Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
623973 | 6be7 RC | 30355 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ASP 1 HN ASP 1 37.580 20.500 23.230
2 HA ASP 1 HA ASP 1 35.090 21.510 24.390
3 HB2 ASP 1 HB2 ASP 1 37.880 22.450 24.840
4 HB3 ASP 1 HB1 ASP 1 36.460 22.630 25.890
5 H ASP 2 HN ASP 2 37.260 22.500 21.830
6 HA ASP 2 HA ASP 2 35.870 25.000 21.450
7 HB2 ASP 2 HB2 ASP 2 38.400 24.580 20.800
8 HB3 ASP 2 HB1 ASP 2 37.740 23.510 19.590
9 HA PRO 3 HA PRO 3 32.870 22.830 18.960
10 HB2 PRO 3 HB2 PRO 3 31.440 24.840 17.880
11 HB3 PRO 3 HB1 PRO 3 31.320 24.300 19.560
12 HG2 PRO 3 HG2 PRO 3 33.190 26.440 18.470
13 HG3 PRO 3 HG1 PRO 3 31.980 26.740 19.770
14 HD2 PRO 3 HD2 PRO 3 34.440 26.290 20.430
15 HD3 PRO 3 HD1 PRO 3 33.140 25.400 21.250
16 H THR 4 HN THR 4 35.260 25.120 17.750
17 HA THR 4 HA THR 4 34.520 25.170 15.050
18 HB THR 4 HB THR 4 37.410 25.580 15.900
19 HG1 THR 4 HG1 THR 4 36.310 26.730 17.340
20 HG21 THR 4 1HG2 THR 4 37.140 27.320 14.180
21 HG22 THR 4 2HG2 THR 4 35.550 26.680 13.610
22 HG23 THR 4 3HG2 THR 4 36.910 25.740 13.540
23 HA DPR 5 HA DPR 5 36.710 21.720 13.400
24 HB2 DPR 5 HB2 DPR 5 35.530 22.310 11.380
25 HB3 DPR 5 HB1 DPR 5 34.760 20.770 11.750
26 HG2 DPR 5 HG2 DPR 5 33.560 23.140 11.290
27 HG3 DPR 5 HG1 DPR 5 32.830 22.070 12.570
28 HD2 DPR 5 HD2 DPR 5 34.540 24.510 12.810
29 HD3 DPR 5 HD1 DPR 5 33.290 23.960 13.960
30 H DAR 6 HN DAR 6 34.210 21.580 15.720
31 HA DAR 6 HA DAR 6 33.850 18.740 15.820
32 HB2 DAR 6 HB2 DAR 6 33.940 20.960 17.920
33 HB3 DAR 6 HB1 DAR 6 32.580 20.580 16.950
34 HG2 DAR 6 HG2 DAR 6 32.740 18.080 17.750
35 HG3 DAR 6 HG1 DAR 6 33.880 18.730 18.920
36 HD2 DAR 6 HD2 DAR 6 31.080 19.690 18.780
37 HD3 DAR 6 HD1 DAR 6 31.640 18.440 19.870
38 HE DAR 6 HE DAR 6 33.200 20.210 20.800
39 HH11 DAR 6 1HH1 DAR 6 32.920 22.120 21.990
40 HH12 DAR 6 2HH1 DAR 6 31.450 22.890 22.020
41 HH21 DAR 6 1HH2 DAR 6 29.910 20.810 19.640
42 HH22 DAR 6 2HH2 DAR 6 29.680 22.190 20.720
43 H GLN 7 HN GLN 7 36.330 20.830 17.090
44 HA GLN 7 HA GLN 7 38.310 18.740 17.210
45 HB2 GLN 7 HB2 GLN 7 38.330 21.560 18.340
46 HB3 GLN 7 HB1 GLN 7 39.620 20.380 18.530
47 HG2 GLN 7 HG2 GLN 7 40.160 20.290 16.200
48 HG3 GLN 7 HG1 GLN 7 38.710 21.070 15.780
49 HE21 GLN 7 1HE2 GLN 7 38.490 23.250 16.060
50 HE22 GLN 7 2HE2 GLN 7 39.790 24.340 16.650
51 H DGN 8 HN DGN 8 36.180 20.200 19.740
52 HA DGN 8 HA DGN 8 37.400 18.790 21.910
53 HB2 DGN 8 HB2 DGN 8 34.640 18.010 20.880
54 HB3 DGN 8 HB1 DGN 8 36.060 16.940 20.960
55 HG2 DGN 8 HG2 DGN 8 34.930 16.120 22.820
56 HG3 DGN 8 HG1 DGN 8 35.850 17.460 23.550
57 HE21 DGN 8 1HE2 DGN 8 32.810 17.030 21.760
58 HE22 DGN 8 2HE2 DGN 8 31.810 17.950 22.890
Start of MODEL 2
1 H1 ASP 1 HN ASP 1 37.251 19.959 23.500
2 HA ASP 1 HA ASP 1 35.082 21.511 24.519
3 HB2 ASP 1 HB2 ASP 1 37.992 22.303 24.794
4 HB3 ASP 1 HB1 ASP 1 36.743 23.020 25.572
5 H ASP 2 HN ASP 2 37.053 22.320 21.533
6 HA ASP 2 HA ASP 2 35.950 25.060 21.306
7 HB2 ASP 2 HB2 ASP 2 38.243 24.632 20.851
8 HB3 ASP 2 HB1 ASP 2 37.859 23.374 19.745
9 HA PRO 3 HA PRO 3 32.611 23.045 18.842
10 HB2 PRO 3 HB2 PRO 3 32.040 25.919 18.256
11 HB3 PRO 3 HB1 PRO 3 30.989 24.587 18.513
12 HG2 PRO 3 HG2 PRO 3 31.694 26.424 20.389
13 HG3 PRO 3 HG1 PRO 3 31.464 24.681 20.913
14 HD2 PRO 3 HD2 PRO 3 33.943 26.288 20.424
15 HD3 PRO 3 HD1 PRO 3 33.566 25.018 21.660
16 H THR 4 HN THR 4 35.395 24.662 17.831
17 HA THR 4 HA THR 4 34.512 25.218 15.017
18 HB THR 4 HB THR 4 37.231 25.609 16.125
19 HG1 THR 4 HG1 THR 4 35.858 26.699 17.303
20 HG21 THR 4 1HG2 THR 4 37.485 27.138 14.302
21 HG22 THR 4 2HG2 THR 4 35.753 26.704 13.740
22 HG23 THR 4 3HG2 THR 4 37.099 25.533 13.716
23 HA DPR 5 HA DPR 5 36.699 21.773 13.063
24 HB2 DPR 5 HB2 DPR 5 35.284 22.113 11.179
25 HB3 DPR 5 HB1 DPR 5 34.801 20.608 11.831
26 HG2 DPR 5 HG2 DPR 5 33.067 22.816 11.573
27 HG3 DPR 5 HG1 DPR 5 32.956 21.685 13.059
28 HD2 DPR 5 HD2 DPR 5 34.334 24.351 12.569
29 HD3 DPR 5 HD1 DPR 5 33.411 23.960 13.983
30 H DAR 6 HN DAR 6 34.157 21.584 15.487
31 HA DAR 6 HA DAR 6 33.983 18.870 16.011
32 HB2 DAR 6 HB2 DAR 6 33.773 21.157 17.997
33 HB3 DAR 6 HB1 DAR 6 32.487 20.538 16.833
34 HG2 DAR 6 HG2 DAR 6 32.686 18.397 17.747
35 HG3 DAR 6 HG1 DAR 6 33.833 18.945 18.964
36 HD2 DAR 6 HD2 DAR 6 31.154 20.405 18.741
37 HD3 DAR 6 HD1 DAR 6 31.192 18.998 19.694
38 HE DAR 6 HE DAR 6 33.259 20.291 20.839
39 HH11 DAR 6 1HH1 DAR 6 33.156 21.392 22.373
40 HH12 DAR 6 2HH1 DAR 6 31.832 22.341 22.993
41 HH21 DAR 6 1HH2 DAR 6 29.876 21.397 20.075
42 HH22 DAR 6 2HH2 DAR 6 29.857 22.318 21.568
43 H GLN 7 HN GLN 7 36.080 21.408 17.600
44 HA GLN 7 HA GLN 7 38.128 19.224 17.883
45 HB2 GLN 7 HB2 GLN 7 38.389 22.168 17.929
46 HB3 GLN 7 HB1 GLN 7 39.608 21.192 18.327
47 HG2 GLN 7 HG2 GLN 7 39.721 19.986 16.045
48 HG3 GLN 7 HG1 GLN 7 38.420 20.926 15.542
49 HE21 GLN 7 1HE2 GLN 7 38.605 23.289 15.274
50 HE22 GLN 7 2HE2 GLN 7 40.093 24.041 15.252
51 H DGN 8 HN DGN 8 36.480 18.508 19.481
52 HA DGN 8 HA DGN 8 37.546 18.686 22.049
53 HB2 DGN 8 HB2 DGN 8 35.011 17.509 20.886
54 HB3 DGN 8 HB1 DGN 8 36.552 16.727 21.067
55 HG2 DGN 8 HG2 DGN 8 35.302 15.828 22.952
56 HG3 DGN 8 HG1 DGN 8 36.128 17.148 23.656
57 HE21 DGN 8 1HE2 DGN 8 34.783 18.140 25.118
58 HE22 DGN 8 2HE2 DGN 8 33.050 18.241 24.956
Start of MODEL 3
1 H1 ASP 1 HN ASP 1 37.038 20.779 22.370
2 HA ASP 1 HA ASP 1 35.016 21.597 24.395
3 HB2 ASP 1 HB2 ASP 1 37.846 22.565 24.776
4 HB3 ASP 1 HB1 ASP 1 36.431 22.886 25.689
5 H ASP 2 HN ASP 2 37.455 22.536 21.800
6 HA ASP 2 HA ASP 2 36.015 25.055 21.416
7 HB2 ASP 2 HB2 ASP 2 38.458 24.776 21.191
8 HB3 ASP 2 HB1 ASP 2 38.326 23.657 19.856
9 HA PRO 3 HA PRO 3 33.171 22.517 18.898
10 HB2 PRO 3 HB2 PRO 3 31.373 24.410 18.199
11 HB3 PRO 3 HB1 PRO 3 31.578 23.961 19.911
12 HG2 PRO 3 HG2 PRO 3 32.837 26.303 18.350
13 HG3 PRO 3 HG1 PRO 3 31.959 26.410 19.823
14 HD2 PRO 3 HD2 PRO 3 34.693 26.100 19.915
15 HD3 PRO 3 HD1 PRO 3 33.551 25.422 21.159
16 H THR 4 HN THR 4 35.331 25.168 17.767
17 HA THR 4 HA THR 4 34.339 25.294 15.211
18 HB THR 4 HB THR 4 37.242 25.750 15.543
19 HG1 THR 4 HG1 THR 4 36.334 26.593 17.214
20 HG21 THR 4 1HG2 THR 4 35.902 26.216 13.342
21 HG22 THR 4 2HG2 THR 4 37.028 27.422 14.147
22 HG23 THR 4 3HG2 THR 4 35.207 27.558 14.279
23 HA DPR 5 HA DPR 5 36.653 21.984 13.055
24 HB2 DPR 5 HB2 DPR 5 35.286 21.950 11.186
25 HB3 DPR 5 HB1 DPR 5 34.353 20.699 11.975
26 HG2 DPR 5 HG2 DPR 5 33.179 22.879 11.449
27 HG3 DPR 5 HG1 DPR 5 32.738 21.998 12.916
