 ALA 1 HB1 ALA 1 22.667 26.742 11.094
4 HB2 ALA 1 HB2 ALA 1 24.426 26.274 10.924
5 HB3 ALA 1 HB3 ALA 1 24.012 27.855 11.394
6 H ALA 2 H ALA 2 21.251 25.304 13.268
7 HA ALA 2 HA ALA 2 20.100 27.546 14.515
8 HB1 ALA 2 HB1 ALA 2 18.590 25.588 13.621
9 HB2 ALA 2 HB2 ALA 2 18.246 26.114 15.188
10 HB3 ALA 2 HB3 ALA 2 19.146 24.728 15.129
11 H ARG 3 H ARG 3 22.294 25.354 16.011
12 HA ARG 3 HA ARG 3 21.389 26.040 18.776
13 HB2 ARG 3 HB2 ARG 3 21.599 23.784 19.391
14 HB3 ARG 3 HB1 ARG 3 20.448 23.939 18.075
15 HG2 ARG 3 HG2 ARG 3 21.810 23.160 16.439
16 HG3 ARG 3 HG1 ARG 3 23.334 23.132 17.497
17 HD2 ARG 3 HD2 ARG 3 22.028 21.498 18.861
18 HD3 ARG 3 HD1 ARG 3 20.670 21.683 17.725
19 HE ARG 3 HE ARG 3 23.283 20.531 16.845
20 HH11 ARG 3 1HH1 ARG 3 23.080 19.050 15.143
21 HH12 ARG 3 2HH1 ARG 3 21.568 18.854 14.366
22 HH21 ARG 3 1HH2 ARG 3 19.556 20.575 16.548
23 HH22 ARG 3 2HH2 ARG 3 19.679 19.649 15.131
24 H DVA 4 H DVA 4 24.152 25.862 16.627
25 HA DVA 4 HA DVA 4 25.986 26.361 18.892
26 HB DVA 4 HB DVA 4 25.555 27.644 16.250
27 HG11 DVA 4 1HG1 DVA 4 24.221 28.598 18.122
28 HG12 DVA 4 2HG1 DVA 4 25.482 29.593 17.361
29 HG13 DVA 4 3HG1 DVA 4 25.733 28.824 19.013
30 HG21 DVA 4 1HG2 DVA 4 27.860 27.765 18.265
31 HG22 DVA 4 2HG2 DVA 4 27.642 29.061 17.008
32 HG23 DVA 4 3HG2 DVA 4 27.974 27.462 16.480
33 HA DPR 5 HA DPR 5 28.031 23.011 16.424
34 HB2 DPR 5 HB1 DPR 5 29.855 22.136 18.537
35 HB3 DPR 5 HB2 DPR 5 28.435 21.462 17.893
36 HG2 DPR 5 HG1 DPR 5 29.049 23.147 20.257
37 HG3 DPR 5 HG2 DPR 5 27.802 21.849 20.105
38 HD2 DPR 5 HD1 DPR 5 27.507 24.690 19.915
39 HD3 DPR 5 HD2 DPR 5 26.254 23.430 19.368
40 H ARG 6 H ARG 6 30.330 22.550 16.075
41 HA ARG 6 HA ARG 6 31.894 24.946 15.751
42 HB2 ARG 6 HB2 ARG 6 32.919 22.615 15.996
43 HB3 ARG 6 HB1 ARG 6 32.085 22.210 14.464
44 HG2 ARG 6 HG2 ARG 6 33.676 23.293 13.278
45 HG3 ARG 6 HG1 ARG 6 33.973 24.437 14.646
46 HD2 ARG 6 HD2 ARG 6 35.929 23.232 14.098
47 HD3 ARG 6 HD1 ARG 6 35.432 22.408 15.571
48 HE ARG 6 HE ARG 6 34.512 21.110 13.063
49 HH11 ARG 6 1HH1 ARG 6 34.719 18.973 13.320
50 HH12 ARG 6 2HH1 ARG 6 35.931 18.126 14.245
51 HH21 ARG 6 1HH2 ARG 6 37.062 21.107 15.729
52 HH22 ARG 6 2HH2 ARG 6 37.267 19.399 15.497
53 H DLE 7 H DLE 7 29.350 23.520 13.927
54 HA DLE 7 HA DLE 7 30.007 25.354 11.669
55 HB2 DLE 7 HB1 DLE 7 27.409 25.302 13.161
56 HB3 DLE 7 HB2 DLE 7 27.522 25.934 11.564
57 HG DLE 7 HG DLE 7 28.988 27.041 14.086
58 HD11 DLE 7 1HD1 DLE 7 28.762 28.287 11.279
59 HD12 DLE 7 2HD1 DLE 7 30.248 27.481 11.926
60 HD13 DLE 7 3HD1 DLE 7 29.621 28.967 12.567
61 HD21 DLE 7 1HD2 DLE 7 27.352 28.747 13.801
62 HD22 DLE 7 2HD2 DLE 7 26.671 27.165 14.311
63 HD23 DLE 7 3HD2 DLE 7 26.447 27.774 12.667
64 H DTH 8 H DTH 8 28.793 24.726 9.722
65 HA DTH 8 HA DTH 8 28.145 21.883 9.520
66 HB DTH 8 HB DTH 8 27.558 24.082 7.457
67 HG21 DTH 8 1HG2 DTH 8 30.028 23.516 7.788
68 HG22 DTH 8 2HG2 DTH 8 29.318 23.344 6.171
69 HG23 DTH 8 3HG2 DTH 8 29.486 21.854 7.162
70 HG1 DTH 8 HG1 DTH 8 26.888 22.485 6.149
71 HA PRO 9 HA PRO 9 23.691 22.260 9.340
72 HB2 PRO 9 HB2 PRO 9 23.578 19.568 10.544
73 HB3 PRO 9 HB1 PRO 9 22.810 20.327 9.115
74 HG2 PRO 9 HG2 PRO 9 25.007 18.499 9.184
75 HG3 PRO 9 HG1 PRO 9 24.830 19.787 7.859
76 HD2 PRO 9 HD2 PRO 9 26.496 19.795 10.307
77 HD3 PRO 9 HD1 PRO 9 26.873 20.426 8.741
78 H GLU 10 H GLU 10 25.704 22.255 12.206
79 HA GLU 10 HA GLU 10 23.740 21.866 14.121
80 HB2 GLU 10 HB2 GLU 10 26.404 22.995 14.158
81 HB3 GLU 10 HB1 GLU 10 25.523 22.848 15.627
82 HG2 GLU 10 HG2 GLU 10 26.457 20.632 13.712
83 HG3 GLU 10 HG1 GLU 10 27.221 20.973 15.204
Start of MODEL 9
1 H1 ALA 1 H1 ALA 1 24.204 24.657 12.129
2 HA ALA 1 HA ALA 1 24.682 26.878 13.821
3 HB1 ALA 1 HB1 ALA 1 23.243 26.654 11.123
4 HB2 ALA 1 HB2 ALA 1 24.951 26.850 11.264
5 HB3 ALA 1 HB3 ALA 1 23.822 28.156 11.826
6 H ALA 2 H ALA 2 21.631 25.029 13.171
7 HA ALA 2 HA ALA 2 19.778 26.862 14.322
8 HB1 ALA 2 HB1 ALA 2 19.126 24.925 13.214
9 HB2 ALA 2 HB2 ALA 2 18.576 24.982 14.763
10 HB3 ALA 2 HB3 ALA 2 20.041 23.893 14.472
11 H ARG 3 H ARG 3 22.467 25.284 15.941
12 HA ARG 3 HA ARG 3 21.221 25.870 18.580
13 HB2 ARG 3 HB2 ARG 3 21.677 23.753 19.436
14 HB3 ARG 3 HB1 ARG 3 20.417 23.849 18.247
15 HG2 ARG 3 HG2 ARG 3 22.060 23.025 16.436
16 HG3 ARG 3 HG1 ARG 3 23.216 22.833 17.649
17 HD2 ARG 3 HD2 ARG 3 22.157 21.119 18.750
18 HD3 ARG 3 HD1 ARG 3 20.598 21.307 17.905
19 HE ARG 3 HE ARG 3 22.969 19.890 16.992
20 HH11 ARG 3 1HH1 ARG 3 23.101 19.155 14.867
21 HH12 ARG 3 2HH1 ARG 3 21.626 19.225 13.871
22 HH21 ARG 3 1HH2 ARG 3 19.981 21.457 15.946
23 HH22 ARG 3 2HH2 ARG 3 20.006 20.741 14.365
24 H DVA 4 H DVA 4 24.158 25.440 16.695
25 HA DVA 4 HA DVA 4 25.845 26.539 18.847
26 HB DVA 4 HB DVA 4 25.524 27.700 16.097
27 HG11 DVA 4 1HG1 DVA 4 25.037 29.073 18.700
28 HG12 DVA 4 2HG1 DVA 4 23.718 28.260 17.661
29 HG13 DVA 4 3HG1 DVA 4 24.702 29.619 17.096
30 HG21 DVA 4 1HG2 DVA 4 27.354 28.403 18.287
31 HG22 DVA 4 2HG2 DVA 4 27.061 29.392 16.808
32 HG23 DVA 4 3HG2 DVA 4 27.865 27.810 16.659
33 HA DPR 5 HA DPR 5 28.083 23.087 17.330
34 HB2 DPR 5 HB1 DPR 5 30.090 23.972 19.336
35 HB3 DPR 5 HB2 DPR 5 29.715 22.341 18.839
36 HG2 DPR 5 HG1 DPR 5 28.471 23.317 21.033
37 HG3 DPR 5 HG2 DPR 5 27.389 22.524 19.876
38 HD2 DPR 5 HD1 DPR 5 27.671 25.412 20.274
39 HD3 DPR 5 HD2 DPR 5 26.269 24.380 19.716
40 H ARG 6 H ARG 6 30.081 22.631 16.275
41 HA ARG 6 HA ARG 6 32.009 24.617 15.565
42 HB2 ARG 6 HB2 ARG 6 32.355 22.270 16.236
43 HB3 ARG 6 HB1 ARG 6 31.768 21.632 14.681
44 HG2 ARG 6 HG2 ARG 6 33.766 22.619 13.615
45 HG3 ARG 6 HG1 ARG 6 34.241 23.398 15.147
46 HD2 ARG 6 HD2 ARG 6 35.443 21.373 14.921
47 HD3 ARG 6 HD1 ARG 6 34.325 21.220 16.180
48 HE ARG 6 HE ARG 6 33.589 20.169 13.482
49 HH11 ARG 6 1HH1 ARG 6 33.474 18.036 12.941
50 HH12 ARG 6 2HH1 ARG 6 34.049 16.882 14.174
51 HH21 ARG 6 1HH2 ARG 6 34.865 18.954 16.661
52 HH22 ARG 6 2HH2 ARG 6 34.702 17.375 15.993
53 H DLE 7 H DLE 7 29.205 23.574 13.997
54 HA DLE 7 HA DLE 7 30.049 24.974 11.568
