Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
625451 | 6azf RC | 30343 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -1.432 -1.673 1.104
2 HA2 GLY 1 1HA GLY 1 -0.106 -2.927 -0.393
3 HA3 GLY 1 2HA GLY 1 -0.715 -1.931 -1.748
4 H SER 2 H SER 2 0.036 0.683 -0.750
5 HA SER 2 HA SER 2 2.911 0.595 -1.290
6 HB2 SER 2 1HB SER 2 2.856 2.944 -1.168
7 HB3 SER 2 2HB SER 2 1.285 2.561 -1.871
8 HG SER 2 HG SER 2 0.311 2.856 0.088
9 HA PRO 3 HA PRO 3 4.170 0.086 2.765
10 HB2 PRO 3 1HB PRO 3 6.142 1.753 3.443
11 HB3 PRO 3 2HB PRO 3 6.376 0.570 2.140
12 HG2 PRO 3 1HG PRO 3 5.673 3.435 1.742
13 HG3 PRO 3 2HG PRO 3 6.970 2.449 0.969
14 HD2 PRO 3 1HD PRO 3 4.595 2.844 -0.216
15 HD3 PRO 3 2HD PRO 3 5.478 1.280 -0.300
16 H LEU 4 H LEU 4 2.789 3.146 2.069
17 HA LEU 4 HA LEU 4 2.486 3.759 4.936
18 HB2 LEU 4 1HB LEU 4 1.830 5.411 2.455
19 HB3 LEU 4 2HB LEU 4 1.678 5.947 4.121
20 HG LEU 4 HG LEU 4 4.300 5.257 2.756
21 HD11 LEU 4 1HD1 LEU 4 3.194 7.989 3.546
22 HD12 LEU 4 2HD1 LEU 4 3.112 7.338 1.892
23 HD13 LEU 4 3HD1 LEU 4 4.685 7.635 2.631
24 HD21 LEU 4 1HD2 LEU 4 5.298 6.415 4.743
25 HD22 LEU 4 2HD2 LEU 4 4.557 4.864 5.068
26 HD23 LEU 4 3HD2 LEU 4 3.688 6.358 5.511
27 H PHE 5 H PHE 5 0.577 3.075 1.969
28 HA PHE 5 HA PHE 5 -1.713 2.398 3.647
29 HB2 PHE 5 1HB PHE 5 -1.959 4.817 3.627
30 HB3 PHE 5 2HB PHE 5 -1.697 4.884 1.876
31 HD1 PHE 5 HD1 PHE 5 -3.553 4.617 0.438
32 HD2 PHE 5 HD2 PHE 5 -4.043 3.790 4.581
33 HE1 PHE 5 HE1 PHE 5 -5.958 4.275 0.067
34 HE2 PHE 5 HE2 PHE 5 -6.505 3.553 4.298
35 HZ PHE 5 HZ PHE 5 -7.478 3.789 2.024
36 H ASP 6 H ASP 6 -2.961 0.906 2.719
37 HA ASP 6 HA ASP 6 -3.519 -0.700 1.235
38 HB2 ASP 6 1HB ASP 6 -3.986 1.943 -0.047
39 HB3 ASP 6 2HB ASP 6 -4.357 0.473 -0.981
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -1.157 -0.709 1.309
2 HA2 GLY 1 1HA GLY 1 -0.079 -1.488 -1.183
3 HA3 GLY 1 2HA GLY 1 0.349 0.222 -0.872
4 H SER 2 H SER 2 2.602 -1.110 -0.811
5 HA SER 2 HA SER 2 2.989 -2.302 1.896
6 HB2 SER 2 1HB SER 2 4.051 -3.380 0.025
7 HB3 SER 2 2HB SER 2 4.991 -1.908 -0.348
8 HG SER 2 HG SER 2 6.082 -3.540 0.913