28 HD2 DPR 5 HD2 DPR 5 34.750 24.371 12.536
29 HD3 DPR 5 HD1 DPR 5 33.301 24.082 13.700
30 H DAR 6 HN DAR 6 34.406 21.618 15.657
31 HA DAR 6 HA DAR 6 33.934 18.816 15.650
32 HB2 DAR 6 HB2 DAR 6 33.666 20.759 17.952
33 HB3 DAR 6 HB1 DAR 6 32.448 20.333 16.642
34 HG2 DAR 6 HG2 DAR 6 32.126 18.151 17.313
35 HG3 DAR 6 HG1 DAR 6 33.484 18.128 18.321
36 HD2 DAR 6 HD2 DAR 6 30.815 19.598 18.566
37 HD3 DAR 6 HD1 DAR 6 31.265 18.160 19.435
38 HE DAR 6 HE DAR 6 33.214 19.623 20.375
39 HH11 DAR 6 1HH1 DAR 6 32.958 21.131 22.152
40 HH12 DAR 6 2HH1 DAR 6 31.617 22.237 22.315
41 HH21 DAR 6 1HH2 DAR 6 29.981 21.091 19.416
42 HH22 DAR 6 2HH2 DAR 6 29.867 21.918 20.894
43 H GLN 7 HN GLN 7 36.166 20.891 17.371
44 HA GLN 7 HA GLN 7 37.977 18.615 17.514
45 HB2 GLN 7 HB2 GLN 7 38.144 21.547 18.138
46 HB3 GLN 7 HB1 GLN 7 39.534 20.392 18.193
47 HG2 GLN 7 HG2 GLN 7 39.600 20.185 15.738
48 HG3 GLN 7 HG1 GLN 7 38.222 21.261 15.602
49 HE21 GLN 7 1HE2 GLN 7 38.523 23.529 15.807
50 HE22 GLN 7 2HE2 GLN 7 40.101 24.214 16.113
51 H DGN 8 HN DGN 8 35.836 19.882 19.770
52 HA DGN 8 HA DGN 8 37.423 18.842 21.984
53 HB2 DGN 8 HB2 DGN 8 35.260 17.520 22.652
54 HB3 DGN 8 HB1 DGN 8 34.913 17.553 20.889
55 HG2 DGN 8 HG2 DGN 8 36.736 16.223 20.347
56 HG3 DGN 8 HG1 DGN 8 37.567 16.565 21.961
57 HE21 DGN 8 1HE2 DGN 8 37.464 13.986 21.136
58 HE22 DGN 8 2HE2 DGN 8 36.153 13.173 22.069
Start of MODEL 4
1 H1 ASP 1 HN ASP 1 37.370 20.544 22.236
2 HA ASP 1 HA ASP 1 35.349 21.286 24.149
3 HB2 ASP 1 HB2 ASP 1 38.087 22.317 24.647
4 HB3 ASP 1 HB1 ASP 1 36.750 22.533 25.658
5 H ASP 2 HN ASP 2 36.535 22.133 21.315
6 HA ASP 2 HA ASP 2 35.606 24.927 21.450
7 HB2 ASP 2 HB2 ASP 2 38.085 24.444 20.970
8 HB3 ASP 2 HB1 ASP 2 37.482 23.907 19.388
9 HA PRO 3 HA PRO 3 32.388 23.329 18.745
10 HB2 PRO 3 HB2 PRO 3 31.577 25.730 17.696
11 HB3 PRO 3 HB1 PRO 3 31.073 24.902 19.262
12 HG2 PRO 3 HG2 PRO 3 33.049 27.142 18.799
13 HG3 PRO 3 HG1 PRO 3 31.847 26.977 20.074
14 HD2 PRO 3 HD2 PRO 3 34.531 26.322 20.382
15 HD3 PRO 3 HD1 PRO 3 33.257 25.467 21.313
16 H THR 4 HN THR 4 35.092 25.273 17.706
17 HA THR 4 HA THR 4 34.758 25.349 15.020
18 HB THR 4 HB THR 4 37.521 25.125 16.302
19 HG1 THR 4 HG1 THR 4 36.490 26.883 17.209
20 HG21 THR 4 1HG2 THR 4 37.726 24.853 13.977
21 HG22 THR 4 2HG2 THR 4 38.086 26.557 14.249
22 HG23 THR 4 3HG2 THR 4 36.446 26.043 13.700
23 HA DPR 5 HA DPR 5 36.835 21.629 13.492
24 HB2 DPR 5 HB2 DPR 5 36.058 22.079 11.451
25 HB3 DPR 5 HB1 DPR 5 34.996 20.712 11.729
26 HG2 DPR 5 HG2 DPR 5 33.753 23.002 11.269
27 HG3 DPR 5 HG1 DPR 5 33.262 21.951 12.676
28 HD2 DPR 5 HD2 DPR 5 34.687 24.614 12.812
29 HD3 DPR 5 HD1 DPR 5 33.473 23.904 13.844
30 H DAR 6 HN DAR 6 34.139 21.659 15.673
31 HA DAR 6 HA DAR 6 33.899 18.830 15.877
32 HB2 DAR 6 HB2 DAR 6 33.508 20.949 18.035
33 HB3 DAR 6 HB1 DAR 6 32.322 20.461 16.934
34 HG2 DAR 6 HG2 DAR 6 32.121 18.266 17.883
35 HG3 DAR 6 HG1 DAR 6 33.546 18.626 18.923
36 HD2 DAR 6 HD2 DAR 6 30.888 20.097 18.914
37 HD3 DAR 6 HD1 DAR 6 31.213 18.849 20.133
38 HE DAR 6 HE DAR 6 33.260 20.081 20.739
39 HH11 DAR 6 1HH1 DAR 6 33.722 21.612 22.115
40 HH12 DAR 6 2HH1 DAR 6 32.404 22.785 22.636
41 HH21 DAR 6 1HH2 DAR 6 30.244 21.862 20.216
42 HH22 DAR 6 2HH2 DAR 6 30.826 23.104 21.394
43 H GLN 7 HN GLN 7 36.203 21.026 17.330
44 HA GLN 7 HA GLN 7 37.945 18.663 17.816
45 HB2 GLN 7 HB2 GLN 7 38.478 21.707 17.426
46 HB3 GLN 7 HB1 GLN 7 39.628 20.396 18.098
47 HG2 GLN 7 HG2 GLN 7 39.582 19.124 16.255
48 HG3 GLN 7 HG1 GLN 7 38.212 19.823 15.554
49 HE21 GLN 7 1HE2 GLN 7 39.443 20.088 13.533
50 HE22 GLN 7 2HE2 GLN 7 40.580 21.413 13.404
51 H DGN 8 HN DGN 8 36.609 17.954 19.552
52 HA DGN 8 HA DGN 8 37.707 18.485 22.000
53 HB2 DGN 8 HB2 DGN 8 34.995 17.346 21.124
54 HB3 DGN 8 HB1 DGN 8 36.369 16.369 21.277
55 HG2 DGN 8 HG2 DGN 8 36.369 17.097 23.826
56 HG3 DGN 8 HG1 DGN 8 34.690 17.436 23.541
57 HE21 DGN 8 1HE2 DGN 8 36.458 15.191 24.777
58 HE22 DGN 8 2HE2 DGN 8 35.488 13.754 24.553
Start of MODEL 5
1 H1 ASP 1 HN ASP 1 37.540 20.116 22.860
2 HA ASP 1 HA ASP 1 35.102 21.199 24.098
3 HB2 ASP 1 HB2 ASP 1 37.783 21.818 25.213
4 HB3 ASP 1 HB1 ASP 1 36.143 21.986 25.961
5 H ASP 2 HN ASP 2 36.879 22.070 21.535
6 HA ASP 2 HA ASP 2 35.871 24.802 21.739
7 HB2 ASP 2 HB2 ASP 2 38.184 24.538 21.266
8 HB3 ASP 2 HB1 ASP 2 37.806 23.645 19.827
9 HA PRO 3 HA PRO 3 32.555 23.519 18.715
10 HB2 PRO 3 HB2 PRO 3 32.805 26.345 17.779
11 HB3 PRO 3 HB1 PRO 3 31.475 25.160 18.196
12 HG2 PRO 3 HG2 PRO 3 32.208 27.122 20.046
13 HG3 PRO 3 HG1 PRO 3 31.796 25.400 20.475
14 HD2 PRO 3 HD2 PRO 3 34.537 26.573 20.156
15 HD3 PRO 3 HD1 PRO 3 33.810 25.618 21.417
16 H THR 4 HN THR 4 35.454 25.021 17.568
17 HA THR 4 HA THR 4 34.654 25.174 14.870
18 HB THR 4 HB THR 4 37.317 25.477 16.395
19 HG1 THR 4 HG1 THR 4 35.998 26.983 16.633
20 HG21 THR 4 1HG2 THR 4 37.014 26.231 13.499
21 HG22 THR 4 2HG2 THR 4 37.952 24.799 14.051
22 HG23 THR 4 3HG2 THR 4 38.445 26.451 14.548
23 HA DPR 5 HA DPR 5 36.519 21.587 13.026
24 HB2 DPR 5 HB2 DPR 5 35.280 21.583 11.289
25 HB3 DPR 5 HB1 DPR 5 34.275 20.268 11.964
26 HG2 DPR 5 HG2 DPR 5 33.063 22.513 11.411
27 HG3 DPR 5 HG1 DPR 5 32.849 21.602 12.979
28 HD2 DPR 5 HD2 DPR 5 34.422 24.145 12.457
29 HD3 DPR 5 HD1 DPR 5 33.247 23.815 13.761
30 H DAR 6 HN DAR 6 34.162 21.595 15.656
31 HA DAR 6 HA DAR 6 34.094 18.749 15.871
32 HB2 DAR 6 HB2 DAR 6 33.510 20.812 18.017
33 HB3 DAR 6 HB1 DAR 6 32.271 20.220 16.913
34 HG2 DAR 6 HG2 DAR 6 32.326 18.087 17.921
35 HG3 DAR 6 HG1 DAR 6 33.681 18.571 18.986
36 HD2 DAR 6 HD2 DAR 6 31.016 19.928 19.065
37 HD3 DAR 6 HD1 DAR 6 31.421 18.578 20.121
38 HE DAR 6 HE DAR 6 33.364 20.149 20.856
39 HH11 DAR 6 1HH1 DAR 6 33.708 22.000 21.616
40 HH12 DAR 6 2HH1 DAR 6 32.393 23.082 22.201
41 HH21 DAR 6 1HH2 DAR 6 30.069 21.315 20.263
42 HH22 DAR 6 2HH2 DAR 6 30.314 22.771 21.113
43 H GLN 7 HN GLN 7 36.359 21.159 16.983
44 HA GLN 7 HA GLN 7 38.181 19.314 17.911
45 HB2 GLN 7 HB2 GLN 7 38.126 22.352 17.870
46 HB3 GLN 7 HB1 GLN 7 39.369 21.449 18.745
47 HG2 GLN 7 HG2 GLN 7 40.067 20.269 16.765
48 HG3 GLN 7 HG1 GLN 7 38.758 20.815 15.803
49 HE21 GLN 7 1HE2 GLN 7 38.578 23.296 15.537
50 HE22 GLN 7 2HE2 GLN 7 39.995 24.246 15.562
51 H DGN 8 HN DGN 8 36.331 18.484 19.272
52 HA DGN 8 HA DGN 8 37.597 18.518 21.913
53 HB2 DGN 8 HB2 DGN 8 35.041 17.084 21.083
54 HB3 DGN 8 HB1 DGN 8 36.616 16.465 20.966
55 HG2 DGN 8 HG2 DGN 8 36.829 16.874 23.433
56 HG3 DGN 8 HG1 DGN 8 35.140 17.273 23.563