55 HB2 DLE 7 HB1 DLE 7 27.404 25.321 12.957
56 HB3 DLE 7 HB2 DLE 7 27.984 26.057 11.431
57 HG DLE 7 HG DLE 7 29.361 26.432 14.089
58 HD11 DLE 7 1HD1 DLE 7 29.362 28.180 11.499
59 HD12 DLE 7 2HD1 DLE 7 30.732 27.260 12.133
60 HD13 DLE 7 3HD1 DLE 7 30.168 28.601 13.056
61 HD21 DLE 7 1HD2 DLE 7 28.327 28.552 14.351
62 HD22 DLE 7 2HD2 DLE 7 27.021 27.532 14.168
63 HD23 DLE 7 3HD2 DLE 7 27.522 28.526 12.774
64 H DTH 8 H DTH 8 28.817 24.595 9.732
65 HA DTH 8 HA DTH 8 28.015 21.867 9.262
66 HB DTH 8 HB DTH 8 27.622 24.338 7.440
67 HG21 DTH 8 1HG2 DTH 8 29.981 23.527 7.610
68 HG22 DTH 8 2HG2 DTH 8 29.210 23.180 6.024
69 HG23 DTH 8 3HG2 DTH 8 29.370 21.878 7.253
70 HG1 DTH 8 HG1 DTH 8 26.103 23.124 6.956
71 HA PRO 9 HA PRO 9 23.418 22.711 9.396
72 HB2 PRO 9 HB2 PRO 9 23.442 20.126 10.756
73 HB3 PRO 9 HB1 PRO 9 22.387 20.642 9.365
74 HG2 PRO 9 HG2 PRO 9 24.465 18.842 9.271
75 HG3 PRO 9 HG1 PRO 9 24.102 19.988 7.838
76 HD2 PRO 9 HD2 PRO 9 26.326 20.150 9.884
77 HD3 PRO 9 HD1 PRO 9 26.277 20.652 8.271
78 H GLU 10 H GLU 10 25.620 22.218 11.941
79 HA GLU 10 HA GLU 10 24.009 22.062 14.304
80 HB2 GLU 10 HB2 GLU 10 26.703 23.290 13.878
81 HB3 GLU 10 HB1 GLU 10 25.927 22.948 15.423
82 HG2 GLU 10 HG2 GLU 10 26.780 20.777 13.366
83 HG3 GLU 10 HG1 GLU 10 27.613 21.208 14.779
Start of MODEL 10
1 H1 ALA 1 H1 ALA 1 23.874 24.586 12.035
2 HA ALA 1 HA ALA 1 24.561 26.826 13.576
3 HB1 ALA 1 HB1 ALA 1 22.507 27.216 11.487
4 HB2 ALA 1 HB2 ALA 1 24.018 26.471 10.968
5 HB3 ALA 1 HB3 ALA 1 24.050 28.042 11.764
6 H ALA 2 H ALA 2 21.516 25.252 13.819
7 HA ALA 2 HA ALA 2 20.065 27.604 14.885
8 HB1 ALA 2 HB1 ALA 2 19.377 24.695 14.352
9 HB2 ALA 2 HB2 ALA 2 19.021 26.158 13.323
10 HB3 ALA 2 HB3 ALA 2 18.271 25.894 14.928
11 H ARG 3 H ARG 3 22.017 25.140 16.203
12 HA ARG 3 HA ARG 3 21.456 26.130 18.963
13 HB2 ARG 3 HB2 ARG 3 21.899 23.908 19.747
14 HB3 ARG 3 HB1 ARG 3 20.570 23.877 18.619
15 HG2 ARG 3 HG2 ARG 3 21.701 22.993 16.893
16 HG3 ARG 3 HG1 ARG 3 23.256 22.980 17.580
17 HD2 ARG 3 HD2 ARG 3 22.515 21.443 19.318
18 HD3 ARG 3 HD1 ARG 3 20.851 21.372 18.585
19 HE ARG 3 HE ARG 3 23.295 20.625 17.098
20 HH11 ARG 3 1HH1 ARG 3 23.225 18.868 15.749
21 HH12 ARG 3 2HH1 ARG 3 22.230 17.538 16.205
22 HH21 ARG 3 1HH2 ARG 3 20.350 19.147 18.666
23 HH22 ARG 3 2HH2 ARG 3 20.414 17.804 17.586
24 H DVA 4 H DVA 4 23.790 25.668 16.554
25 HA DVA 4 HA DVA 4 25.970 26.306 18.579
26 HB DVA 4 HB DVA 4 25.474 27.593 15.871
27 HG11 DVA 4 1HG1 DVA 4 25.018 28.909 18.548
28 HG12 DVA 4 2HG1 DVA 4 23.823 28.367 17.340
29 HG13 DVA 4 3HG1 DVA 4 25.010 29.597 16.905
30 HG21 DVA 4 1HG2 DVA 4 27.928 27.497 16.399
31 HG22 DVA 4 2HG2 DVA 4 27.442 28.177 17.997
32 HG23 DVA 4 3HG2 DVA 4 27.243 29.089 16.506
33 HA DPR 5 HA DPR 5 27.926 22.782 16.468
34 HB2 DPR 5 HB1 DPR 5 29.564 23.117 18.984
35 HB3 DPR 5 HB2 DPR 5 28.897 21.622 18.193
36 HG2 DPR 5 HG1 DPR 5 27.692 22.596 20.410
37 HG3 DPR 5 HG2 DPR 5 26.781 21.933 19.072
38 HD2 DPR 5 HD1 DPR 5 27.392 24.864 19.678
39 HD3 DPR 5 HD2 DPR 5 25.899 24.196 19.224
40 H ARG 6 H ARG 6 29.944 22.587 15.625
41 HA ARG 6 HA ARG 6 31.981 24.792 15.800
42 HB2 ARG 6 HB2 ARG 6 32.049 22.183 14.235
43 HB3 ARG 6 HB1 ARG 6 33.269 23.372 14.300
44 HG2 ARG 6 HG2 ARG 6 33.472 23.005 16.778
45 HG3 ARG 6 HG1 ARG 6 32.221 21.764 16.657
46 HD2 ARG 6 HD2 ARG 6 35.005 21.723 15.445
47 HD3 ARG 6 HD1 ARG 6 34.367 20.621 16.621
48 HE ARG 6 HE ARG 6 34.273 20.565 13.762
49 HH11 ARG 6 1HH1 ARG 6 33.665 18.472 12.964
50 HH12 ARG 6 2HH1 ARG 6 32.649 17.353 13.842
51 HH21 ARG 6 1HH2 ARG 6 32.535 19.307 16.744
52 HH22 ARG 6 2HH2 ARG 6 32.066 17.893 15.787
53 H DLE 7 H DLE 7 29.413 23.977 13.992
54 HA DLE 7 HA DLE 7 30.334 25.165 11.394
55 HB2 DLE 7 HB1 DLE 7 27.696 25.740 12.852
56 HB3 DLE 7 HB2 DLE 7 28.051 26.257 11.257
57 HG DLE 7 HG DLE 7 29.461 26.998 13.772
58 HD11 DLE 7 1HD1 DLE 7 30.950 27.473 11.726
59 HD12 DLE 7 2HD1 DLE 7 30.416 28.974 12.393
60 HD13 DLE 7 3HD1 DLE 7 29.567 28.175 10.941
61 HD21 DLE 7 1HD2 DLE 7 27.328 27.756 13.860
62 HD22 DLE 7 2HD2 DLE 7 27.606 28.645 12.247
63 HD23 DLE 7 3HD2 DLE 7 28.428 29.076 13.808
64 H DTH 8 H DTH 8 28.541 24.886 9.615
65 HA DTH 8 HA DTH 8 28.372 22.003 9.470
66 HB DTH 8 HB DTH 8 27.649 24.068 7.461
67 HG21 DTH 8 1HG2 DTH 8 29.378 22.959 6.120
68 HG22 DTH 8 2HG2 DTH 8 29.903 22.013 7.550
69 HG23 DTH 8 3HG2 DTH 8 30.112 23.754 7.560
70 HG1 DTH 8 HG1 DTH 8 27.275 22.449 6.051
71 HA PRO 9 HA PRO 9 23.855 21.569 9.161
72 HB2 PRO 9 HB2 PRO 9 24.533 19.657 11.417
73 HB3 PRO 9 HB1 PRO 9 23.414 19.406 10.081
74 HG2 PRO 9 HG2 PRO 9 25.842 18.314 10.032
75 HG3 PRO 9 HG1 PRO 9 25.157 19.007 8.572
76 HD2 PRO 9 HD2 PRO 9 27.141 20.188 10.630
77 HD3 PRO 9 HD1 PRO 9 27.196 20.388 8.867
78 H GLU 10 H GLU 10 25.695 22.153 12.192
79 HA GLU 10 HA GLU 10 23.651 22.035 14.135
80 HB2 GLU 10 HB2 GLU 10 26.485 23.141 13.931
81 HB3 GLU 10 HB1 GLU 10 25.556 22.816 15.452
82 HG2 GLU 10 HG2 GLU 10 26.362 20.786 13.307
83 HG3 GLU 10 HG1 GLU 10 27.075 21.003 14.900
Start of MODEL 11
1 H1 ALA 1 H1 ALA 1 23.730 24.442 12.003
2 HA ALA 1 HA ALA 1 24.373 27.001 12.993
3 HB1 ALA 1 HB1 ALA 1 22.318 26.194 11.003
4 HB2 ALA 1 HB2 ALA 1 24.014 26.346 10.667
5 HB3 ALA 1 HB3 ALA 1 23.090 27.794 11.146
6 H ALA 2 H ALA 2 21.477 25.259 13.626
7 HA ALA 2 HA ALA 2 20.063 27.634 14.704
8 HB1 ALA 2 HB1 ALA 2 19.071 24.811 14.482
9 HB2 ALA 2 HB2 ALA 2 18.665 26.201 13.475
10 HB3 ALA 2 HB3 ALA 2 18.209 26.125 15.189
11 H ARG 3 H ARG 3 22.287 25.436 16.081
12 HA ARG 3 HA ARG 3 21.615 26.332 18.779
13 HB2 ARG 3 HB2 ARG 3 21.406 23.979 19.580
14 HB3 ARG 3 HB1 ARG 3 20.475 24.143 18.099
15 HG2 ARG 3 HG2 ARG 3 22.300 23.336 16.742
16 HG3 ARG 3 HG1 ARG 3 23.260 23.068 18.215
17 HD2 ARG 3 HD2 ARG 3 21.230 21.479 18.948
18 HD3 ARG 3 HD1 ARG 3 20.476 21.966 17.480
19 HE ARG 3 HE ARG 3 23.035 20.699 16.915
20 HH11 ARG 3 1HH1 ARG 3 22.733 19.049 15.506
21 HH12 ARG 3 2HH1 ARG 3 21.329 17.999 15.437
22 HH21 ARG 3 1HH2 ARG 3 19.519 19.991 17.581
23 HH22 ARG 3 2HH2 ARG 3 19.591 18.555 16.628