57 HE21 DGN 8 1HE2 DGN 8 36.361 15.138 24.956
58 HE22 DGN 8 2HE2 DGN 8 35.725 13.584 24.291
Start of MODEL 6
1 H1 ASP 1 HN ASP 1 37.489 20.545 22.858
2 HA ASP 1 HA ASP 1 35.065 21.513 24.351
3 HB2 ASP 1 HB2 ASP 1 37.910 22.494 24.486
4 HB3 ASP 1 HB1 ASP 1 36.681 22.884 25.668
5 H ASP 2 HN ASP 2 37.006 22.171 21.553
6 HA ASP 2 HA ASP 2 35.880 24.913 21.326
7 HB2 ASP 2 HB2 ASP 2 38.327 24.318 21.144
8 HB3 ASP 2 HB1 ASP 2 37.944 23.253 19.843
9 HA PRO 3 HA PRO 3 32.768 22.921 18.829
10 HB2 PRO 3 HB2 PRO 3 31.319 25.092 17.946
11 HB3 PRO 3 HB1 PRO 3 31.226 24.490 19.602
12 HG2 PRO 3 HG2 PRO 3 32.994 26.742 18.684
13 HG3 PRO 3 HG1 PRO 3 31.899 26.611 20.146
14 HD2 PRO 3 HD2 PRO 3 34.583 26.276 20.097
15 HD3 PRO 3 HD1 PRO 3 33.458 25.474 21.301
16 H THR 4 HN THR 4 35.136 25.324 17.669
17 HA THR 4 HA THR 4 34.727 25.522 14.943
18 HB THR 4 HB THR 4 37.439 25.207 16.157
19 HG1 THR 4 HG1 THR 4 36.679 26.874 17.273
20 HG21 THR 4 1HG2 THR 4 38.067 26.682 14.382
21 HG22 THR 4 2HG2 THR 4 36.414 26.716 13.795
22 HG23 THR 4 3HG2 THR 4 37.348 25.216 13.626
23 HA DPR 5 HA DPR 5 36.724 21.744 13.370
24 HB2 DPR 5 HB2 DPR 5 35.566 21.945 11.445
25 HB3 DPR 5 HB1 DPR 5 34.672 20.498 12.146
26 HG2 DPR 5 HG2 DPR 5 33.203 22.695 11.472
27 HG3 DPR 5 HG1 DPR 5 33.087 21.832 13.142
28 HD2 DPR 5 HD2 DPR 5 34.781 24.232 12.362
29 HD3 DPR 5 HD1 DPR 5 33.528 24.172 13.658
30 H DAR 6 HN DAR 6 34.132 21.629 15.711
31 HA DAR 6 HA DAR 6 34.056 18.717 16.009
32 HB2 DAR 6 HB2 DAR 6 33.619 21.029 17.813
33 HB3 DAR 6 HB1 DAR 6 32.324 20.451 16.798
34 HG2 DAR 6 HG2 DAR 6 32.341 18.314 18.005
35 HG3 DAR 6 HG1 DAR 6 33.784 18.889 18.929
36 HD2 DAR 6 HD2 DAR 6 31.135 20.225 18.892
37 HD3 DAR 6 HD1 DAR 6 31.493 19.020 20.138
38 HE DAR 6 HE DAR 6 33.539 20.852 20.352
39 HH11 DAR 6 1HH1 DAR 6 33.563 22.401 22.084
40 HH12 DAR 6 2HH1 DAR 6 32.011 22.865 22.740
41 HH21 DAR 6 1HH2 DAR 6 29.910 20.936 20.828
42 HH22 DAR 6 2HH2 DAR 6 30.053 22.029 22.099
43 H GLN 7 HN GLN 7 36.134 21.363 17.321
44 HA GLN 7 HA GLN 7 38.075 19.244 17.881
45 HB2 GLN 7 HB2 GLN 7 38.429 22.164 17.761
46 HB3 GLN 7 HB1 GLN 7 39.651 21.098 18.370
47 HG2 GLN 7 HG2 GLN 7 39.744 19.963 15.996
48 HG3 GLN 7 HG1 GLN 7 38.283 20.786 15.663
49 HE21 GLN 7 1HE2 GLN 7 38.462 23.215 15.450
50 HE22 GLN 7 2HE2 GLN 7 40.016 23.947 15.413
51 H DGN 8 HN DGN 8 36.193 18.620 19.549
52 HA DGN 8 HA DGN 8 37.544 18.728 22.055
53 HB2 DGN 8 HB2 DGN 8 34.852 17.592 21.119
54 HB3 DGN 8 HB1 DGN 8 36.329 16.724 21.064
55 HG2 DGN 8 HG2 DGN 8 36.553 16.707 23.444
56 HG3 DGN 8 HG1 DGN 8 35.057 17.873 23.571
57 HE21 DGN 8 1HE2 DGN 8 34.206 16.366 25.070
58 HE22 DGN 8 2HE2 DGN 8 33.290 15.007 24.386
Start of MODEL 7
1 H1 ASP 1 HN ASP 1 36.586 19.558 23.643
2 HA ASP 1 HA ASP 1 34.927 21.395 24.327
3 HB2 ASP 1 HB2 ASP 1 37.814 22.264 24.499
4 HB3 ASP 1 HB1 ASP 1 36.571 22.812 25.575
5 H ASP 2 HN ASP 2 37.213 22.352 21.659
6 HA ASP 2 HA ASP 2 36.117 24.916 21.462
7 HB2 ASP 2 HB2 ASP 2 38.472 24.294 21.145
8 HB3 ASP 2 HB1 ASP 2 38.024 23.342 19.701
9 HA PRO 3 HA PRO 3 33.040 22.947 19.004
10 HB2 PRO 3 HB2 PRO 3 31.821 25.261 17.738
11 HB3 PRO 3 HB1 PRO 3 31.322 24.230 19.136
12 HG2 PRO 3 HG2 PRO 3 32.576 26.987 19.074
13 HG3 PRO 3 HG1 PRO 3 31.674 26.166 20.379
14 HD2 PRO 3 HD2 PRO 3 34.534 26.312 20.441
15 HD3 PRO 3 HD1 PRO 3 33.389 25.330 21.316
16 H THR 4 HN THR 4 35.379 25.116 17.618
17 HA THR 4 HA THR 4 34.564 25.398 15.097
18 HB THR 4 HB THR 4 37.439 25.415 15.768
19 HG1 THR 4 HG1 THR 4 36.376 26.571 17.399
20 HG21 THR 4 1HG2 THR 4 37.289 27.510 14.224
21 HG22 THR 4 2HG2 THR 4 35.697 27.124 13.868
22 HG23 THR 4 3HG2 THR 4 36.946 25.967 13.443
23 HA DPR 5 HA DPR 5 36.476 21.675 13.074
24 HB2 DPR 5 HB2 DPR 5 35.196 22.205 11.246
25 HB3 DPR 5 HB1 DPR 5 34.291 20.769 11.785
26 HG2 DPR 5 HG2 DPR 5 32.956 22.964 11.356
27 HG3 DPR 5 HG1 DPR 5 32.593 22.152 12.857
28 HD2 DPR 5 HD2 DPR 5 34.624 24.464 12.528
29 HD3 DPR 5 HD1 DPR 5 33.343 24.270 13.697
30 H DAR 6 HN DAR 6 34.395 21.622 15.693
31 HA DAR 6 HA DAR 6 33.905 18.793 16.009
32 HB2 DAR 6 HB2 DAR 6 33.711 20.922 18.093
33 HB3 DAR 6 HB1 DAR 6 32.428 20.407 16.868
34 HG2 DAR 6 HG2 DAR 6 32.509 18.215 17.628
35 HG3 DAR 6 HG1 DAR 6 33.725 18.623 18.941
36 HD2 DAR 6 HD2 DAR 6 30.869 19.622 18.739
37 HD3 DAR 6 HD1 DAR 6 31.551 18.570 19.892
38 HE DAR 6 HE DAR 6 33.069 20.307 20.697
39 HH11 DAR 6 1HH1 DAR 6 32.925 22.145 22.014
40 HH12 DAR 6 2HH1 DAR 6 31.517 23.151 21.762
41 HH21 DAR 6 1HH2 DAR 6 29.895 21.222 19.428
42 HH22 DAR 6 2HH2 DAR 6 29.734 22.576 20.500
43 H GLN 7 HN GLN 7 36.176 21.099 17.448
44 HA GLN 7 HA GLN 7 38.200 18.960 17.871
45 HB2 GLN 7 HB2 GLN 7 38.400 21.932 18.183
46 HB3 GLN 7 HB1 GLN 7 39.770 20.845 18.391
47 HG2 GLN 7 HG2 GLN 7 39.887 20.199 16.247
48 HG3 GLN 7 HG1 GLN 7 38.442 20.903 15.662
49 HE21 GLN 7 1HE2 GLN 7 38.640 23.067 14.781
50 HE22 GLN 7 2HE2 GLN 7 40.238 23.892 14.917
51 H DGN 8 HN DGN 8 36.413 18.271 19.478
52 HA DGN 8 HA DGN 8 37.588 18.685 22.015
53 HB2 DGN 8 HB2 DGN 8 34.682 17.507 21.685
54 HB3 DGN 8 HB1 DGN 8 36.255 16.675 21.110
55 HG2 DGN 8 HG2 DGN 8 37.066 16.718 23.327
56 HG3 DGN 8 HG1 DGN 8 35.579 17.396 23.929
57 HE21 DGN 8 1HE2 DGN 8 35.793 15.327 25.380
58 HE22 DGN 8 2HE2 DGN 8 35.493 13.795 24.621
Start of MODEL 8
1 H1 ASP 1 HN ASP 1 37.418 20.547 22.573
2 HA ASP 1 HA ASP 1 34.900 21.366 23.898
3 HB2 ASP 1 HB2 ASP 1 36.092 22.500 25.709
4 HB3 ASP 1 HB1 ASP 1 36.113 20.833 25.750
5 H ASP 2 HN ASP 2 36.985 22.146 21.433
6 HA ASP 2 HA ASP 2 35.989 24.938 21.338
7 HB2 ASP 2 HB2 ASP 2 38.386 24.724 20.997
8 HB3 ASP 2 HB1 ASP 2 38.160 23.481 19.783
9 HA PRO 3 HA PRO 3 33.019 22.787 18.590
10 HB2 PRO 3 HB2 PRO 3 31.344 24.620 18.044
11 HB3 PRO 3 HB1 PRO 3 31.350 24.006 19.736
12 HG2 PRO 3 HG2 PRO 3 32.707 26.520 18.499
13 HG3 PRO 3 HG1 PRO 3 31.875 26.485 19.977
14 HD2 PRO 3 HD2 PRO 3 34.497 26.199 20.208
15 HD3 PRO 3 HD1 PRO 3 33.410 25.254 21.257
16 H THR 4 HN THR 4 35.290 25.298 17.532
17 HA THR 4 HA THR 4 34.571 25.491 14.968
18 HB THR 4 HB THR 4 37.439 25.502 15.895
19 HG1 THR 4 HG1 THR 4 36.268 26.781 17.217
20 HG21 THR 4 1HG2 THR 4 37.332 27.505 14.277
21 HG22 THR 4 2HG2 THR 4 35.905 26.621 13.532
22 HG23 THR 4 3HG2 THR 4 37.513 25.902 13.515
23 HA DPR 5 HA DPR 5 36.627 21.865 13.332
24 HB2 DPR 5 HB2 DPR 5 35.389 22.081 11.372
25 HB3 DPR 5 HB1 DPR 5 34.621 20.548 11.920
26 HG2 DPR 5 HG2 DPR 5 33.002 22.628 11.602
27 HG3 DPR 5 HG1 DPR 5 32.980 21.667 13.225
28 HD2 DPR 5 HD2 DPR 5 34.354 24.242 12.579
29 HD3 DPR 5 HD1 DPR 5 33.260 23.799 14.040
30 H DAR 6 HN DAR 6 34.070 21.653 15.526
31 HA DAR 6 HA DAR 6 33.827 18.904 15.943
32 HB2 DAR 6 HB2 DAR 6 33.906 20.893 18.096
33 HB3 DAR 6 HB1 DAR 6 32.426 20.761 17.004
34 HG2 DAR 6 HG2 DAR 6 31.920 18.630 17.826
35 HG3 DAR 6 HG1 DAR 6 33.326 18.791 19.001
36 HD2 DAR 6 HD2 DAR 6 30.978 20.609 18.831
37 HD3 DAR 6 HD1 DAR 6 30.940 19.174 19.793
38 HE DAR 6 HE DAR 6 33.307 20.161 20.683
39 HH11 DAR 6 1HH1 DAR 6 33.001 20.665 22.926
40 HH12 DAR 6 2HH1 DAR 6 32.092 22.155 23.232
41 HH21 DAR 6 1HH2 DAR 6 30.104 21.746 20.386
42 HH22 DAR 6 2HH2 DAR 6 30.147 22.497 21.930
43 H GLN 7 HN GLN 7 36.078 21.105 17.490
44 HA GLN 7 HA GLN 7 37.995 18.836 17.914
45 HB2 GLN 7 HB2 GLN 7 38.506 21.837 17.903
46 HB3 GLN 7 HB1 GLN 7 39.686 20.625 18.206
47 HG2 GLN 7 HG2 GLN 7 39.494 19.699 15.965
48 HG3 GLN 7 HG1 GLN 7 38.050 20.640 15.619
49 HE21 GLN 7 1HE2 GLN 7 38.530 23.098 16.147
50 HE22 GLN 7 2HE2 GLN 7 40.006 23.812 15.392
51 H DGN 8 HN DGN 8 36.549 18.164 19.580
52 HA DGN 8 HA DGN 8 37.700 18.678 22.036
53 HB2 DGN 8 HB2 DGN 8 36.062 17.120 22.943
54 HB3 DGN 8 HB1 DGN 8 35.142 17.115 21.418
55 HG2 DGN 8 HG2 DGN 8 36.951 15.836 20.290
56 HG3 DGN 8 HG1 DGN 8 38.071 16.280 21.518
57 HE21 DGN 8 1HE2 DGN 8 38.093 13.723 20.978
58 HE22 DGN 8 2HE2 DGN 8 37.186 12.767 22.135
Start of MODEL 9
1 H1 ASP 1 HN ASP 1 36.963 20.640 22.139
2 HA ASP 1 HA ASP 1 35.116 21.289 24.142
3 HB2 ASP 1 HB2 ASP 1 36.506 22.961 25.529
4 HB3 ASP 1 HB1 ASP 1 36.739 21.190 25.798
5 H ASP 2 HN ASP 2 37.428 22.513 21.697
6 HA ASP 2 HA ASP 2 36.099 24.953 21.215
7 HB2 ASP 2 HB2 ASP 2 38.512 24.344 20.651
8 HB3 ASP 2 HB1 ASP 2 37.874 23.067 19.572
9 HA PRO 3 HA PRO 3 32.737 23.013 18.914
10 HB2 PRO 3 HB2 PRO 3 31.546 25.318 18.044
11 HB3 PRO 3 HB1 PRO 3 31.121 24.624 19.602
12 HG2 PRO 3 HG2 PRO 3 32.889 26.916 18.931
13 HG3 PRO 3 HG1 PRO 3 32.145 26.499 20.619
14 HD2 PRO 3 HD2 PRO 3 34.649 26.452 19.888
15 HD3 PRO 3 HD1 PRO 3 34.013 25.673 21.308
16 H THR 4 HN THR 4 35.182 25.233 17.632
17 HA THR 4 HA THR 4 34.453 25.230 14.935
18 HB THR 4 HB THR 4 37.293 25.627 15.751
19 HG1 THR 4 HG1 THR 4 36.375 26.604 17.209
20 HG21 THR 4 1HG2 THR 4 35.703 26.949 13.639
21 HG22 THR 4 2HG2 THR 4 36.977 25.680 13.486
22 HG23 THR 4 3HG2 THR 4 37.444 27.156 14.093
23 HA DPR 5 HA DPR 5 36.964 21.702 13.748
24 HB2 DPR 5 HB2 DPR 5 36.154 22.217 11.479
25 HB3 DPR 5 HB1 DPR 5 35.420 20.554 11.834
26 HG2 DPR 5 HG2 DPR 5 33.860 22.592 11.116
27 HG3 DPR 5 HG1 DPR 5 33.437 21.742 12.658
28 HD2 DPR 5 HD2 DPR 5 35.001 24.378 12.433
29 HD3 DPR 5 HD1 DPR 5 33.558 23.958 13.402
30 H DAR 6 HN DAR 6 34.058 21.546 15.572
31 HA DAR 6 HA DAR 6 33.852 18.715 15.877
32 HB2 DAR 6 HB2 DAR 6 33.601 21.091 17.794
33 HB3 DAR 6 HB1 DAR 6 32.284 20.470 16.654
34 HG2 DAR 6 HG2 DAR 6 32.330 18.379 17.851
35 HG3 DAR 6 HG1 DAR 6 33.608 18.953 18.899
36 HD2 DAR 6 HD2 DAR 6 30.936 20.460 18.966
37 HD3 DAR 6 HD1 DAR 6 31.306 18.956 19.842
38 HE DAR 6 HE DAR 6 33.413 20.624 20.353
39 HH11 DAR 6 1HH1 DAR 6 33.480 22.037 22.013
40 HH12 DAR 6 2HH1 DAR 6 32.230 23.027 22.614
41 HH21 DAR 6 1HH2 DAR 6 29.861 20.907 20.827
42 HH22 DAR 6 2HH2 DAR 6 30.076 22.225 21.969
43 H GLN 7 HN GLN 7 36.141 21.138 17.278
44 HA GLN 7 HA GLN 7 37.883 18.831 17.824
45 HB2 GLN 7 HB2 GLN 7 38.238 21.825 17.750
46 HB3 GLN 7 HB1 GLN 7 39.558 20.735 18.267
47 HG2 GLN 7 HG2 GLN 7 38.282 20.367 15.638
48 HG3 GLN 7 HG1 GLN 7 39.648 21.422 15.912
49 HE21 GLN 7 1HE2 GLN 7 39.675 18.759 14.254
50 HE22 GLN 7 2HE2 GLN 7 40.324 17.531 15.266
51 H DGN 8 HN DGN 8 36.020 18.516 19.448
52 HA DGN 8 HA DGN 8 37.690 18.578 21.892
53 HB2 DGN 8 HB2 DGN 8 35.939 17.161 22.920
54 HB3 DGN 8 HB1 DGN 8 34.997 17.208 21.476
55 HG2 DGN 8 HG2 DGN 8 36.489 16.164 20.141
56 HG3 DGN 8 HG1 DGN 8 37.865 16.475 21.216
57 HE21 DGN 8 1HE2 DGN 8 35.999 13.990 20.210
58 HE22 DGN 8 2HE2 DGN 8 36.093 13.000 21.745
Start of MODEL 10
1 H1 ASP 1 HN ASP 1 37.412 20.454 22.758
2 HA ASP 1 HA ASP 1 35.331 21.460 24.622
3 HB2 ASP 1 HB2 ASP 1 37.214 22.952 25.461
4 HB3 ASP 1 HB1 ASP 1 37.510 21.260 25.715
5 H ASP 2 HN ASP 2 36.980 22.318 21.538
6 HA ASP 2 HA ASP 2 35.520 24.920 21.502
7 HB2 ASP 2 HB2 ASP 2 38.041 25.047 21.290
8 HB3 ASP 2 HB1 ASP 2 37.878 24.078 19.854
9 HA PRO 3 HA PRO 3 32.910 22.740 18.619
10 HB2 PRO 3 HB2 PRO 3 31.345 24.723 17.708
11 HB3 PRO 3 HB1 PRO 3 31.209 23.959 19.245
12 HG2 PRO 3 HG2 PRO 3 32.701 26.558 18.671
13 HG3 PRO 3 HG1 PRO 3 31.444 26.371 19.958
14 HD2 PRO 3 HD2 PRO 3 34.008 26.058 20.601
15 HD3 PRO 3 HD1 PRO 3 32.803 24.873 21.179
16 H THR 4 HN THR 4 35.110 25.251 17.723
17 HA THR 4 HA THR 4 34.720 25.405 14.992
18 HB THR 4 HB THR 4 37.452 25.253 16.293
19 HG1 THR 4 HG1 THR 4 36.229 26.697 17.414
20 HG21 THR 4 1HG2 THR 4 37.955 26.978 14.483
21 HG22 THR 4 2HG2 THR 4 36.433 26.559 13.753
22 HG23 THR 4 3HG2 THR 4 37.615 25.333 13.919
23 HA DPR 5 HA DPR 5 36.567 21.892 13.083
24 HB2 DPR 5 HB2 DPR 5 35.283 22.074 11.325
25 HB3 DPR 5 HB1 DPR 5 34.232 20.675 11.992
26 HG2 DPR 5 HG2 DPR 5 33.277 23.058 11.325
27 HG3 DPR 5 HG1 DPR 5 32.763 22.327 12.903
28 HD2 DPR 5 HD2 DPR 5 34.853 24.556 12.519
29 HD3 DPR 5 HD1 DPR 5 33.532 24.369 13.697
30 H DAR 6 HN DAR 6 34.175 21.609 15.590
31 HA DAR 6 HA DAR 6 34.097 18.766 15.923
32 HB2 DAR 6 HB2 DAR 6 33.725 20.815 18.092
33 HB3 DAR 6 HB1 DAR 6 32.528 20.557 16.742
34 HG2 DAR 6 HG2 DAR 6 32.082 18.268 17.595
35 HG3 DAR 6 HG1 DAR 6 33.417 18.451 18.687
36 HD2 DAR 6 HD2 DAR 6 30.976 20.090 18.796
37 HD3 DAR 6 HD1 DAR 6 31.333 18.593 19.751
38 HE DAR 6 HE DAR 6 33.335 20.159 20.527
39 HH11 DAR 6 1HH1 DAR 6 33.436 21.952 21.836
40 HH12 DAR 6 2HH1 DAR 6 31.995 22.727 22.451
41 HH21 DAR 6 1HH2 DAR 6 29.832 20.644 20.738
42 HH22 DAR 6 2HH2 DAR 6 30.031 22.257 21.323
43 H GLN 7 HN GLN 7 36.248 21.248 17.289
44 HA GLN 7 HA GLN 7 38.317 19.333 18.122
45 HB2 GLN 7 HB2 GLN 7 38.144 22.399 18.009
46 HB3 GLN 7 HB1 GLN 7 39.459 21.574 18.674
47 HG2 GLN 7 HG2 GLN 7 39.958 20.313 16.638
48 HG3 GLN 7 HG1 GLN 7 38.644 21.017 15.843
49 HE21 GLN 7 1HE2 GLN 7 41.711 21.511 17.216
50 HE22 GLN 7 2HE2 GLN 7 42.176 22.997 16.425
51 H DGN 8 HN DGN 8 36.061 18.607 19.502
52 HA DGN 8 HA DGN 8 37.448 18.751 21.812
53 HB2 DGN 8 HB2 DGN 8 34.593 17.571 21.365
54 HB3 DGN 8 HB1 DGN 8 36.098 16.897 20.942
55 HG2 DGN 8 HG2 DGN 8 35.629 17.614 23.843
56 HG3 DGN 8 HG1 DGN 8 34.877 16.124 23.185
57 HE21 DGN 8 1HE2 DGN 8 36.321 15.353 25.080