24 H DVA 4 H DVA 4 24.275 25.584 16.672
25 HA DVA 4 HA DVA 4 26.120 26.108 18.898
26 HB DVA 4 HB DVA 4 25.982 27.651 16.337
27 HG11 DVA 4 1HG1 DVA 4 25.278 28.255 19.296
28 HG12 DVA 4 2HG1 DVA 4 24.244 28.478 17.880
29 HG13 DVA 4 3HG1 DVA 4 25.652 29.558 18.150
30 HG21 DVA 4 1HG2 DVA 4 28.252 27.315 17.044
31 HG22 DVA 4 2HG2 DVA 4 27.759 27.839 18.726
32 HG23 DVA 4 3HG2 DVA 4 27.650 28.987 17.397
33 HA DPR 5 HA DPR 5 28.140 23.103 16.095
34 HB2 DPR 5 HB1 DPR 5 29.389 21.534 17.912
35 HB3 DPR 5 HB2 DPR 5 27.616 21.638 17.983
36 HG2 DPR 5 HG1 DPR 5 29.686 23.297 19.464
37 HG3 DPR 5 HG2 DPR 5 28.353 22.345 20.165
38 HD2 DPR 5 HD1 DPR 5 28.032 25.044 19.796
39 HD3 DPR 5 HD2 DPR 5 26.753 23.925 19.648
40 H ARG 6 H ARG 6 30.186 22.534 15.608
41 HA ARG 6 HA ARG 6 32.124 24.806 15.588
42 HB2 ARG 6 HB2 ARG 6 31.914 22.256 14.011
43 HB3 ARG 6 HB1 ARG 6 33.292 23.437 13.971
44 HG2 ARG 6 HG2 ARG 6 33.473 22.892 16.444
45 HG3 ARG 6 HG1 ARG 6 32.455 21.573 16.173
46 HD2 ARG 6 HD2 ARG 6 34.922 21.930 14.454
47 HD3 ARG 6 HD1 ARG 6 34.982 21.020 15.965
48 HE ARG 6 HE ARG 6 33.967 20.141 13.426
49 HH11 ARG 6 1HH1 ARG 6 32.966 17.980 13.329
50 HH12 ARG 6 2HH1 ARG 6 32.857 17.059 14.820
51 HH21 ARG 6 1HH2 ARG 6 33.935 19.552 16.929
52 HH22 ARG 6 2HH2 ARG 6 33.303 17.947 16.800
53 H DLE 7 H DLE 7 29.111 23.965 14.261
54 HA DLE 7 HA DLE 7 29.713 25.378 11.757
55 HB2 DLE 7 HB1 DLE 7 27.229 25.661 13.430
56 HB3 DLE 7 HB2 DLE 7 27.421 26.380 11.775
57 HG DLE 7 HG DLE 7 29.075 27.303 14.096
58 HD11 DLE 7 1HD1 DLE 7 30.252 27.456 11.968
59 HD12 DLE 7 2HD1 DLE 7 29.746 28.978 12.702
60 HD13 DLE 7 3HD1 DLE 7 28.880 28.198 11.216
61 HD21 DLE 7 1HD2 DLE 7 26.753 27.881 14.432
62 HD22 DLE 7 2HD2 DLE 7 26.716 28.764 12.918
63 HD23 DLE 7 3HD2 DLE 7 27.946 29.141 14.132
64 H DTH 8 H DTH 8 28.683 24.737 9.960
65 HA DTH 8 HA DTH 8 28.396 21.893 9.846
66 HB DTH 8 HB DTH 8 28.323 23.896 7.665
67 HG21 DTH 8 1HG2 DTH 8 30.558 23.606 8.629
68 HG22 DTH 8 2HG2 DTH 8 30.574 22.903 7.065
69 HG23 DTH 8 3HG2 DTH 8 30.395 21.831 8.478
70 HG1 DTH 8 HG1 DTH 8 27.900 22.226 6.347
71 HA PRO 9 HA PRO 9 23.935 22.029 9.340
72 HB2 PRO 9 HB2 PRO 9 23.197 19.498 10.275
73 HB3 PRO 9 HB1 PRO 9 23.823 19.980 8.675
74 HG2 PRO 9 HG2 PRO 9 25.230 19.084 11.145
75 HG3 PRO 9 HG1 PRO 9 25.422 18.293 9.512
76 HD2 PRO 9 HD2 PRO 9 27.352 20.092 10.316
77 HD3 PRO 9 HD1 PRO 9 26.672 20.080 8.607
78 H GLU 10 H GLU 10 25.655 22.688 12.018
79 HA GLU 10 HA GLU 10 23.463 22.156 13.981
80 HB2 GLU 10 HB2 GLU 10 26.377 22.940 14.492
81 HB3 GLU 10 HB1 GLU 10 25.161 22.553 15.655
82 HG2 GLU 10 HG2 GLU 10 26.011 20.569 13.516
83 HG3 GLU 10 HG1 GLU 10 26.754 20.822 15.154
Start of MODEL 12
1 H1 ALA 1 H1 ALA 1 23.804 25.131 11.991
2 HA ALA 1 HA ALA 1 24.422 27.199 13.732
3 HB1 ALA 1 HB1 ALA 1 22.678 27.136 11.184
4 HB2 ALA 1 HB2 ALA 1 24.448 27.525 11.346
5 HB3 ALA 1 HB3 ALA 1 23.155 28.595 12.048
6 H ALA 2 H ALA 2 21.417 25.511 13.505
7 HA ALA 2 HA ALA 2 19.959 27.400 14.934
8 HB1 ALA 2 HB1 ALA 2 18.343 25.249 15.051
9 HB2 ALA 2 HB2 ALA 2 19.807 24.390 14.561
10 HB3 ALA 2 HB3 ALA 2 19.055 25.587 13.420
11 H ARG 3 H ARG 3 22.349 25.548 16.128
12 HA ARG 3 HA ARG 3 21.288 25.713 18.842
13 HB2 ARG 3 HB2 ARG 3 21.545 23.464 19.503
14 HB3 ARG 3 HB1 ARG 3 20.359 23.667 18.240
15 HG2 ARG 3 HG2 ARG 3 21.987 22.861 16.596
16 HG3 ARG 3 HG1 ARG 3 23.187 22.707 17.794
17 HD2 ARG 3 HD2 ARG 3 21.560 21.243 19.142
18 HD3 ARG 3 HD1 ARG 3 20.452 21.233 17.781
19 HE ARG 3 HE ARG 3 23.117 20.308 16.949
20 HH11 ARG 3 1HH1 ARG 3 23.219 18.566 15.746
21 HH12 ARG 3 2HH1 ARG 3 22.036 17.304 15.892
22 HH21 ARG 3 1HH2 ARG 3 20.000 18.993 18.050
23 HH22 ARG 3 2HH2 ARG 3 20.441 17.443 17.342
24 H DVA 4 H DVA 4 24.151 25.099 16.757
25 HA DVA 4 HA DVA 4 25.887 26.403 18.661
26 HB DVA 4 HB DVA 4 24.978 27.356 15.979
27 HG11 DVA 4 1HG1 DVA 4 24.152 29.305 17.282
28 HG12 DVA 4 2HG1 DVA 4 24.373 28.541 18.723
29 HG13 DVA 4 3HG1 DVA 4 23.234 27.811 17.461
30 HG21 DVA 4 1HG2 DVA 4 26.274 29.439 16.557
31 HG22 DVA 4 2HG2 DVA 4 27.279 28.057 16.219
32 HG23 DVA 4 3HG2 DVA 4 27.027 28.584 17.913
33 HA DPR 5 HA DPR 5 27.917 23.221 16.360
34 HB2 DPR 5 HB1 DPR 5 29.646 22.101 18.205
35 HB3 DPR 5 HB2 DPR 5 27.980 21.750 18.070
36 HG2 DPR 5 HG1 DPR 5 29.280 23.959 19.716
37 HG3 DPR 5 HG2 DPR 5 28.058 22.732 20.335
38 HD2 DPR 5 HD1 DPR 5 27.279 25.328 19.689
39 HD3 DPR 5 HD2 DPR 5 26.336 23.896 19.387
40 H ARG 6 H ARG 6 30.205 22.549 15.706
41 HA ARG 6 HA ARG 6 32.265 24.708 15.592
42 HB2 ARG 6 HB2 ARG 6 31.782 22.130 14.037
43 HB3 ARG 6 HB1 ARG 6 33.025 23.202 13.684
44 HG2 ARG 6 HG2 ARG 6 33.768 23.071 16.068
45 HG3 ARG 6 HG1 ARG 6 32.892 21.582 16.207
46 HD2 ARG 6 HD2 ARG 6 34.974 22.113 13.978
47 HD3 ARG 6 HD1 ARG 6 35.309 21.272 15.541
48 HE ARG 6 HE ARG 6 34.477 20.206 13.130
49 HH11 ARG 6 1HH1 ARG 6 34.403 18.082 12.960
50 HH12 ARG 6 2HH1 ARG 6 34.180 17.106 14.390
51 HH21 ARG 6 1HH2 ARG 6 33.579 19.671 16.593
52 HH22 ARG 6 2HH2 ARG 6 33.722 17.943 16.250
53 H DLE 7 H DLE 7 29.369 23.539 13.863
54 HA DLE 7 HA DLE 7 30.063 25.102 11.495
55 HB2 DLE 7 HB1 DLE 7 27.409 25.239 12.931
56 HB3 DLE 7 HB2 DLE 7 27.565 25.665 11.273
57 HG DLE 7 HG DLE 7 29.115 27.043 13.423
58 HD11 DLE 7 1HD1 DLE 7 29.274 28.916 11.548
59 HD12 DLE 7 2HD1 DLE 7 28.719 27.588 10.500
60 HD13 DLE 7 3HD1 DLE 7 30.168 27.334 11.470
61 HD21 DLE 7 1HD2 DLE 7 26.788 27.207 13.869
62 HD22 DLE 7 2HD2 DLE 7 26.426 27.739 12.191
63 HD23 DLE 7 3HD2 DLE 7 27.328 28.783 13.162
64 H DTH 8 H DTH 8 28.916 24.239 9.542
65 HA DTH 8 HA DTH 8 28.391 21.439 9.850
66 HB DTH 8 HB DTH 8 28.192 23.360 7.439
67 HG21 DTH 8 1HG2 DTH 8 30.216 21.146 7.802
68 HG22 DTH 8 2HG2 DTH 8 30.442 22.806 8.351
69 HG23 DTH 8 3HG2 DTH 8 30.172 22.576 6.644
70 HG1 DTH 8 HG1 DTH 8 28.254 21.081 6.578
71 HA PRO 9 HA PRO 9 23.710 22.312 9.305
72 HB2 PRO 9 HB2 PRO 9 22.751 20.211 10.543
73 HB3 PRO 9 HB1 PRO 9 23.551 20.036 8.912
74 HG2 PRO 9 HG2 PRO 9 24.648 19.502 11.589