58 HE22 DGN 8 2HE2 DGN 8 37.973 14.990 24.647
Start of MODEL 11
1 H1 ASP 1 HN ASP 1 37.527 20.420 23.028
2 HA ASP 1 HA ASP 1 35.284 21.588 24.551
3 HB2 ASP 1 HB2 ASP 1 38.134 22.652 24.304
4 HB3 ASP 1 HB1 ASP 1 36.984 23.078 25.470
5 H ASP 2 HN ASP 2 37.376 22.498 21.668
6 HA ASP 2 HA ASP 2 35.752 24.890 21.481
7 HB2 ASP 2 HB2 ASP 2 38.260 24.944 21.008
8 HB3 ASP 2 HB1 ASP 2 37.961 23.837 19.727
9 HA PRO 3 HA PRO 3 32.729 22.863 18.866
10 HB2 PRO 3 HB2 PRO 3 31.467 24.933 17.776
11 HB3 PRO 3 HB1 PRO 3 31.231 24.398 19.485
12 HG2 PRO 3 HG2 PRO 3 33.021 26.587 18.587
13 HG3 PRO 3 HG1 PRO 3 31.875 26.762 19.875
14 HD2 PRO 3 HD2 PRO 3 34.386 26.256 20.388
15 HD3 PRO 3 HD1 PRO 3 33.177 25.164 21.276
16 H THR 4 HN THR 4 35.152 25.033 17.814
17 HA THR 4 HA THR 4 34.391 25.214 15.098
18 HB THR 4 HB THR 4 37.249 25.383 15.907
19 HG1 THR 4 HG1 THR 4 36.137 26.764 17.350
20 HG21 THR 4 1HG2 THR 4 37.418 27.186 14.326
21 HG22 THR 4 2HG2 THR 4 35.704 26.959 13.861
22 HG23 THR 4 3HG2 THR 4 36.839 25.643 13.538
23 HA DPR 5 HA DPR 5 36.754 21.840 13.169
24 HB2 DPR 5 HB2 DPR 5 35.627 22.006 11.304
25 HB3 DPR 5 HB1 DPR 5 34.680 20.632 11.945
26 HG2 DPR 5 HG2 DPR 5 33.489 23.069 11.185
27 HG3 DPR 5 HG1 DPR 5 32.890 21.981 12.480
28 HD2 DPR 5 HD2 DPR 5 34.367 24.504 12.892
29 HD3 DPR 5 HD1 DPR 5 33.208 23.564 13.950
30 H DAR 6 HN DAR 6 34.305 21.732 15.605
31 HA DAR 6 HA DAR 6 34.052 18.944 15.809
32 HB2 DAR 6 HB2 DAR 6 33.880 20.924 18.051
33 HB3 DAR 6 HB1 DAR 6 32.620 20.751 16.784
34 HG2 DAR 6 HG2 DAR 6 32.353 18.365 17.422
35 HG3 DAR 6 HG1 DAR 6 33.493 18.469 18.635
36 HD2 DAR 6 HD2 DAR 6 31.105 20.365 18.683
37 HD3 DAR 6 HD1 DAR 6 31.135 18.786 19.476
38 HE DAR 6 HE DAR 6 33.218 19.976 20.671
39 HH11 DAR 6 1HH1 DAR 6 33.224 21.408 22.257
40 HH12 DAR 6 2HH1 DAR 6 31.909 22.530 22.678
41 HH21 DAR 6 1HH2 DAR 6 30.124 21.422 19.855
42 HH22 DAR 6 2HH2 DAR 6 30.141 22.500 21.290
43 H GLN 7 HN GLN 7 36.074 21.204 17.476
44 HA GLN 7 HA GLN 7 38.121 19.112 18.064
45 HB2 GLN 7 HB2 GLN 7 38.228 22.137 18.056
46 HB3 GLN 7 HB1 GLN 7 39.579 21.198 18.680
47 HG2 GLN 7 HG2 GLN 7 39.860 19.966 16.654
48 HG3 GLN 7 HG1 GLN 7 38.328 20.689 15.986
49 HE21 GLN 7 1HE2 GLN 7 40.367 20.915 14.211
50 HE22 GLN 7 2HE2 GLN 7 40.891 22.530 14.072
51 H DGN 8 HN DGN 8 36.272 18.287 19.545
52 HA DGN 8 HA DGN 8 37.297 18.473 22.137
53 HB2 DGN 8 HB2 DGN 8 34.660 17.316 21.103
54 HB3 DGN 8 HB1 DGN 8 36.175 16.620 21.439
55 HG2 DGN 8 HG2 DGN 8 36.064 16.815 23.676
56 HG3 DGN 8 HG1 DGN 8 34.701 17.987 23.682
57 HE21 DGN 8 1HE2 DGN 8 32.626 17.376 22.467
58 HE22 DGN 8 2HE2 DGN 8 32.155 15.725 22.820
Start of MODEL 12
1 H1 ASP 1 HN ASP 1 37.813 20.463 22.915
2 HA ASP 1 HA ASP 1 35.588 21.299 24.450
3 HB2 ASP 1 HB2 ASP 1 38.126 22.906 24.066
4 HB3 ASP 1 HB1 ASP 1 37.206 22.672 25.615
5 H ASP 2 HN ASP 2 36.717 22.017 21.417
6 HA ASP 2 HA ASP 2 35.482 24.610 21.484
7 HB2 ASP 2 HB2 ASP 2 37.967 24.604 21.157
8 HB3 ASP 2 HB1 ASP 2 37.683 23.567 19.728
9 HA PRO 3 HA PRO 3 32.631 22.912 18.429
10 HB2 PRO 3 HB2 PRO 3 31.952 25.713 17.879
11 HB3 PRO 3 HB1 PRO 3 30.915 24.296 18.053
12 HG2 PRO 3 HG2 PRO 3 31.335 26.001 20.314
13 HG3 PRO 3 HG1 PRO 3 31.342 24.250 20.451
14 HD2 PRO 3 HD2 PRO 3 33.779 26.064 20.188
15 HD3 PRO 3 HD1 PRO 3 33.504 24.747 21.346
16 H THR 4 HN THR 4 35.405 24.927 17.766
17 HA THR 4 HA THR 4 34.869 25.437 15.059
18 HB THR 4 HB THR 4 37.675 25.341 16.260
19 HG1 THR 4 HG1 THR 4 36.589 26.614 17.430
20 HG21 THR 4 1HG2 THR 4 37.750 25.440 13.883
21 HG22 THR 4 2HG2 THR 4 37.887 27.122 14.472
22 HG23 THR 4 3HG2 THR 4 36.285 26.540 13.885
23 HA DPR 5 HA DPR 5 36.642 21.575 13.145
24 HB2 DPR 5 HB2 DPR 5 35.610 21.871 11.409
25 HB3 DPR 5 HB1 DPR 5 34.377 20.696 12.053
26 HG2 DPR 5 HG2 DPR 5 33.580 23.206 11.249
27 HG3 DPR 5 HG1 DPR 5 33.002 22.466 12.759
28 HD2 DPR 5 HD2 DPR 5 35.162 24.444 12.423
29 HD3 DPR 5 HD1 DPR 5 33.719 24.452 13.535
30 H DAR 6 HN DAR 6 34.221 21.716 15.561
31 HA DAR 6 HA DAR 6 33.699 18.963 16.036
32 HB2 DAR 6 HB2 DAR 6 33.541 21.127 18.041
33 HB3 DAR 6 HB1 DAR 6 32.236 20.575 16.994
34 HG2 DAR 6 HG2 DAR 6 32.138 18.517 17.916
35 HG3 DAR 6 HG1 DAR 6 33.492 18.687 19.052
36 HD2 DAR 6 HD2 DAR 6 30.955 20.391 19.171
37 HD3 DAR 6 HD1 DAR 6 31.204 18.930 19.949
38 HE DAR 6 HE DAR 6 33.353 20.053 20.955
39 HH11 DAR 6 1HH1 DAR 6 33.453 21.402 22.727
40 HH12 DAR 6 2HH1 DAR 6 32.182 22.389 23.264
41 HH21 DAR 6 1HH2 DAR 6 29.951 21.133 20.862
42 HH22 DAR 6 2HH2 DAR 6 30.193 22.359 22.025
43 H GLN 7 HN GLN 7 36.101 21.197 17.379
44 HA GLN 7 HA GLN 7 37.950 18.946 17.720
45 HB2 GLN 7 HB2 GLN 7 38.252 21.930 17.723
46 HB3 GLN 7 HB1 GLN 7 39.567 21.016 18.421
47 HG2 GLN 7 HG2 GLN 7 39.735 19.859 16.143
48 HG3 GLN 7 HG1 GLN 7 38.453 20.961 15.666
49 HE21 GLN 7 1HE2 GLN 7 38.669 23.113 15.700
50 HE22 GLN 7 2HE2 GLN 7 40.190 23.976 15.838
51 H DGN 8 HN DGN 8 36.127 18.387 19.496
52 HA DGN 8 HA DGN 8 37.621 18.562 21.960
53 HB2 DGN 8 HB2 DGN 8 34.979 17.291 21.203
54 HB3 DGN 8 HB1 DGN 8 36.570 16.529 21.309
55 HG2 DGN 8 HG2 DGN 8 36.592 16.722 23.710
56 HG3 DGN 8 HG1 DGN 8 35.088 17.555 23.758
57 HE21 DGN 8 1HE2 DGN 8 35.585 15.187 25.151
58 HE22 DGN 8 2HE2 DGN 8 34.491 13.974 24.444
Start of MODEL 13
1 H1 ASP 1 HN ASP 1 37.298 20.489 22.933
2 HA ASP 1 HA ASP 1 34.532 21.058 23.832
3 HB2 ASP 1 HB2 ASP 1 36.839 22.508 25.049
4 HB3 ASP 1 HB1 ASP 1 35.162 22.551 25.540
5 H ASP 2 HN ASP 2 37.193 22.284 21.826
6 HA ASP 2 HA ASP 2 36.182 24.951 21.489
7 HB2 ASP 2 HB2 ASP 2 38.493 24.653 21.172
8 HB3 ASP 2 HB1 ASP 2 38.166 23.369 19.918
9 HA PRO 3 HA PRO 3 32.889 23.176 18.728
10 HB2 PRO 3 HB2 PRO 3 32.413 25.858 17.848
11 HB3 PRO 3 HB1 PRO 3 31.267 24.753 18.556
12 HG2 PRO 3 HG2 PRO 3 32.372 26.896 19.941
13 HG3 PRO 3 HG1 PRO 3 31.681 25.392 20.737
14 HD2 PRO 3 HD2 PRO 3 34.473 26.359 20.203
15 HD3 PRO 3 HD1 PRO 3 33.916 25.250 21.502
16 H THR 4 HN THR 4 35.400 25.011 17.632
17 HA THR 4 HA THR 4 34.792 25.302 14.813
18 HB THR 4 HB THR 4 37.552 24.999 15.884
19 HG1 THR 4 HG1 THR 4 36.649 26.355 17.246
20 HG21 THR 4 1HG2 THR 4 36.096 26.635 13.642
21 HG22 THR 4 2HG2 THR 4 37.235 25.375 13.385
22 HG23 THR 4 3HG2 THR 4 37.775 26.915 14.116
23 HA DPR 5 HA DPR 5 36.197 21.560 12.971
24 HB2 DPR 5 HB2 DPR 5 34.822 21.744 11.137
25 HB3 DPR 5 HB1 DPR 5 33.690 20.696 12.000
26 HG2 DPR 5 HG2 DPR 5 32.979 23.274 11.331
27 HG3 DPR 5 HG1 DPR 5 32.546 22.340 12.906
28 HD2 DPR 5 HD2 DPR 5 34.697 24.391 12.355
29 HD3 DPR 5 HD1 DPR 5 33.476 24.436 13.621
30 H DAR 6 HN DAR 6 34.271 21.633 15.731
31 HA DAR 6 HA DAR 6 34.059 18.843 16.206
32 HB2 DAR 6 HB2 DAR 6 33.824 21.007 18.191
33 HB3 DAR 6 HB1 DAR 6 32.420 20.482 17.129
34 HG2 DAR 6 HG2 DAR 6 32.602 18.257 18.053
35 HG3 DAR 6 HG1 DAR 6 33.964 18.635 19.028
36 HD2 DAR 6 HD2 DAR 6 31.188 19.854 19.126
37 HD3 DAR 6 HD1 DAR 6 31.690 18.692 20.257
38 HE DAR 6 HE DAR 6 33.509 20.536 20.913
39 HH11 DAR 6 1HH1 DAR 6 33.153 22.504 22.209
40 HH12 DAR 6 2HH1 DAR 6 31.533 22.684 22.835
41 HH21 DAR 6 1HH2 DAR 6 30.219 20.109 21.050
42 HH22 DAR 6 2HH2 DAR 6 29.866 21.519 22.127
43 H GLN 7 HN GLN 7 36.320 21.211 17.364
44 HA GLN 7 HA GLN 7 38.293 19.021 17.827
45 HB2 GLN 7 HB2 GLN 7 38.424 22.058 17.700
46 HB3 GLN 7 HB1 GLN 7 39.768 21.035 18.392
47 HG2 GLN 7 HG2 GLN 7 40.275 20.008 16.530
48 HG3 GLN 7 HG1 GLN 7 38.721 20.207 15.749
49 HE21 GLN 7 1HE2 GLN 7 38.203 22.523 15.024
50 HE22 GLN 7 2HE2 GLN 7 39.591 23.488 14.398
51 H DGN 8 HN DGN 8 36.538 18.361 19.517
52 HA DGN 8 HA DGN 8 37.831 18.660 22.044
53 HB2 DGN 8 HB2 DGN 8 35.294 17.243 21.249
54 HB3 DGN 8 HB1 DGN 8 36.830 16.570 21.174
55 HG2 DGN 8 HG2 DGN 8 37.104 16.747 23.682
56 HG3 DGN 8 HG1 DGN 8 35.418 17.383 23.699
57 HE21 DGN 8 1HE2 DGN 8 35.609 15.577 25.377
58 HE22 DGN 8 2HE2 DGN 8 35.325 13.928 24.852
Start of MODEL 14
1 H1 ASP 1 HN ASP 1 37.467 20.414 23.183
2 HA ASP 1 HA ASP 1 34.819 21.283 24.215
3 HB2 ASP 1 HB2 ASP 1 36.016 22.875 25.498
4 HB3 ASP 1 HB1 ASP 1 36.435 21.346 25.933
5 H ASP 2 HN ASP 2 37.037 22.163 21.767
6 HA ASP 2 HA ASP 2 35.948 25.002 21.340
7 HB2 ASP 2 HB2 ASP 2 38.181 24.914 21.237
8 HB3 ASP 2 HB1 ASP 2 38.150 23.450 20.108
9 HA PRO 3 HA PRO 3 33.021 22.935 18.841
10 HB2 PRO 3 HB2 PRO 3 31.913 25.306 17.582
11 HB3 PRO 3 HB1 PRO 3 31.433 24.370 19.119
12 HG2 PRO 3 HG2 PRO 3 32.692 27.023 19.087
13 HG3 PRO 3 HG1 PRO 3 31.993 25.943 20.420
14 HD2 PRO 3 HD2 PRO 3 34.758 26.293 19.974
15 HD3 PRO 3 HD1 PRO 3 33.848 25.492 21.287
16 H THR 4 HN THR 4 35.580 25.011 17.565
17 HA THR 4 HA THR 4 34.795 25.371 14.967
18 HB THR 4 HB THR 4 37.590 25.161 16.039
19 HG1 THR 4 HG1 THR 4 36.653 26.568 17.292
20 HG21 THR 4 1HG2 THR 4 37.286 25.295 13.465
21 HG22 THR 4 2HG2 THR 4 38.157 26.638 14.248
22 HG23 THR 4 3HG2 THR 4 36.642 26.952 13.755
23 HA DPR 5 HA DPR 5 36.176 21.562 12.869
24 HB2 DPR 5 HB2 DPR 5 34.647 21.852 11.232
25 HB3 DPR 5 HB1 DPR 5 33.606 20.682 12.014
26 HG2 DPR 5 HG2 DPR 5 32.632 23.089 11.817
27 HG3 DPR 5 HG1 DPR 5 32.561 22.166 13.406
28 HD2 DPR 5 HD2 DPR 5 34.455 24.433 12.678
29 HD3 DPR 5 HD1 DPR 5 33.365 24.310 14.042
30 H DAR 6 HN DAR 6 33.966 21.515 15.734
31 HA DAR 6 HA DAR 6 34.019 18.792 16.084
32 HB2 DAR 6 HB2 DAR 6 33.899 21.019 18.060
33 HB3 DAR 6 HB1 DAR 6 32.499 20.527 17.160
34 HG2 DAR 6 HG2 DAR 6 32.504 18.299 18.337
35 HG3 DAR 6 HG1 DAR 6 33.889 18.917 19.214
36 HD2 DAR 6 HD2 DAR 6 31.048 19.993 19.209
37 HD3 DAR 6 HD1 DAR 6 31.638 18.805 20.349
38 HE DAR 6 HE DAR 6 33.362 20.545 20.983
39 HH11 DAR 6 1HH1 DAR 6 33.337 22.738 22.010
40 HH12 DAR 6 2HH1 DAR 6 31.733 23.561 22.000
41 HH21 DAR 6 1HH2 DAR 6 30.001 21.484 20.193
42 HH22 DAR 6 2HH2 DAR 6 30.071 22.837 21.294
43 H GLN 7 HN GLN 7 36.432 21.210 17.088
44 HA GLN 7 HA GLN 7 38.275 19.076 17.935
45 HB2 GLN 7 HB2 GLN 7 38.560 22.150 17.883
46 HB3 GLN 7 HB1 GLN 7 39.760 20.943 18.455
47 HG2 GLN 7 HG2 GLN 7 40.079 19.929 16.313
48 HG3 GLN 7 HG1 GLN 7 38.789 20.834 15.632
49 HE21 GLN 7 1HE2 GLN 7 38.796 23.063 15.450
50 HE22 GLN 7 2HE2 GLN 7 40.338 23.966 15.488
51 H DGN 8 HN DGN 8 36.495 18.348 19.427
52 HA DGN 8 HA DGN 8 37.494 18.484 22.045
53 HB2 DGN 8 HB2 DGN 8 34.753 17.525 21.150
54 HB3 DGN 8 HB1 DGN 8 36.275 16.600 20.977
55 HG2 DGN 8 HG2 DGN 8 36.711 16.761 23.275
56 HG3 DGN 8 HG1 DGN 8 35.251 17.481 23.779
57 HE21 DGN 8 1HE2 DGN 8 33.135 16.129 22.518
58 HE22 DGN 8 2HE2 DGN 8 33.237 14.457 22.896
Start of MODEL 15
1 H1 ASP 1 HN ASP 1 37.424 20.060 23.608
2 HA ASP 1 HA ASP 1 35.018 21.168 24.191
3 HB2 ASP 1 HB2 ASP 1 37.698 22.504 24.514
4 HB3 ASP 1 HB1 ASP 1 36.107 22.827 25.430
5 H ASP 2 HN ASP 2 36.955 22.051 21.576
6 HA ASP 2 HA ASP 2 35.685 24.746 21.329
7 HB2 ASP 2 HB2 ASP 2 38.181 24.673 21.206
8 HB3 ASP 2 HB1 ASP 2 37.919 23.613 19.763
9 HA PRO 3 HA PRO 3 32.603 23.086 18.506
10 HB2 PRO 3 HB2 PRO 3 31.704 25.296 17.518
11 HB3 PRO 3 HB1 PRO 3 31.356 24.596 19.224
12 HG2 PRO 3 HG2 PRO 3 33.441 26.768 18.434
13 HG3 PRO 3 HG1 PRO 3 32.135 26.955 19.648
14 HD2 PRO 3 HD2 PRO 3 34.576 26.156 20.301
15 HD3 PRO 3 HD1 PRO 3 33.161 25.369 21.081
16 H THR 4 HN THR 4 35.362 25.160 17.642
17 HA THR 4 HA THR 4 35.050 25.283 14.846
18 HB THR 4 HB THR 4 37.510 25.001 16.480
19 HG1 THR 4 HG1 THR 4 36.390 26.706 17.242
20 HG21 THR 4 1HG2 THR 4 38.660 26.360 14.730
21 HG22 THR 4 2HG2 THR 4 37.177 26.455 13.782
22 HG23 THR 4 3HG2 THR 4 38.065 24.881 13.995
23 HA DPR 5 HA DPR 5 36.435 21.630 13.243
24 HB2 DPR 5 HB2 DPR 5 35.030 21.867 11.375
25 HB3 DPR 5 HB1 DPR 5 33.995 20.675 12.209
26 HG2 DPR 5 HG2 DPR 5 32.868 23.186 11.651
27 HG3 DPR 5 HG1 DPR 5 32.569 22.445 13.156
28 HD2 DPR 5 HD2 DPR 5 34.744 24.379 12.436
29 HD3 DPR 5 HD1 DPR 5 33.647 24.425 13.871
30 H DAR 6 HN DAR 6 34.134 21.758 15.714
31 HA DAR 6 HA DAR 6 33.861 18.992 16.147
32 HB2 DAR 6 HB2 DAR 6 33.725 21.137 18.284
33 HB3 DAR 6 HB1 DAR 6 32.414 20.766 17.130
34 HG2 DAR 6 HG2 DAR 6 32.438 18.404 18.009
35 HG3 DAR 6 HG1 DAR 6 33.583 18.818 19.163
36 HD2 DAR 6 HD2 DAR 6 30.676 19.852 18.954
37 HD3 DAR 6 HD1 DAR 6 31.346 18.615 19.986
38 HE DAR 6 HE DAR 6 32.639 20.345 21.129
39 HH11 DAR 6 1HH1 DAR 6 32.227 22.357 22.375
40 HH12 DAR 6 2HH1 DAR 6 31.046 23.447 21.823
41 HH21 DAR 6 1HH2 DAR 6 29.912 21.637 19.101
42 HH22 DAR 6 2HH2 DAR 6 29.607 22.918 20.153
43 H GLN 7 HN GLN 7 36.255 21.343 17.333
44 HA GLN 7 HA GLN 7 38.097 19.117 17.760
45 HB2 GLN 7 HB2 GLN 7 38.292 22.031 17.711
46 HB3 GLN 7 HB1 GLN 7 39.637 21.025 18.437
47 HG2 GLN 7 HG2 GLN 7 39.937 20.000 16.325
48 HG3 GLN 7 HG1 GLN 7 38.616 20.871 15.534
49 HE21 GLN 7 1HE2 GLN 7 38.965 23.064 15.113
50 HE22 GLN 7 2HE2 GLN 7 40.504 23.916 15.278
51 H DGN 8 HN DGN 8 36.465 18.216 19.499
52 HA DGN 8 HA DGN 8 37.781 18.602 21.966
53 HB2 DGN 8 HB2 DGN 8 35.683 17.070 22.509
54 HB3 DGN 8 HB1 DGN 8 35.354 17.082 20.815
55 HG2 DGN 8 HG2 DGN 8 36.576 15.108 21.083
56 HG3 DGN 8 HG1 DGN 8 37.670 16.152 20.359
57 HE21 DGN 8 1HE2 DGN 8 36.983 14.528 23.387