75 HG3 PRO 9 HG1 PRO 9 24.643 18.387 10.196
76 HD2 PRO 9 HD2 PRO 9 26.862 19.950 10.629
77 HD3 PRO 9 HD1 PRO 9 26.152 19.767 8.953
78 H GLU 10 H GLU 10 25.738 22.663 11.953
79 HA GLU 10 HA GLU 10 23.585 22.565 13.843
80 HB2 GLU 10 HB2 GLU 10 26.462 23.331 14.578
81 HB3 GLU 10 HB1 GLU 10 25.181 22.866 15.579
82 HG2 GLU 10 HG2 GLU 10 26.093 20.905 13.445
83 HG3 GLU 10 HG1 GLU 10 26.831 21.060 15.058
Start of MODEL 13
1 H1 ALA 1 H1 ALA 1 23.729 24.865 11.889
2 HA ALA 1 HA ALA 1 24.267 27.116 13.580
3 HB1 ALA 1 HB1 ALA 1 22.571 27.265 11.110
4 HB2 ALA 1 HB2 ALA 1 24.318 27.337 11.174
5 HB3 ALA 1 HB3 ALA 1 23.413 28.639 11.967
6 H ALA 2 H ALA 2 21.335 25.393 13.212
7 HA ALA 2 HA ALA 2 19.712 27.095 14.677
8 HB1 ALA 2 HB1 ALA 2 18.381 25.172 15.345
9 HB2 ALA 2 HB2 ALA 2 19.599 24.036 14.763
10 HB3 ALA 2 HB3 ALA 2 18.793 25.192 13.670
11 H ARG 3 H ARG 3 22.401 25.437 16.055
12 HA ARG 3 HA ARG 3 21.517 25.892 18.790
13 HB2 ARG 3 HB2 ARG 3 21.977 23.585 19.497
14 HB3 ARG 3 HB1 ARG 3 20.570 23.761 18.455
15 HG2 ARG 3 HG2 ARG 3 21.750 22.820 16.566
16 HG3 ARG 3 HG1 ARG 3 23.233 22.780 17.448
17 HD2 ARG 3 HD2 ARG 3 21.930 21.156 19.134
18 HD3 ARG 3 HD1 ARG 3 20.622 21.318 18.016
19 HE ARG 3 HE ARG 3 23.225 20.466 16.957
20 HH11 ARG 3 1HH1 ARG 3 23.347 18.600 15.826
21 HH12 ARG 3 2HH1 ARG 3 22.197 17.316 16.095
22 HH21 ARG 3 1HH2 ARG 3 20.066 19.299 18.033
23 HH22 ARG 3 2HH2 ARG 3 20.323 17.723 17.246
24 H DVA 4 H DVA 4 24.091 25.335 16.775
25 HA DVA 4 HA DVA 4 26.126 26.636 18.639
26 HB DVA 4 HB DVA 4 25.557 27.308 15.747
27 HG11 DVA 4 1HG1 DVA 4 24.771 29.412 16.590
28 HG12 DVA 4 2HG1 DVA 4 25.244 29.032 18.259
29 HG13 DVA 4 3HG1 DVA 4 23.884 28.179 17.566
30 HG21 DVA 4 1HG2 DVA 4 27.290 28.887 16.038
31 HG22 DVA 4 2HG2 DVA 4 27.921 27.367 16.358
32 HG23 DVA 4 3HG2 DVA 4 27.572 28.450 17.703
33 HA DPR 5 HA DPR 5 28.064 22.874 17.022
34 HB2 DPR 5 HB1 DPR 5 29.778 23.304 19.420
35 HB3 DPR 5 HB2 DPR 5 28.943 21.808 18.861
36 HG2 DPR 5 HG1 DPR 5 28.116 23.278 21.059
37 HG3 DPR 5 HG2 DPR 5 26.935 22.493 20.022
38 HD2 DPR 5 HD1 DPR 5 27.870 25.317 20.093
39 HD3 DPR 5 HD2 DPR 5 26.216 24.598 19.829
40 H ARG 6 H ARG 6 29.739 22.646 15.765
41 HA ARG 6 HA ARG 6 31.830 24.633 15.732
42 HB2 ARG 6 HB2 ARG 6 31.832 21.838 14.710
43 HB3 ARG 6 HB1 ARG 6 33.122 22.954 14.506
44 HG2 ARG 6 HG2 ARG 6 33.656 23.161 16.834
45 HG3 ARG 6 HG1 ARG 6 32.124 22.330 17.224
46 HD2 ARG 6 HD2 ARG 6 34.416 21.061 15.526
47 HD3 ARG 6 HD1 ARG 6 34.268 20.830 17.290
48 HE ARG 6 HE ARG 6 32.558 19.772 15.269
49 HH11 ARG 6 1HH1 ARG 6 31.262 17.956 15.901
50 HH12 ARG 6 2HH1 ARG 6 30.914 17.694 17.593
51 HH21 ARG 6 1HH2 ARG 6 32.717 20.392 18.854
52 HH22 ARG 6 2HH2 ARG 6 31.782 18.946 19.096
53 H DLE 7 H DLE 7 28.925 24.432 13.838
54 HA DLE 7 HA DLE 7 30.473 24.658 11.344
55 HB2 DLE 7 HB1 DLE 7 29.012 26.441 10.720
56 HB3 DLE 7 HB2 DLE 7 30.361 26.805 11.893
57 HG DLE 7 HG DLE 7 28.831 26.810 13.708
58 HD11 DLE 7 1HD1 DLE 7 27.481 28.649 13.391
59 HD12 DLE 7 2HD1 DLE 7 27.484 28.460 11.575
60 HD13 DLE 7 3HD1 DLE 7 28.985 28.904 12.399
61 HD21 DLE 7 1HD2 DLE 7 26.484 26.207 11.884
62 HD22 DLE 7 2HD2 DLE 7 26.547 26.716 13.643
63 HD23 DLE 7 3HD2 DLE 7 27.217 25.195 13.245
64 H DTH 8 H DTH 8 29.029 24.452 9.415
65 HA DTH 8 HA DTH 8 28.138 21.786 9.785
66 HB DTH 8 HB DTH 8 28.224 23.622 7.394
67 HG21 DTH 8 1HG2 DTH 8 29.598 20.996 7.655
68 HG22 DTH 8 2HG2 DTH 8 30.355 22.452 8.224
69 HG23 DTH 8 3HG2 DTH 8 30.003 22.347 6.540
70 HG1 DTH 8 HG1 DTH 8 27.532 22.051 6.138
71 HA PRO 9 HA PRO 9 23.731 22.105 9.248
72 HB2 PRO 9 HB2 PRO 9 22.851 19.825 10.311
73 HB3 PRO 9 HB1 PRO 9 23.640 19.907 8.689
74 HG2 PRO 9 HG2 PRO 9 25.095 19.152 11.158
75 HG3 PRO 9 HG1 PRO 9 25.189 18.417 9.556
76 HD2 PRO 9 HD2 PRO 9 26.945 20.116 10.537
77 HD3 PRO 9 HD1 PRO 9 26.402 20.012 8.743
78 H GLU 10 H GLU 10 25.435 22.984 11.712
79 HA GLU 10 HA GLU 10 23.542 22.466 13.845
80 HB2 GLU 10 HB2 GLU 10 26.487 23.118 14.014
81 HB3 GLU 10 HB1 GLU 10 25.533 22.687 15.419
82 HG2 GLU 10 HG2 GLU 10 26.036 20.794 13.098
83 HG3 GLU 10 HG1 GLU 10 26.890 20.794 14.609
Start of MODEL 14
1 H1 ALA 1 H1 ALA 1 22.975 24.878 11.742
2 HA ALA 1 HA ALA 1 23.867 26.952 13.333
3 HB1 ALA 1 HB1 ALA 1 23.786 27.468 11.137
4 HB2 ALA 1 HB2 ALA 1 22.824 28.605 12.035
5 HB3 ALA 1 HB3 ALA 1 22.004 27.333 11.061
6 H ALA 2 H ALA 2 21.031 25.344 13.844
7 HA ALA 2 HA ALA 2 19.779 27.523 15.281
8 HB1 ALA 2 HB1 ALA 2 18.401 25.818 13.937
9 HB2 ALA 2 HB2 ALA 2 17.869 25.921 15.569
10 HB3 ALA 2 HB3 ALA 2 18.783 24.565 15.110
11 H ARG 3 H ARG 3 22.056 25.397 15.899
12 HA ARG 3 HA ARG 3 21.699 25.417 18.861
13 HB2 ARG 3 HB2 ARG 3 21.370 23.310 17.722
14 HB3 ARG 3 HB1 ARG 3 23.003 23.345 17.052
15 HG2 ARG 3 HG2 ARG 3 23.676 23.327 19.723
16 HG3 ARG 3 HG1 ARG 3 22.064 22.960 19.949
17 HD2 ARG 3 HD2 ARG 3 22.796 21.126 20.217
18 HD3 ARG 3 HD1 ARG 3 22.192 20.932 18.566
19 HE ARG 3 HE ARG 3 24.375 20.821 17.610
20 HH11 ARG 3 1HH1 ARG 3 26.390 20.334 17.535
21 HH12 ARG 3 2HH1 ARG 3 27.304 20.136 18.989
22 HH21 ARG 3 1HH2 ARG 3 24.802 21.465 21.076
23 HH22 ARG 3 2HH2 ARG 3 26.475 20.965 20.987
24 H DVA 4 H DVA 4 24.370 25.523 16.387
25 HA DVA 4 HA DVA 4 26.126 26.495 18.575
26 HB DVA 4 HB DVA 4 26.002 27.264 15.622
27 HG11 DVA 4 1HG1 DVA 4 25.788 29.542 16.679
28 HG12 DVA 4 2HG1 DVA 4 25.123 28.613 18.076
29 HG13 DVA 4 3HG1 DVA 4 24.422 28.548 16.431
30 HG21 DVA 4 1HG2 DVA 4 28.358 27.168 16.228
31 HG22 DVA 4 2HG2 DVA 4 27.952 27.872 17.821
32 HG23 DVA 4 3HG2 DVA 4 27.781 28.864 16.272
33 HA DPR 5 HA DPR 5 28.445 22.719 17.037
34 HB2 DPR 5 HB1 DPR 5 30.002 22.410 19.082
35 HB3 DPR 5 HB2 DPR 5 28.290 21.970 19.170
36 HG2 DPR 5 HG1 DPR 5 29.560 24.511 20.175
37 HG3 DPR 5 HG2 DPR 5 28.451 23.429 21.059
38 HD2 DPR 5 HD1 DPR 5 27.450 25.577 19.849
39 HD3 DPR 5 HD2 DPR 5 26.533 24.051 19.818
40 H ARG 6 H ARG 6 30.017 22.977 15.517
41 HA ARG 6 HA ARG 6 31.915 25.222 15.960
42 HB2 ARG 6 HB2 ARG 6 32.535 22.645 14.682
43 HB3 ARG 6 HB1 ARG 6 33.664 24.019 14.853
44 HG2 ARG 6 HG2 ARG 6 33.339 23.804 17.303
45 HG3 ARG 6 HG1 ARG 6 32.520 22.288 17.143
46 HD2 ARG 6 HD2 ARG 6 35.258 22.946 15.912
47 HD3 ARG 6 HD1 ARG 6 34.940 22.003 17.440
48 HE ARG 6 HE ARG 6 34.622 21.124 14.620
49 HH11 ARG 6 1HH1 ARG 6 34.870 18.867 14.427
50 HH12 ARG 6 2HH1 ARG 6 34.460 17.841 15.765
51 HH21 ARG 6 1HH2 ARG 6 33.709 20.339 17.973
52 HH22 ARG 6 2HH2 ARG 6 34.012 18.584 17.685
53 H DLE 7 H DLE 7 29.756 23.549 13.953
54 HA DLE 7 HA DLE 7 30.523 24.634 11.309
55 HB2 DLE 7 HB1 DLE 7 28.520 26.014 11.099
56 HB3 DLE 7 HB2 DLE 7 29.623 26.619 12.293
57 HG DLE 7 HG DLE 7 28.014 25.992 14.069
58 HD11 DLE 7 1HD1 DLE 7 27.383 28.073 12.013
59 HD12 DLE 7 2HD1 DLE 7 28.152 28.092 13.645
60 HD13 DLE 7 3HD1 DLE 7 26.406 27.735 13.332
61 HD21 DLE 7 1HD2 DLE 7 26.049 25.742 11.717
62 HD22 DLE 7 2HD2 DLE 7 25.848 25.623 13.553
63 HD23 DLE 7 3HD2 DLE 7 26.536 24.295 12.617
64 H DTH 8 H DTH 8 29.187 24.088 9.584
65 HA DTH 8 HA DTH 8 28.446 21.355 10.195
66 HB DTH 8 HB DTH 8 28.554 22.673 7.488
67 HG21 DTH 8 1HG2 DTH 8 30.819 22.566 8.535
68 HG22 DTH 8 2HG2 DTH 8 30.649 21.387 7.277
69 HG23 DTH 8 3HG2 DTH 8 30.549 20.844 8.929
70 HG1 DTH 8 HG1 DTH 8 28.842 20.556 7.013
71 HA PRO 9 HA PRO 9 24.018 22.452 8.815
72 HB2 PRO 9 HB2 PRO 9 22.769 20.335 9.596
73 HB3 PRO 9 HB1 PRO 9 23.939 20.285 8.293
74 HG2 PRO 9 HG2 PRO 9 24.286 19.427 11.237
75 HG3 PRO 9 HG1 PRO 9 24.976 18.641 9.822
76 HD2 PRO 9 HD2 PRO 9 26.529 20.437 11.257
77 HD3 PRO 9 HD1 PRO 9 26.690 19.958 9.516
78 H GLU 10 H GLU 10 25.183 22.936 11.791
79 HA GLU 10 HA GLU 10 22.690 22.558 13.317
80 HB2 GLU 10 HB2 GLU 10 25.560 22.775 14.371
81 HB3 GLU 10 HB1 GLU 10 24.093 22.338 15.279
82 HG2 GLU 10 HG2 GLU 10 24.181 20.146 13.755
83 HG3 GLU 10 HG1 GLU 10 25.758 20.822 13.341
Start of MODEL 15
1 H1 ALA 1 H1 ALA 1 23.784 25.176 11.944
2 HA ALA 1 HA ALA 1 24.112 27.215 13.787
3 HB1 ALA 1 HB1 ALA 1 24.229 27.143 11.315
4 HB2 ALA 1 HB2 ALA 1 23.649 28.679 12.103
5 HB3 ALA 1 HB3 ALA 1 22.501 27.647 11.349
6 H ALA 2 H ALA 2 21.230 25.320 13.876
7 HA ALA 2 HA ALA 2 19.930 27.540 15.285
8 HB1 ALA 2 HB1 ALA 2 18.418 26.141 14.005
9 HB2 ALA 2 HB2 ALA 2 18.203 25.772 15.776
10 HB3 ALA 2 HB3 ALA 2 19.023 24.686 14.851
11 H ARG 3 H ARG 3 21.911 24.766 16.071
12 HA ARG 3 HA ARG 3 21.410 24.654 18.984
13 HB2 ARG 3 HB2 ARG 3 21.575 22.645 17.637
14 HB3 ARG 3 HB1 ARG 3 23.217 22.939 17.298
15 HG2 ARG 3 HG2 ARG 3 23.547 22.965 19.844
16 HG3 ARG 3 HG1 ARG 3 21.812 22.484 20.038
17 HD2 ARG 3 HD2 ARG 3 23.132 20.571 20.385
18 HD3 ARG 3 HD1 ARG 3 22.297 20.456 18.763
19 HE ARG 3 HE ARG 3 24.134 20.494 17.715
20 HH11 ARG 3 1HH1 ARG 3 26.447 19.880 17.569
21 HH12 ARG 3 2HH1 ARG 3 27.404 19.987 19.036
22 HH21 ARG 3 1HH2 ARG 3 25.048 21.010 21.182
23 HH22 ARG 3 2HH2 ARG 3 26.689 20.497 20.908
24 H DVA 4 H DVA 4 23.899 25.527 16.560
25 HA DVA 4 HA DVA 4 25.615 26.630 18.665
26 HB DVA 4 HB DVA 4 25.103 27.501 15.752
27 HG11 DVA 4 1HG1 DVA 4 24.086 29.395 16.826
28 HG12 DVA 4 2HG1 DVA 4 24.363 28.590 18.396
29 HG13 DVA 4 3HG1 DVA 4 23.239 27.811 17.286
30 HG21 DVA 4 1HG2 DVA 4 26.375 29.374 16.053
31 HG22 DVA 4 2HG2 DVA 4 27.451 28.025 16.398
32 HG23 DVA 4 3HG2 DVA 4 26.742 28.913 17.787
33 HA DPR 5 HA DPR 5 28.198 23.295 17.069
34 HB2 DPR 5 HB1 DPR 5 30.162 23.150 18.993
35 HB3 DPR 5 HB2 DPR 5 28.532 22.361 18.848
36 HG2 DPR 5 HG1 DPR 5 29.258 24.721 20.599
37 HG3 DPR 5 HG2 DPR 5 28.062 23.455 20.895
38 HD2 DPR 5 HD1 DPR 5 27.130 25.800 19.995
39 HD3 DPR 5 HD2 DPR 5 26.452 24.194 19.626
40 H ARG 6 H ARG 6 29.635 23.063 15.786
41 HA ARG 6 HA ARG 6 31.856 25.038 15.690
42 HB2 ARG 6 HB2 ARG 6 32.046 22.116 15.115
43 HB3 ARG 6 HB1 ARG 6 33.404 23.323 15.320
44 HG2 ARG 6 HG2 ARG 6 32.631 23.514 17.657
45 HG3 ARG 6 HG1 ARG 6 31.551 22.114 17.424
46 HD2 ARG 6 HD2 ARG 6 34.564 22.140 16.985
47 HD3 ARG 6 HD1 ARG 6 33.649 21.610 18.461
48 HE ARG 6 HE ARG 6 32.859 20.086 16.164
49 HH11 ARG 6 1HH1 ARG 6 33.502 17.879 16.029
50 HH12 ARG 6 2HH1 ARG 6 34.217 17.230 17.496
51 HH21 ARG 6 1HH2 ARG 6 35.377 20.248 18.617
52 HH22 ARG 6 2HH2 ARG 6 35.660 18.471 18.451
53 H DLE 7 H DLE 7 29.330 24.182 13.699
54 HA DLE 7 HA DLE 7 30.956 23.959 11.289
55 HB2 DLE 7 HB1 DLE 7 29.277 25.620 10.202
56 HB3 DLE 7 HB2 DLE 7 30.560 26.262 11.218
57 HG DLE 7 HG DLE 7 29.032 26.555 13.070
58 HD11 DLE 7 1HD1 DLE 7 27.362 27.499 10.744
59 HD12 DLE 7 2HD1 DLE 7 28.970 28.119 11.154
60 HD13 DLE 7 3HD1 DLE 7 27.632 28.327 12.297
61 HD21 DLE 7 1HD2 DLE 7 27.509 24.747 12.978
62 HD22 DLE 7 2HD2 DLE 7 26.715 25.324 11.421
63 HD23 DLE 7 3HD2 DLE 7 26.561 26.200 12.905
64 H DTH 8 H DTH 8 29.555 23.502 9.212
65 HA DTH 8 HA DTH 8 28.085 21.159 9.912
66 HB DTH 8 HB DTH 8 28.786 22.368 7.285
67 HG21 DTH 8 1HG2 DTH 8 29.826 20.148 6.990
68 HG22 DTH 8 2HG2 DTH 8 29.268 19.682 8.656
69 HG23 DTH 8 3HG2 DTH 8 30.419 20.926 8.528
70 HG1 DTH 8 HG1 DTH 8 27.510 20.773 6.402
71 HA PRO 9 HA PRO 9 24.033 22.866 8.985
72 HB2 PRO 9 HB2 PRO 9 22.386 20.860 9.769
73 HB3 PRO 9 HB1 PRO 9 23.225 20.823 8.245
74 HG2 PRO 9 HG2 PRO 9 23.874 19.735 10.988
75 HG3 PRO 9 HG1 PRO 9 24.086 18.764 9.483
76 HD2 PRO 9 HD2 PRO 9 26.240 19.822 10.609
77 HD3 PRO 9 HD1 PRO 9 25.970 19.736 8.901
78 H GLU 10 H GLU 10 25.473 22.603 11.928
79 HA GLU 10 HA GLU 10 23.140 22.517 13.488
80 HB2 GLU 10 HB2 GLU 10 26.094 22.756 14.300
81 HB3 GLU 10 HB1 GLU 10 24.709 22.534 15.397
82 HG2 GLU 10 HG2 GLU 10 24.083 20.483 13.778
83 HG3 GLU 10 HG1 GLU 10 25.647 20.696 13.148
Start of MODEL 16
1 H1 ALA 1 H1 ALA 1 23.093 24.471 11.944
2 HA ALA 1 HA ALA 1 23.850 26.737 13.516
3 HB1 ALA 1 HB1 ALA 1 24.161 26.689 11.088
4 HB2 ALA 1 HB2 ALA 1 23.264 28.069 11.589
5 HB3 ALA 1 HB3 ALA 1 22.405 26.609 10.818
6 H ALA 2 H ALA 2 21.363 25.053 14.344
7 HA ALA 2 HA ALA 2 19.842 27.467 15.019
8 HB1 ALA 2 HB1 ALA 2 18.617 25.880 13.814
9 HB2 ALA 2 HB2 ALA 2 17.876 26.173 15.383
10 HB3 ALA 2 HB3 ALA 2 18.787 24.610 15.059
11 H ARG 3 H ARG 3 22.020 25.239 16.134