58 HE22 DGN 8 2HE2 DGN 8 38.573 15.002 24.104
Start of MODEL 16
1 H1 ASP 1 HN ASP 1 37.476 20.341 22.946
2 HA ASP 1 HA ASP 1 35.065 21.377 24.152
3 HB2 ASP 1 HB2 ASP 1 37.827 22.395 24.835
4 HB3 ASP 1 HB1 ASP 1 36.397 22.445 25.830
5 H ASP 2 HN ASP 2 36.970 22.257 21.423
6 HA ASP 2 HA ASP 2 35.654 24.888 21.561
7 HB2 ASP 2 HB2 ASP 2 38.124 24.731 21.363
8 HB3 ASP 2 HB1 ASP 2 38.075 23.968 19.840
9 HA PRO 3 HA PRO 3 32.815 23.028 18.769
10 HB2 PRO 3 HB2 PRO 3 31.627 25.319 17.687
11 HB3 PRO 3 HB1 PRO 3 31.347 24.699 19.357
12 HG2 PRO 3 HG2 PRO 3 33.356 26.781 18.434
13 HG3 PRO 3 HG1 PRO 3 32.102 26.922 19.724
14 HD2 PRO 3 HD2 PRO 3 34.638 26.327 20.448
15 HD3 PRO 3 HD1 PRO 3 33.248 25.478 21.195
16 H THR 4 HN THR 4 35.076 25.411 17.670
17 HA THR 4 HA THR 4 34.757 25.401 14.935
18 HB THR 4 HB THR 4 37.450 25.021 16.262
19 HG1 THR 4 HG1 THR 4 36.397 26.548 17.259
20 HG21 THR 4 1HG2 THR 4 37.629 24.906 13.811
21 HG22 THR 4 2HG2 THR 4 38.363 26.405 14.353
22 HG23 THR 4 3HG2 THR 4 36.765 26.457 13.739
23 HA DPR 5 HA DPR 5 36.756 21.742 13.343
24 HB2 DPR 5 HB2 DPR 5 35.396 21.968 11.343
25 HB3 DPR 5 HB1 DPR 5 34.650 20.533 12.041
26 HG2 DPR 5 HG2 DPR 5 33.164 22.762 11.616
27 HG3 DPR 5 HG1 DPR 5 32.930 21.862 13.091
28 HD2 DPR 5 HD2 DPR 5 34.450 24.479 12.735
29 HD3 DPR 5 HD1 DPR 5 33.438 24.039 14.037
30 H DAR 6 HN DAR 6 34.278 21.626 15.606
31 HA DAR 6 HA DAR 6 33.849 18.752 15.858
32 HB2 DAR 6 HB2 DAR 6 33.749 20.779 18.066
33 HB3 DAR 6 HB1 DAR 6 32.459 20.608 16.878
34 HG2 DAR 6 HG2 DAR 6 32.074 18.270 17.646
35 HG3 DAR 6 HG1 DAR 6 33.419 18.393 18.848
36 HD2 DAR 6 HD2 DAR 6 30.915 20.086 18.977
37 HD3 DAR 6 HD1 DAR 6 31.242 18.643 19.957
38 HE DAR 6 HE DAR 6 33.295 20.049 20.687
39 HH11 DAR 6 1HH1 DAR 6 33.530 21.641 21.994
40 HH12 DAR 6 2HH1 DAR 6 32.204 22.737 22.421
41 HH21 DAR 6 1HH2 DAR 6 30.046 21.417 19.973
42 HH22 DAR 6 2HH2 DAR 6 30.343 22.707 21.101
43 H GLN 7 HN GLN 7 36.169 20.939 17.047
44 HA GLN 7 HA GLN 7 37.939 18.763 17.821
45 HB2 GLN 7 HB2 GLN 7 38.460 21.803 17.602
46 HB3 GLN 7 HB1 GLN 7 39.607 20.571 18.220
47 HG2 GLN 7 HG2 GLN 7 39.856 19.655 16.147
48 HG3 GLN 7 HG1 GLN 7 38.424 20.395 15.456
49 HE21 GLN 7 1HE2 GLN 7 38.663 23.120 15.735
50 HE22 GLN 7 2HE2 GLN 7 40.172 23.661 15.079
51 H DGN 8 HN DGN 8 36.448 18.134 19.559
52 HA DGN 8 HA DGN 8 37.696 18.747 21.977
53 HB2 DGN 8 HB2 DGN 8 35.968 17.117 22.922
54 HB3 DGN 8 HB1 DGN 8 35.250 16.983 21.275
55 HG2 DGN 8 HG2 DGN 8 38.121 16.632 21.301
56 HG3 DGN 8 HG1 DGN 8 37.210 15.454 22.269
57 HE21 DGN 8 1HE2 DGN 8 38.524 14.190 20.349
58 HE22 DGN 8 2HE2 DGN 8 37.662 14.128 18.802
Start of MODEL 17
1 H1 ASP 1 HN ASP 1 37.472 20.326 23.392
2 HA ASP 1 HA ASP 1 34.930 21.502 24.243
3 HB2 ASP 1 HB2 ASP 1 37.124 21.145 25.671
4 HB3 ASP 1 HB1 ASP 1 37.867 22.278 24.636
5 H ASP 2 HN ASP 2 37.206 22.307 21.760
6 HA ASP 2 HA ASP 2 36.087 24.955 21.417
7 HB2 ASP 2 HB2 ASP 2 38.436 24.903 20.902
8 HB3 ASP 2 HB1 ASP 2 38.154 23.619 19.815
9 HA PRO 3 HA PRO 3 32.825 22.950 19.027
10 HB2 PRO 3 HB2 PRO 3 31.641 25.188 17.926
11 HB3 PRO 3 HB1 PRO 3 31.334 24.641 19.597
12 HG2 PRO 3 HG2 PRO 3 33.533 26.601 18.604
13 HG3 PRO 3 HG1 PRO 3 32.208 26.859 19.867
14 HD2 PRO 3 HD2 PRO 3 34.583 26.192 20.616
15 HD3 PRO 3 HD1 PRO 3 33.200 25.191 21.269
16 H THR 4 HN THR 4 35.247 25.064 17.820
17 HA THR 4 HA THR 4 34.452 25.286 15.085
18 HB THR 4 HB THR 4 37.247 25.504 16.006
19 HG1 THR 4 HG1 THR 4 36.056 27.010 17.270
20 HG21 THR 4 1HG2 THR 4 37.478 27.029 14.358
21 HG22 THR 4 2HG2 THR 4 35.786 26.924 13.839
22 HG23 THR 4 3HG2 THR 4 36.809 25.552 13.532
23 HA DPR 5 HA DPR 5 36.712 21.799 13.087
24 HB2 DPR 5 HB2 DPR 5 35.537 22.167 11.277
25 HB3 DPR 5 HB1 DPR 5 34.671 20.666 11.733
26 HG2 DPR 5 HG2 DPR 5 33.353 22.936 11.328
27 HG3 DPR 5 HG1 DPR 5 32.841 21.726 12.640
28 HD2 DPR 5 HD2 DPR 5 34.491 24.284 12.549
29 HD3 DPR 5 HD1 DPR 5 33.210 23.909 13.752
30 H DAR 6 HN DAR 6 34.225 21.507 15.537
31 HA DAR 6 HA DAR 6 33.870 18.728 15.918
32 HB2 DAR 6 HB2 DAR 6 33.796 21.022 17.843
33 HB3 DAR 6 HB1 DAR 6 32.425 20.502 16.840
34 HG2 DAR 6 HG2 DAR 6 32.691 18.213 17.864
35 HG3 DAR 6 HG1 DAR 6 33.732 18.928 19.065
36 HD2 DAR 6 HD2 DAR 6 30.995 19.985 18.478
37 HD3 DAR 6 HD1 DAR 6 31.350 18.802 19.725
38 HE DAR 6 HE DAR 6 33.113 20.533 20.609
39 HH11 DAR 6 1HH1 DAR 6 33.046 22.377 22.043
40 HH12 DAR 6 2HH1 DAR 6 31.585 23.256 22.032
41 HH21 DAR 6 1HH2 DAR 6 29.783 21.442 19.808
42 HH22 DAR 6 2HH2 DAR 6 29.748 22.749 20.911
43 H GLN 7 HN GLN 7 36.416 21.007 17.262
44 HA GLN 7 HA GLN 7 38.165 18.781 17.312
45 HB2 GLN 7 HB2 GLN 7 38.116 21.675 18.264
46 HB3 GLN 7 HB1 GLN 7 39.563 20.730 18.745
47 HG2 GLN 7 HG2 GLN 7 40.131 20.263 16.502
48 HG3 GLN 7 HG1 GLN 7 38.645 20.988 15.879
49 HE21 GLN 7 1HE2 GLN 7 38.554 23.443 16.015
50 HE22 GLN 7 2HE2 GLN 7 40.011 24.327 16.460
51 H DGN 8 HN DGN 8 35.925 19.707 19.753
52 HA DGN 8 HA DGN 8 37.548 18.828 21.994
53 HB2 DGN 8 HB2 DGN 8 34.830 17.492 21.405
54 HB3 DGN 8 HB1 DGN 8 36.408 16.758 20.972
55 HG2 DGN 8 HG2 DGN 8 37.145 17.096 23.318
56 HG3 DGN 8 HG1 DGN 8 35.542 17.653 23.735
57 HE21 DGN 8 1HE2 DGN 8 36.566 15.374 24.848
58 HE22 DGN 8 2HE2 DGN 8 35.809 13.865 24.197
Start of MODEL 18
1 H1 ASP 1 HN ASP 1 37.475 20.390 22.616
2 HA ASP 1 HA ASP 1 35.244 21.371 24.343
3 HB2 ASP 1 HB2 ASP 1 38.280 22.195 24.239
4 HB3 ASP 1 HB1 ASP 1 37.100 22.914 25.273
5 H ASP 2 HN ASP 2 37.250 22.364 21.579
6 HA ASP 2 HA ASP 2 35.784 24.880 21.456
7 HB2 ASP 2 HB2 ASP 2 38.227 24.834 21.003
8 HB3 ASP 2 HB1 ASP 2 37.967 23.864 19.636
9 HA PRO 3 HA PRO 3 32.668 23.040 18.663
10 HB2 PRO 3 HB2 PRO 3 32.273 25.984 18.231
11 HB3 PRO 3 HB1 PRO 3 31.034 24.729 18.380
12 HG2 PRO 3 HG2 PRO 3 31.618 26.247 20.435
13 HG3 PRO 3 HG1 PRO 3 31.452 24.453 20.805
14 HD2 PRO 3 HD2 PRO 3 33.981 25.965 20.707
15 HD3 PRO 3 HD1 PRO 3 33.558 24.765 21.690
16 H THR 4 HN THR 4 35.382 25.080 17.712
17 HA THR 4 HA THR 4 34.835 25.230 14.897
18 HB THR 4 HB THR 4 37.537 25.205 16.069
19 HG1 THR 4 HG1 THR 4 36.331 26.660 17.077
20 HG21 THR 4 1HG2 THR 4 37.415 25.172 13.559
21 HG22 THR 4 2HG2 THR 4 37.993 26.799 14.159
22 HG23 THR 4 3HG2 THR 4 36.378 26.613 13.554
23 HA DPR 5 HA DPR 5 36.399 21.627 13.034
24 HB2 DPR 5 HB2 DPR 5 35.040 21.879 11.249
25 HB3 DPR 5 HB1 DPR 5 34.019 20.554 12.088
26 HG2 DPR 5 HG2 DPR 5 32.890 23.006 11.554
27 HG3 DPR 5 HG1 DPR 5 32.682 22.230 13.091
28 HD2 DPR 5 HD2 DPR 5 34.749 24.254 12.315
29 HD3 DPR 5 HD1 DPR 5 33.533 24.374 13.645