12 HA ARG 3 HA ARG 3 21.485 25.702 19.000
13 HB2 ARG 3 HB2 ARG 3 21.248 23.363 18.123
14 HB3 ARG 3 HB1 ARG 3 22.958 23.476 17.584
15 HG2 ARG 3 HG2 ARG 3 23.594 23.768 19.972
16 HG3 ARG 3 HG1 ARG 3 21.845 23.760 20.429
17 HD2 ARG 3 HD2 ARG 3 22.712 21.623 20.955
18 HD3 ARG 3 HD1 ARG 3 21.700 21.426 19.500
19 HE ARG 3 HE ARG 3 23.622 21.241 18.151
20 HH11 ARG 3 1HH1 ARG 3 25.319 19.601 17.911
21 HH12 ARG 3 2HH1 ARG 3 26.103 19.221 19.445
22 HH21 ARG 3 1HH2 ARG 3 24.399 20.880 21.700
23 HH22 ARG 3 2HH2 ARG 3 25.934 20.154 21.313
24 H DVA 4 H DVA 4 24.192 25.318 16.651
25 HA DVA 4 HA DVA 4 25.948 26.661 18.449
26 HB DVA 4 HB DVA 4 25.821 27.207 15.465
27 HG11 DVA 4 1HG1 DVA 4 25.114 29.614 16.284
28 HG12 DVA 4 2HG1 DVA 4 24.837 28.801 17.864
29 HG13 DVA 4 3HG1 DVA 4 23.932 28.354 16.539
30 HG21 DVA 4 1HG2 DVA 4 27.558 28.469 17.712
31 HG22 DVA 4 2HG2 DVA 4 27.478 29.082 16.085
32 HG23 DVA 4 3HG2 DVA 4 28.110 27.494 16.303
33 HA DPR 5 HA DPR 5 28.200 22.843 16.962
34 HB2 DPR 5 HB1 DPR 5 29.803 23.746 19.444
35 HB3 DPR 5 HB2 DPR 5 29.336 22.100 18.950
36 HG2 DPR 5 HG1 DPR 5 27.915 23.061 20.895
37 HG3 DPR 5 HG2 DPR 5 27.118 22.293 19.416
38 HD2 DPR 5 HD1 DPR 5 27.553 25.263 19.886
39 HD3 DPR 5 HD2 DPR 5 26.045 24.375 19.412
40 H ARG 6 H ARG 6 30.091 22.587 16.091
41 HA ARG 6 HA ARG 6 31.957 24.783 15.770
42 HB2 ARG 6 HB2 ARG 6 31.977 21.873 15.230
43 HB3 ARG 6 HB1 ARG 6 33.314 22.898 14.703
44 HG2 ARG 6 HG2 ARG 6 33.521 23.509 17.284
45 HG3 ARG 6 HG1 ARG 6 32.422 22.224 17.560
46 HD2 ARG 6 HD2 ARG 6 35.173 21.979 16.174
47 HD3 ARG 6 HD1 ARG 6 34.644 21.359 17.809
48 HE ARG 6 HE ARG 6 33.557 20.328 15.306
49 HH11 ARG 6 1HH1 ARG 6 33.863 18.382 14.632
50 HH12 ARG 6 2HH1 ARG 6 34.955 17.310 15.521
51 HH21 ARG 6 1HH2 ARG 6 35.583 19.323 18.166
52 HH22 ARG 6 2HH2 ARG 6 35.915 17.826 17.403
53 H DLE 7 H DLE 7 29.385 24.039 14.126
54 HA DLE 7 HA DLE 7 30.512 24.731 11.493
55 HB2 DLE 7 HB1 DLE 7 28.815 26.133 10.824
56 HB3 DLE 7 HB2 DLE 7 29.998 26.672 12.149
57 HG DLE 7 HG DLE 7 28.181 26.179 13.829
58 HD11 DLE 7 1HD1 DLE 7 27.105 28.413 13.472
59 HD12 DLE 7 2HD1 DLE 7 27.968 28.622 11.967
60 HD13 DLE 7 3HD1 DLE 7 28.864 28.456 13.424
61 HD21 DLE 7 1HD2 DLE 7 26.565 25.070 12.597
62 HD22 DLE 7 2HD2 DLE 7 26.307 26.386 11.380
63 HD23 DLE 7 3HD2 DLE 7 25.885 26.487 13.148
64 H DTH 8 H DTH 8 29.171 24.347 9.763
65 HA DTH 8 HA DTH 8 28.307 21.584 9.827
66 HB DTH 8 HB DTH 8 28.790 23.399 7.550
67 HG21 DTH 8 1HG2 DTH 8 30.618 21.966 7.257
68 HG22 DTH 8 2HG2 DTH 8 29.826 20.612 8.262
69 HG23 DTH 8 3HG2 DTH 8 30.534 22.008 8.928
70 HG1 DTH 8 HG1 DTH 8 26.948 22.340 6.975
71 HA PRO 9 HA PRO 9 23.831 22.552 9.064
72 HB2 PRO 9 HB2 PRO 9 22.785 20.321 10.067
73 HB3 PRO 9 HB1 PRO 9 23.672 20.207 8.543
74 HG2 PRO 9 HG2 PRO 9 24.736 19.526 11.340
75 HG3 PRO 9 HG1 PRO 9 24.823 18.649 9.819
76 HD2 PRO 9 HD2 PRO 9 26.736 20.372 10.860
77 HD3 PRO 9 HD1 PRO 9 26.610 19.935 9.080
78 H GLU 10 H GLU 10 25.651 22.533 11.877
79 HA GLU 10 HA GLU 10 23.434 22.227 13.677
80 HB2 GLU 10 HB2 GLU 10 26.162 23.067 14.433
81 HB3 GLU 10 HB1 GLU 10 24.886 22.502 15.461
82 HG2 GLU 10 HG2 GLU 10 24.685 20.449 13.836
83 HG3 GLU 10 HG1 GLU 10 26.387 20.648 13.509
Start of MODEL 17
1 H1 ALA 1 H1 ALA 1 22.749 23.985 11.864
2 HA ALA 1 HA ALA 1 23.989 26.333 12.906
3 HB1 ALA 1 HB1 ALA 1 23.603 25.906 10.523
4 HB2 ALA 1 HB2 ALA 1 22.930 27.458 11.009
5 HB3 ALA 1 HB3 ALA 1 21.825 26.056 10.704
6 H ALA 2 H ALA 2 21.082 25.322 13.911
7 HA ALA 2 HA ALA 2 20.846 27.870 15.353
8 HB1 ALA 2 HB1 ALA 2 18.479 27.766 15.572
9 HB2 ALA 2 HB2 ALA 2 18.411 26.170 14.940
10 HB3 ALA 2 HB3 ALA 2 18.829 27.485 13.866
11 H ARG 3 H ARG 3 22.406 25.379 16.061
12 HA ARG 3 HA ARG 3 21.641 25.461 18.940
13 HB2 ARG 3 HB2 ARG 3 21.296 23.153 17.869
14 HB3 ARG 3 HB1 ARG 3 22.870 23.107 17.371
15 HG2 ARG 3 HG2 ARG 3 23.347 23.354 20.149
16 HG3 ARG 3 HG1 ARG 3 21.668 23.574 20.151
17 HD2 ARG 3 HD2 ARG 3 22.229 21.239 20.934
18 HD3 ARG 3 HD1 ARG 3 21.318 21.168 19.449
19 HE ARG 3 HE ARG 3 23.952 21.325 18.715
20 HH11 ARG 3 1HH1 ARG 3 24.601 19.459 17.319
21 HH12 ARG 3 2HH1 ARG 3 23.589 18.103 17.287
22 HH21 ARG 3 1HH2 ARG 3 21.508 19.007 19.865
23 HH22 ARG 3 2HH2 ARG 3 22.141 17.632 19.023
24 H DVA 4 H DVA 4 24.252 25.222 16.644
25 HA DVA 4 HA DVA 4 25.856 26.748 18.619
26 HB DVA 4 HB DVA 4 25.735 27.093 15.614
27 HG11 DVA 4 1HG1 DVA 4 24.920 29.087 17.721
28 HG12 DVA 4 2HG1 DVA 4 23.760 28.134 16.637
29 HG13 DVA 4 3HG1 DVA 4 24.847 29.306 16.041
30 HG21 DVA 4 1HG2 DVA 4 27.385 28.649 17.671
31 HG22 DVA 4 2HG2 DVA 4 27.241 29.110 16.066
32 HG23 DVA 4 3HG2 DVA 4 27.992 27.516 16.446
33 HA DPR 5 HA DPR 5 28.455 23.125 17.819
34 HB2 DPR 5 HB1 DPR 5 30.709 23.692 19.111
35 HB3 DPR 5 HB2 DPR 5 29.311 23.201 20.010
36 HG2 DPR 5 HG1 DPR 5 30.144 26.107 19.477
37 HG3 DPR 5 HG2 DPR 5 29.638 25.298 21.023
38 HD2 DPR 5 HD1 DPR 5 28.005 26.769 19.470
39 HD3 DPR 5 HD2 DPR 5 27.300 25.375 20.260
40 H ARG 6 H ARG 6 30.124 22.596 16.428
41 HA ARG 6 HA ARG 6 32.116 24.696 15.713
42 HB2 ARG 6 HB2 ARG 6 31.919 21.921 14.676
43 HB3 ARG 6 HB1 ARG 6 33.292 22.958 14.493
44 HG2 ARG 6 HG2 ARG 6 33.763 22.730 16.930
45 HG3 ARG 6 HG1 ARG 6 32.350 21.700 17.093
46 HD2 ARG 6 HD2 ARG 6 35.002 21.277 15.786
47 HD3 ARG 6 HD1 ARG 6 34.289 20.358 17.104
48 HE ARG 6 HE ARG 6 33.253 20.165 14.280
49 HH11 ARG 6 1HH1 ARG 6 32.265 18.289 13.741
50 HH12 ARG 6 2HH1 ARG 6 32.577 16.871 14.679
51 HH21 ARG 6 1HH2 ARG 6 34.104 18.361 17.351
52 HH22 ARG 6 2HH2 ARG 6 33.411 16.932 16.575
53 H DLE 7 H DLE 7 29.182 24.135 14.167
54 HA DLE 7 HA DLE 7 30.436 24.664 11.670
55 HB2 DLE 7 HB1 DLE 7 28.940 26.593 11.087
56 HB3 DLE 7 HB2 DLE 7 30.117 26.984 12.359
57 HG DLE 7 HG DLE 7 28.476 26.814 13.974
58 HD11 DLE 7 1HD1 DLE 7 29.001 28.887 12.932
59 HD12 DLE 7 2HD1 DLE 7 27.309 28.837 13.431
60 HD13 DLE 7 3HD1 DLE 7 27.729 28.684 11.719
61 HD21 DLE 7 1HD2 DLE 7 26.030 26.823 13.163
62 HD22 DLE 7 2HD2 DLE 7 26.821 25.273 13.446
63 HD23 DLE 7 3HD2 DLE 7 26.578 25.924 11.754
64 H DTH 8 H DTH 8 28.850 24.594 9.797
65 HA DTH 8 HA DTH 8 28.228 21.707 10.024
66 HB DTH 8 HB DTH 8 29.015 23.411 7.780
67 HG21 DTH 8 1HG2 DTH 8 30.190 21.553 7.078
68 HG22 DTH 8 2HG2 DTH 8 29.178 20.438 7.987
69 HG23 DTH 8 3HG2 DTH 8 30.268 21.472 8.887
70 HG1 DTH 8 HG1 DTH 8 28.098 22.420 6.300
71 HA PRO 9 HA PRO 9 23.830 22.646 8.855
72 HB2 PRO 9 HB2 PRO 9 22.632 20.356 9.162
73 HB3 PRO 9 HB1 PRO 9 23.832 20.535 7.828
74 HG2 PRO 9 HG2 PRO 9 24.457 19.163 10.445
75 HG3 PRO 9 HG1 PRO 9 24.901 18.762 8.776
76 HD2 PRO 9 HD2 PRO 9 26.573 20.137 10.394
77 HD3 PRO 9 HD1 PRO 9 26.579 20.303 8.537
78 H GLU 10 H GLU 10 25.376 22.327 11.786
79 HA GLU 10 HA GLU 10 23.004 21.860 13.478
80 HB2 GLU 10 HB2 GLU 10 25.968 22.295 14.134
81 HB3 GLU 10 HB1 GLU 10 24.749 22.221 15.276
82 HG2 GLU 10 HG2 GLU 10 23.988 20.018 14.729
83 HG3 GLU 10 HG1 GLU 10 25.178 19.913 13.418
Start of MODEL 18
1 H1 ALA 1 H1 ALA 1 22.908 24.563 11.900
2 HA ALA 1 HA ALA 1 24.330 26.815 13.118
3 HB1 ALA 1 HB1 ALA 1 22.236 26.762 10.884
4 HB2 ALA 1 HB2 ALA 1 24.056 26.734 10.868
5 HB3 ALA 1 HB3 ALA 1 23.303 28.133 11.427
6 H ALA 2 H ALA 2 21.086 25.357 13.883
7 HA ALA 2 HA ALA 2 20.882 27.673 15.677
8 HB1 ALA 2 HB1 ALA 2 18.563 27.410 15.767
9 HB2 ALA 2 HB2 ALA 2 18.521 25.881 14.784
10 HB3 ALA 2 HB3 ALA 2 19.087 27.427 14.077
11 H ARG 3 H ARG 3 22.233 24.751 15.776
12 HA ARG 3 HA ARG 3 21.427 24.564 18.612
13 HB2 ARG 3 HB2 ARG 3 23.437 22.905 17.018
14 HB3 ARG 3 HB1 ARG 3 22.961 22.619 18.691
15 HG2 ARG 3 HG2 ARG 3 20.843 21.752 18.184
16 HG3 ARG 3 HG1 ARG 3 20.838 22.322 16.597
17 HD2 ARG 3 HD2 ARG 3 21.327 19.958 16.756
18 HD3 ARG 3 HD1 ARG 3 22.676 20.872 15.931
19 HE ARG 3 HE ARG 3 23.961 19.794 17.585
20 HH11 ARG 3 1HH1 ARG 3 24.535 18.691 19.428
21 HH12 ARG 3 2HH1 ARG 3 23.371 18.385 20.678
22 HH21 ARG 3 1HH2 ARG 3 20.793 19.778 18.914
23 HH22 ARG 3 2HH2 ARG 3 21.499 19.130 20.503
24 H DVA 4 H DVA 4 24.264 25.241 16.494
25 HA DVA 4 HA DVA 4 25.534 26.708 18.636
26 HB DVA 4 HB DVA 4 25.532 27.212 15.704
27 HG11 DVA 4 1HG1 DVA 4 24.306 28.613 17.955
28 HG12 DVA 4 2HG1 DVA 4 23.397 27.774 16.572
29 HG13 DVA 4 3HG1 DVA 4 24.171 29.230 16.299
30 HG21 DVA 4 1HG2 DVA 4 26.647 29.091 17.931
31 HG22 DVA 4 2HG2 DVA 4 26.875 29.171 16.163
32 HG23 DVA 4 3HG2 DVA 4 27.664 27.918 16.990
33 HA DPR 5 HA DPR 5 28.598 23.530 18.152
34 HB2 DPR 5 HB1 DPR 5 30.595 25.269 19.398
35 HB3 DPR 5 HB2 DPR 5 30.097 23.598 19.644
36 HG2 DPR 5 HG1 DPR 5 29.153 25.508 21.380
37 HG3 DPR 5 HG2 DPR 5 28.111 24.177 20.700
38 HD2 DPR 5 HD1 DPR 5 28.189 26.986 19.686
39 HD3 DPR 5 HD2 DPR 5 26.830 25.954 20.095
40 H ARG 6 H ARG 6 30.112 23.007 16.670
41 HA ARG 6 HA ARG 6 32.174 24.645 15.861
42 HB2 ARG 6 HB2 ARG 6 31.500 21.834 14.860
43 HB3 ARG 6 HB1 ARG 6 33.007 22.786 14.562
44 HG2 ARG 6 HG2 ARG 6 33.201 22.630 17.072
45 HG3 ARG 6 HG1 ARG 6 31.859 21.501 17.105
46 HD2 ARG 6 HD2 ARG 6 34.499 21.225 15.732
47 HD3 ARG 6 HD1 ARG 6 34.181 20.569 17.250
48 HE ARG 6 HE ARG 6 32.138 19.559 15.494
49 HH11 ARG 6 1HH1 ARG 6 31.910 17.363 15.620
50 HH12 ARG 6 2HH1 ARG 6 33.413 16.381 15.658
51 HH21 ARG 6 1HH2 ARG 6 35.493 19.092 16.150
52 HH22 ARG 6 2HH2 ARG 6 35.536 17.358 16.018
53 H DLE 7 H DLE 7 29.423 23.628 14.023
54 HA DLE 7 HA DLE 7 30.545 24.381 11.437
55 HB2 DLE 7 HB1 DLE 7 28.690 25.738 10.783
56 HB3 DLE 7 HB2 DLE 7 30.040 26.358 11.675
57 HG DLE 7 HG DLE 7 28.572 26.525 13.709
58 HD11 DLE 7 1HD1 DLE 7 28.332 28.579 12.117
59 HD12 DLE 7 2HD1 DLE 7 26.820 28.026 13.061
60 HD13 DLE 7 3HD1 DLE 7 27.142 27.675 11.343
61 HD21 DLE 7 1HD2 DLE 7 27.063 24.621 13.415
62 HD22 DLE 7 2HD2 DLE 7 26.378 25.337 11.908
63 HD23 DLE 7 3HD2 DLE 7 26.224 26.004 13.650
64 H DTH 8 H DTH 8 29.305 23.771 9.611
65 HA DTH 8 HA DTH 8 27.733 21.363 9.998
66 HB DTH 8 HB DTH 8 28.752 22.927 7.711
67 HG21 DTH 8 1HG2 DTH 8 29.353 20.189 8.778
68 HG22 DTH 8 2HG2 DTH 8 30.522 21.500 8.598
69 HG23 DTH 8 3HG2 DTH 8 29.948 20.699 7.188
70 HG1 DTH 8 HG1 DTH 8 27.694 21.702 6.269
71 HA PRO 9 HA PRO 9 23.666 22.877 8.783
72 HB2 PRO 9 HB2 PRO 9 22.281 20.640 9.398
73 HB3 PRO 9 HB1 PRO 9 23.347 20.782 7.946
74 HG2 PRO 9 HG2 PRO 9 23.897 19.471 10.613
75 HG3 PRO 9 HG1 PRO 9 24.040 18.854 8.997
76 HD2 PRO 9 HD2 PRO 9 26.208 19.952 10.184
77 HD3 PRO 9 HD1 PRO 9 25.955 20.134 8.403
78 H GLU 10 H GLU 10 25.282 22.415 11.759
79 HA GLU 10 HA GLU 10 22.960 22.269 13.421
80 HB2 GLU 10 HB2 GLU 10 25.817 22.662 14.318
81 HB3 GLU 10 HB1 GLU 10 24.458 22.007 15.215
82 HG2 GLU 10 HG2 GLU 10 24.353 20.079 13.710
83 HG3 GLU 10 HG1 GLU 10 25.968 20.550 13.032
Start of MODEL 19
1 H1 ALA 1 H1 ALA 1 22.723 24.497 11.582
2 HA ALA 1 HA ALA 1 23.739 26.816 12.753
3 HB1 ALA 1 HB1 ALA 1 21.495 26.259 10.766
4 HB2 ALA 1 HB2 ALA 1 23.168 26.204 10.485
5 HB3 ALA 1 HB3 ALA 1 22.420 27.817 10.911
6 H ALA 2 H ALA 2 21.167 25.174 14.156
7 HA ALA 2 HA ALA 2 20.413 27.728 15.571
8 HB1 ALA 2 HB1 ALA 2 18.284 26.527 16.031
9 HB2 ALA 2 HB2 ALA 2 18.870 25.067 15.264
10 HB3 ALA 2 HB3 ALA 2 18.516 26.327 14.240
11 H ARG 3 H ARG 3 21.755 24.522 15.903
12 HA ARG 3 HA ARG 3 21.971 24.636 18.803
13 HB2 ARG 3 HB2 ARG 3 21.828 22.594 17.413
14 HB3 ARG 3 HB1 ARG 3 23.405 23.166 16.696
15 HG2 ARG 3 HG2 ARG 3 24.252 23.015 19.177
16 HG3 ARG 3 HG1 ARG 3 22.809 22.224 19.562
17 HD2 ARG 3 HD2 ARG 3 23.026 20.586 17.732
18 HD3 ARG 3 HD1 ARG 3 24.712 21.133 17.590
19 HE ARG 3 HE ARG 3 24.133 20.242 20.306
20 HH11 ARG 3 1HH1 ARG 3 25.260 18.978 21.045
21 HH12 ARG 3 2HH1 ARG 3 26.288 17.689 20.399
22 HH21 ARG 3 1HH2 ARG 3 25.438 19.092 17.134
23 HH22 ARG 3 2HH2 ARG 3 26.602 18.133 18.011
24 H DVA 4 H DVA 4 24.468 25.441 16.129
25 HA DVA 4 HA DVA 4 25.712 26.847 18.328
26 HB DVA 4 HB DVA 4 26.363 27.015 15.372
27 HG11 DVA 4 1HG1 DVA 4 24.252 27.817 15.108
28 HG12 DVA 4 2HG1 DVA 4 25.239 29.177 15.325
29 HG13 DVA 4 3HG1 DVA 4 24.267 28.650 16.721
30 HG21 DVA 4 1HG2 DVA 4 27.435 29.051 16.097
31 HG22 DVA 4 2HG2 DVA 4 28.082 27.767 17.128