30 H DAR 6 HN DAR 6 34.165 21.674 15.503
31 HA DAR 6 HA DAR 6 34.146 18.826 15.830
32 HB2 DAR 6 HB2 DAR 6 33.719 21.114 17.911
33 HB3 DAR 6 HB1 DAR 6 32.581 20.618 16.735
34 HG2 DAR 6 HG2 DAR 6 31.967 18.669 17.792
35 HG3 DAR 6 HG1 DAR 6 33.412 18.670 18.870
36 HD2 DAR 6 HD2 DAR 6 31.091 20.675 18.797
37 HD3 DAR 6 HD1 DAR 6 31.116 19.278 19.728
38 HE DAR 6 HE DAR 6 33.469 20.317 20.634
39 HH11 DAR 6 1HH1 DAR 6 33.880 21.934 22.163
40 HH12 DAR 6 2HH1 DAR 6 32.480 22.960 22.567
41 HH21 DAR 6 1HH2 DAR 6 30.118 21.262 20.855
42 HH22 DAR 6 2HH2 DAR 6 30.471 22.408 22.139
43 H GLN 7 HN GLN 7 36.467 21.151 17.069
44 HA GLN 7 HA GLN 7 38.134 19.086 17.831
45 HB2 GLN 7 HB2 GLN 7 38.582 22.047 18.044
46 HB3 GLN 7 HB1 GLN 7 39.741 20.805 18.500
47 HG2 GLN 7 HG2 GLN 7 39.828 19.992 16.276
48 HG3 GLN 7 HG1 GLN 7 38.444 21.021 15.766
49 HE21 GLN 7 1HE2 GLN 7 38.753 23.181 14.975
50 HE22 GLN 7 2HE2 GLN 7 40.364 23.680 14.756
51 H DGN 8 HN DGN 8 36.361 18.277 19.450
52 HA DGN 8 HA DGN 8 37.458 18.314 22.026
53 HB2 DGN 8 HB2 DGN 8 35.237 17.119 22.509
54 HB3 DGN 8 HB1 DGN 8 34.835 17.264 20.858
55 HG2 DGN 8 HG2 DGN 8 36.688 16.001 20.173
56 HG3 DGN 8 HG1 DGN 8 37.468 16.074 21.736
57 HE21 DGN 8 1HE2 DGN 8 35.139 14.334 19.813
58 HE22 DGN 8 2HE2 DGN 8 34.545 13.193 21.048
Start of MODEL 19
1 H1 ASP 1 HN ASP 1 37.512 19.912 23.483
2 HA ASP 1 HA ASP 1 35.552 21.253 24.495
3 HB2 ASP 1 HB2 ASP 1 38.346 22.283 24.493
4 HB3 ASP 1 HB1 ASP 1 37.069 22.758 25.695
5 H ASP 2 HN ASP 2 37.038 22.289 21.640
6 HA ASP 2 HA ASP 2 35.661 24.825 21.561
7 HB2 ASP 2 HB2 ASP 2 38.100 24.608 21.013
8 HB3 ASP 2 HB1 ASP 2 37.524 23.841 19.503
9 HA PRO 3 HA PRO 3 32.814 22.769 18.661
10 HB2 PRO 3 HB2 PRO 3 31.464 24.963 17.623
11 HB3 PRO 3 HB1 PRO 3 31.180 24.162 19.239
12 HG2 PRO 3 HG2 PRO 3 32.686 26.696 18.545
13 HG3 PRO 3 HG1 PRO 3 31.567 26.406 19.839
14 HD2 PRO 3 HD2 PRO 3 34.079 26.336 20.358
15 HD3 PRO 3 HD1 PRO 3 33.059 25.163 21.084
16 H THR 4 HN THR 4 35.220 25.099 17.662
17 HA THR 4 HA THR 4 34.934 25.464 14.861
18 HB THR 4 HB THR 4 37.355 25.105 16.643
19 HG1 THR 4 HG1 THR 4 36.337 26.903 17.300
20 HG21 THR 4 1HG2 THR 4 36.833 26.743 14.106
21 HG22 THR 4 2HG2 THR 4 37.638 25.265 13.968
22 HG23 THR 4 3HG2 THR 4 38.336 26.632 15.042
23 HA DPR 5 HA DPR 5 36.869 21.602 13.387
24 HB2 DPR 5 HB2 DPR 5 35.933 21.441 11.378
25 HB3 DPR 5 HB1 DPR 5 34.745 20.328 12.056
26 HG2 DPR 5 HG2 DPR 5 33.892 22.716 11.031
27 HG3 DPR 5 HG1 DPR 5 33.236 21.948 12.581
28 HD2 DPR 5 HD2 DPR 5 35.243 24.173 12.316
29 HD3 DPR 5 HD1 DPR 5 33.705 24.148 13.220
30 H DAR 6 HN DAR 6 33.987 21.615 15.436
31 HA DAR 6 HA DAR 6 33.792 18.884 15.914
32 HB2 DAR 6 HB2 DAR 6 33.645 21.000 18.044
33 HB3 DAR 6 HB1 DAR 6 32.376 20.526 16.801
34 HG2 DAR 6 HG2 DAR 6 32.025 18.485 17.694
35 HG3 DAR 6 HG1 DAR 6 33.472 18.563 18.775
36 HD2 DAR 6 HD2 DAR 6 30.801 19.889 19.248
37 HD3 DAR 6 HD1 DAR 6 31.378 18.504 20.029
38 HE DAR 6 HE DAR 6 33.262 19.832 20.993
39 HH11 DAR 6 1HH1 DAR 6 33.649 21.581 22.276
40 HH12 DAR 6 2HH1 DAR 6 32.488 22.877 22.450
41 HH21 DAR 6 1HH2 DAR 6 30.497 21.606 19.769
42 HH22 DAR 6 2HH2 DAR 6 30.560 22.758 21.086
43 H GLN 7 HN GLN 7 36.071 21.138 17.434
44 HA GLN 7 HA GLN 7 38.210 19.182 17.316
45 HB2 GLN 7 HB2 GLN 7 38.329 21.827 17.260
46 HB3 GLN 7 HB1 GLN 7 38.279 21.702 19.026
47 HG2 GLN 7 HG2 GLN 7 40.157 20.216 19.143
48 HG3 GLN 7 HG1 GLN 7 40.281 20.404 17.378
49 HE21 GLN 7 1HE2 GLN 7 42.498 21.324 17.846
50 HE22 GLN 7 2HE2 GLN 7 42.634 23.029 18.276
51 H DGN 8 HN DGN 8 35.908 20.100 19.816
52 HA DGN 8 HA DGN 8 37.307 18.361 21.854
53 HB2 DGN 8 HB2 DGN 8 34.280 18.200 21.231
54 HB3 DGN 8 HB1 DGN 8 35.516 17.255 20.280
55 HG2 DGN 8 HG2 DGN 8 36.272 16.329 22.282
56 HG3 DGN 8 HG1 DGN 8 35.343 17.531 23.258
57 HE21 DGN 8 1HE2 DGN 8 35.296 14.507 23.474
58 HE22 DGN 8 2HE2 DGN 8 33.617 13.995 23.138
Start of MODEL 20
1 H1 ASP 1 HN ASP 1 37.626 20.406 23.133
2 HA ASP 1 HA ASP 1 34.928 20.832 24.095
3 HB2 ASP 1 HB2 ASP 1 37.660 21.830 24.812
4 HB3 ASP 1 HB1 ASP 1 36.260 22.751 25.353
5 H ASP 2 HN ASP 2 36.996 22.236 21.653
6 HA ASP 2 HA ASP 2 35.628 24.812 21.697
7 HB2 ASP 2 HB2 ASP 2 38.093 23.802 20.626
8 HB3 ASP 2 HB1 ASP 2 37.165 24.565 19.333
9 HA PRO 3 HA PRO 3 32.586 23.452 18.601
10 HB2 PRO 3 HB2 PRO 3 32.133 25.719 17.125
11 HB3 PRO 3 HB1 PRO 3 31.432 25.452 18.732
12 HG2 PRO 3 HG2 PRO 3 33.754 27.116 17.930
13 HG3 PRO 3 HG1 PRO 3 32.521 27.406 19.167
14 HD2 PRO 3 HD2 PRO 3 35.055 26.522 19.778
15 HD3 PRO 3 HD1 PRO 3 33.621 26.162 20.768
16 H THR 4 HN THR 4 35.187 25.496 17.454
17 HA THR 4 HA THR 4 35.498 25.361 14.881
18 HB THR 4 HB THR 4 37.846 24.501 16.539
19 HG1 THR 4 HG1 THR 4 37.955 26.636 17.208
20 HG21 THR 4 1HG2 THR 4 37.693 26.705 14.490
21 HG22 THR 4 2HG2 THR 4 37.930 25.037 13.970
22 HG23 THR 4 3HG2 THR 4 39.105 25.804 15.033
23 HA DPR 5 HA DPR 5 36.237 21.321 12.967
24 HB2 DPR 5 HB2 DPR 5 34.555 21.406 11.432
25 HB3 DPR 5 HB1 DPR 5 33.603 20.435 12.570
26 HG2 DPR 5 HG2 DPR 5 32.824 22.862 11.770
27 HG3 DPR 5 HG1 DPR 5 32.488 22.249 13.403
28 HD2 DPR 5 HD2 DPR 5 34.586 24.221 12.525
29 HD3 DPR 5 HD1 DPR 5 33.554 24.195 13.978
30 H DAR 6 HN DAR 6 33.925 21.533 15.581
31 HA DAR 6 HA DAR 6 33.877 18.785 16.167
32 HB2 DAR 6 HB2 DAR 6 33.411 20.866 18.261
33 HB3 DAR 6 HB1 DAR 6 32.279 20.723 16.931
34 HG2 DAR 6 HG2 DAR 6 31.648 18.493 17.545
35 HG3 DAR 6 HG1 DAR 6 33.057 18.286 18.579
36 HD2 DAR 6 HD2 DAR 6 30.810 20.251 19.209
37 HD3 DAR 6 HD1 DAR 6 30.861 18.600 19.807
38 HE DAR 6 HE DAR 6 33.305 19.685 20.532
39 HH11 DAR 6 1HH1 DAR 6 33.635 20.648 22.547
40 HH12 DAR 6 2HH1 DAR 6 32.288 21.244 23.458
41 HH21 DAR 6 1HH2 DAR 6 29.933 20.335 21.092
42 HH22 DAR 6 2HH2 DAR 6 30.202 21.068 22.638
43 H GLN 7 HN GLN 7 36.177 21.316 16.858
44 HA GLN 7 HA GLN 7 38.038 19.336 17.776
45 HB2 GLN 7 HB2 GLN 7 38.213 22.353 17.837
46 HB3 GLN 7 HB1 GLN 7 39.427 21.374 18.630
47 HG2 GLN 7 HG2 GLN 7 40.162 20.411 16.637
48 HG3 GLN 7 HG1 GLN 7 38.696 20.802 15.768
49 HE21 GLN 7 1HE2 GLN 7 41.495 22.413 17.348
50 HE22 GLN 7 2HE2 GLN 7 41.516 23.737 16.288
51 H DGN 8 HN DGN 8 37.330 18.202 19.411
52 HA DGN 8 HA DGN 8 38.097 18.781 21.931
53 HB2 DGN 8 HB2 DGN 8 36.071 17.073 22.510
54 HB3 DGN 8 HB1 DGN 8 36.184 16.819 20.776
55 HG2 DGN 8 HG2 DGN 8 38.695 16.417 21.122
56 HG3 DGN 8 HG1 DGN 8 38.353 16.389 22.858
57 HE21 DGN 8 1HE2 DGN 8 37.648 14.721 19.780
58 HE22 DGN 8 2HE2 DGN 8 37.139 13.268 20.507