32 HG23 DVA 4 3HG2 DVA 4 26.835 28.949 17.686
33 HA DPR 5 HA DPR 5 28.781 23.512 18.421
34 HB2 DPR 5 HB1 DPR 5 30.553 25.723 19.729
35 HB3 DPR 5 HB2 DPR 5 30.261 23.937 19.988
36 HG2 DPR 5 HG1 DPR 5 28.935 26.020 21.306
37 HG3 DPR 5 HG2 DPR 5 28.426 24.393 21.127
38 HD2 DPR 5 HD1 DPR 5 27.439 26.906 19.794
39 HD3 DPR 5 HD2 DPR 5 26.644 25.306 20.051
40 H ARG 6 H ARG 6 29.809 22.776 16.791
41 HA ARG 6 HA ARG 6 32.220 23.736 15.883
42 HB2 ARG 6 HB2 ARG 6 31.561 21.417 15.977
43 HB3 ARG 6 HB1 ARG 6 30.488 21.693 14.636
44 HG2 ARG 6 HG2 ARG 6 32.405 22.463 13.271
45 HG3 ARG 6 HG1 ARG 6 33.530 22.250 14.664
46 HD2 ARG 6 HD2 ARG 6 32.595 19.835 14.723
47 HD3 ARG 6 HD1 ARG 6 32.149 20.041 13.079
48 HE ARG 6 HE ARG 6 34.065 20.441 12.195
49 HH11 ARG 6 1HH1 ARG 6 36.150 19.696 11.891
50 HH12 ARG 6 2HH1 ARG 6 37.166 19.218 13.206
51 HH21 ARG 6 1HH2 ARG 6 34.561 19.453 15.599
52 HH22 ARG 6 2HH2 ARG 6 36.262 19.084 15.365
53 H DLE 7 H DLE 7 28.986 23.892 14.177
54 HA DLE 7 HA DLE 7 30.498 24.477 11.743
55 HB2 DLE 7 HB1 DLE 7 28.991 26.299 10.991
56 HB3 DLE 7 HB2 DLE 7 30.139 26.693 12.192
57 HG DLE 7 HG DLE 7 28.419 26.409 13.868
58 HD11 DLE 7 1HD1 DLE 7 28.761 28.625 13.041
59 HD12 DLE 7 2HD1 DLE 7 27.107 28.531 13.404
60 HD13 DLE 7 3HD1 DLE 7 27.676 28.393 11.675
61 HD21 DLE 7 1HD2 DLE 7 26.608 24.990 12.951
62 HD22 DLE 7 2HD2 DLE 7 26.334 26.077 11.563
63 HD23 DLE 7 3HD2 DLE 7 25.930 26.612 13.091
64 H DTH 8 H DTH 8 29.099 24.251 9.696
65 HA DTH 8 HA DTH 8 28.233 21.608 9.855
66 HB DTH 8 HB DTH 8 28.425 23.798 7.769
67 HG21 DTH 8 1HG2 DTH 8 30.531 23.242 7.629
68 HG22 DTH 8 2HG2 DTH 8 30.135 21.652 7.110
69 HG23 DTH 8 3HG2 DTH 8 30.316 21.997 8.846
70 HG1 DTH 8 HG1 DTH 8 27.962 22.226 6.229
71 HA PRO 9 HA PRO 9 23.927 22.615 8.721
72 HB2 PRO 9 HB2 PRO 9 23.027 20.214 9.846
73 HB3 PRO 9 HB1 PRO 9 23.123 20.633 8.069
74 HG2 PRO 9 HG2 PRO 9 24.782 18.607 9.185
75 HG3 PRO 9 HG1 PRO 9 25.109 19.742 7.831
76 HD2 PRO 9 HD2 PRO 9 25.991 20.007 10.719
77 HD3 PRO 9 HD1 PRO 9 26.997 20.240 9.219
78 H GLU 10 H GLU 10 25.283 22.908 11.641
79 HA GLU 10 HA GLU 10 22.967 22.199 13.282
80 HB2 GLU 10 HB2 GLU 10 25.797 23.029 14.198
81 HB3 GLU 10 HB1 GLU 10 24.470 22.260 15.111
82 HG2 GLU 10 HG2 GLU 10 24.581 20.406 13.260
83 HG3 GLU 10 HG1 GLU 10 26.259 20.991 13.104
Start of MODEL 20
1 H1 ALA 1 H1 ALA 1 22.816 24.336 11.976
2 HA ALA 1 HA ALA 1 24.001 26.760 12.694
3 HB1 ALA 1 HB1 ALA 1 23.367 26.138 10.436
4 HB2 ALA 1 HB2 ALA 1 22.687 27.631 10.949
5 HB3 ALA 1 HB3 ALA 1 21.641 26.218 10.799
6 H ALA 2 H ALA 2 21.216 25.463 14.033
7 HA ALA 2 HA ALA 2 20.483 27.944 15.421
8 HB1 ALA 2 HB1 ALA 2 18.814 25.427 15.039
9 HB2 ALA 2 HB2 ALA 2 18.729 26.624 13.744
10 HB3 ALA 2 HB3 ALA 2 18.263 27.072 15.404
11 H ARG 3 H ARG 3 21.979 24.917 15.946
12 HA ARG 3 HA ARG 3 21.285 25.032 18.908
13 HB2 ARG 3 HB2 ARG 3 21.002 22.961 17.655
14 HB3 ARG 3 HB1 ARG 3 22.584 22.863 17.219
15 HG2 ARG 3 HG2 ARG 3 23.202 22.789 19.717
16 HG3 ARG 3 HG1 ARG 3 21.398 22.720 20.068
17 HD2 ARG 3 HD2 ARG 3 21.514 20.584 18.711
18 HD3 ARG 3 HD1 ARG 3 23.241 20.962 18.445
19 HE ARG 3 HE ARG 3 22.762 21.204 21.174
20 HH11 ARG 3 1HH1 ARG 3 23.235 19.530 22.707
21 HH12 ARG 3 2HH1 ARG 3 23.569 17.923 22.248
22 HH21 ARG 3 1HH2 ARG 3 22.763 18.498 18.890
23 HH22 ARG 3 2HH2 ARG 3 23.347 17.332 20.070
24 H DVA 4 H DVA 4 24.076 25.293 16.604
25 HA DVA 4 HA DVA 4 25.522 26.583 18.778
26 HB DVA 4 HB DVA 4 25.403 27.007 15.787
27 HG11 DVA 4 1HG1 DVA 4 24.230 29.044 16.158
28 HG12 DVA 4 2HG1 DVA 4 24.868 29.128 17.871
29 HG13 DVA 4 3HG1 DVA 4 23.668 27.948 17.435
30 HG21 DVA 4 1HG2 DVA 4 26.864 29.002 15.882
31 HG22 DVA 4 2HG2 DVA 4 27.643 27.566 16.192
32 HG23 DVA 4 3HG2 DVA 4 27.161 28.635 17.582
33 HA DPR 5 HA DPR 5 28.437 23.278 17.544
34 HB2 DPR 5 HB1 DPR 5 30.611 23.755 19.012
35 HB3 DPR 5 HB2 DPR 5 28.966 23.726 19.841
36 HG2 DPR 5 HG1 DPR 5 30.445 26.166 19.008
37 HG3 DPR 5 HG2 DPR 5 29.608 25.815 20.604
38 HD2 DPR 5 HD1 DPR 5 28.563 27.155 18.454
39 HD3 DPR 5 HD2 DPR 5 27.554 26.310 19.730
40 H ARG 6 H ARG 6 30.289 22.561 16.528
41 HA ARG 6 HA ARG 6 32.389 24.203 15.537
42 HB2 ARG 6 HB2 ARG 6 31.901 21.548 15.927
43 HB3 ARG 6 HB1 ARG 6 31.877 21.627 14.093
44 HG2 ARG 6 HG2 ARG 6 34.024 22.753 14.184
45 HG3 ARG 6 HG1 ARG 6 34.068 22.585 15.974
46 HD2 ARG 6 HD2 ARG 6 35.448 20.800 15.011
47 HD3 ARG 6 HD1 ARG 6 33.997 20.257 15.820
48 HE ARG 6 HE ARG 6 33.271 19.369 13.872
49 HH11 ARG 6 1HH1 ARG 6 33.536 18.752 11.469
50 HH12 ARG 6 2HH1 ARG 6 34.797 19.555 10.612
51 HH21 ARG 6 1HH2 ARG 6 36.117 21.470 13.109
52 HH22 ARG 6 2HH2 ARG 6 36.228 20.997 11.492
53 H DLE 7 H DLE 7 29.288 24.093 14.048
54 HA DLE 7 HA DLE 7 30.544 24.855 11.458
55 HB2 DLE 7 HB1 DLE 7 28.587 26.416 11.235
56 HB3 DLE 7 HB2 DLE 7 29.879 26.895 12.363
57 HG DLE 7 HG DLE 7 28.532 26.631 14.241
58 HD11 DLE 7 1HD1 DLE 7 27.952 28.589 12.660
59 HD12 DLE 7 2HD1 DLE 7 26.580 28.093 13.625
60 HD13 DLE 7 3HD1 DLE 7 26.749 27.591 11.931
61 HD21 DLE 7 1HD2 DLE 7 27.455 24.417 13.780
62 HD22 DLE 7 2HD2 DLE 7 26.336 25.183 12.674
63 HD23 DLE 7 3HD2 DLE 7 26.415 25.589 14.361
64 H DTH 8 H DTH 8 28.924 24.558 9.579
65 HA DTH 8 HA DTH 8 28.258 21.729 9.734
66 HB DTH 8 HB DTH 8 28.004 23.727 7.466
67 HG21 DTH 8 1HG2 DTH 8 29.935 21.309 7.766
68 HG22 DTH 8 2HG2 DTH 8 30.349 22.842 8.340
69 HG23 DTH 8 3HG2 DTH 8 29.944 22.630 6.542
70 HG1 DTH 8 HG1 DTH 8 27.928 21.956 6.202
71 HA PRO 9 HA PRO 9 23.845 22.305 9.116
72 HB2 PRO 9 HB2 PRO 9 22.908 20.129 10.375
73 HB3 PRO 9 HB1 PRO 9 23.556 20.085 8.723
74 HG2 PRO 9 HG2 PRO 9 24.881 19.210 11.356
75 HG3 PRO 9 HG1 PRO 9 25.035 18.509 9.711
76 HD2 PRO 9 HD2 PRO 9 26.638 20.366 11.074
77 HD3 PRO 9 HD1 PRO 9 26.878 19.906 9.380
78 H GLU 10 H GLU 10 25.641 22.543 12.078
79 HA GLU 10 HA GLU 10 23.285 22.121 13.640
80 HB2 GLU 10 HB2 GLU 10 26.042 22.895 14.453
81 HB3 GLU 10 HB1 GLU 10 24.677 22.550 15.575
82 HG2 GLU 10 HG2 GLU 10 24.227 20.408 14.630
83 HG3 GLU 10 HG1 GLU 10 25.722 20.552 13.538