9 HA PRO 3 HA PRO 3 5.736 1.260 2.679
10 HB2 PRO 3 1HB PRO 3 6.338 3.295 1.055
11 HB3 PRO 3 2HB PRO 3 7.136 1.677 0.861
12 HG2 PRO 3 1HG PRO 3 4.850 2.884 -0.627
13 HG3 PRO 3 2HG PRO 3 6.319 2.077 -1.268
14 HD2 PRO 3 1HD PRO 3 3.891 0.754 -0.901
15 HD3 PRO 3 2HD PRO 3 5.500 -0.057 -0.765
16 H LEU 4 H LEU 4 2.594 1.640 1.599
17 HA LEU 4 HA LEU 4 2.112 3.849 3.366
18 HB2 LEU 4 1HB LEU 4 1.131 5.305 1.802
19 HB3 LEU 4 2HB LEU 4 2.704 4.947 1.132
20 HG LEU 4 HG LEU 4 0.047 3.803 0.228
21 HD11 LEU 4 1HD1 LEU 4 0.099 6.209 -0.072
22 HD12 LEU 4 2HD1 LEU 4 0.313 5.452 -1.670
23 HD13 LEU 4 3HD1 LEU 4 1.715 6.141 -0.803
24 HD21 LEU 4 1HD2 LEU 4 1.067 3.100 -1.786
25 HD22 LEU 4 2HD2 LEU 4 1.942 2.382 -0.443
26 HD23 LEU 4 3HD2 LEU 4 2.627 3.775 -1.312
27 H PHE 5 H PHE 5 -0.408 4.119 3.417
28 HA PHE 5 HA PHE 5 -1.693 1.680 3.906
29 HB2 PHE 5 1HB PHE 5 -2.383 3.947 4.753
30 HB3 PHE 5 2HB PHE 5 -2.816 4.385 3.080
31 HD1 PHE 5 HD1 PHE 5 -3.712 2.179 5.998
32 HD2 PHE 5 HD2 PHE 5 -4.987 3.726 2.131
33 HE1 PHE 5 HE1 PHE 5 -5.970 1.281 6.396
34 HE2 PHE 5 HE2 PHE 5 -7.288 2.839 2.541
35 HZ PHE 5 HZ PHE 5 -7.807 1.617 4.646
36 H ASP 6 H ASP 6 -3.068 0.403 2.683
37 HA ASP 6 HA ASP 6 -3.905 -0.695 0.867
38 HB2 ASP 6 1HB ASP 6 -5.304 1.415 0.708
39 HB3 ASP 6 2HB ASP 6 -4.125 2.016 -0.471
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -1.138 -0.271 1.156
2 HA2 GLY 1 1HA GLY 1 -0.356 -2.011 -0.993
3 HA3 GLY 1 2HA GLY 1 0.227 -0.343 -1.342
4 H SER 2 H SER 2 2.305 -1.944 -0.853
5 HA SER 2 HA SER 2 2.818 -2.418 1.956
6 HB2 SER 2 1HB SER 2 4.796 -2.151 -0.340
7 HB3 SER 2 2HB SER 2 5.185 -2.733 1.290
8 HG SER 2 HG SER 2 3.374 -4.312 0.830
9 HA PRO 3 HA PRO 3 5.044 1.677 2.325
10 HB2 PRO 3 1HB PRO 3 4.916 3.635 0.473
11 HB3 PRO 3 2HB PRO 3 6.122 2.361 0.320
12 HG2 PRO 3 1HG PRO 3 3.501 2.640 -1.045
13 HG3 PRO 3 2HG PRO 3 5.085 2.234 -1.709
14 HD2 PRO 3 1HD PRO 3 3.162 0.359 -1.109
15 HD3 PRO 3 2HD PRO 3 4.947 0.023 -0.997
16 H LEU 4 H LEU 4 4.012 3.576 3.350
17 HA LEU 4 HA LEU 4 2.163 4.756 4.220
18 HB2 LEU 4 1HB LEU 4 1.246 4.600 1.353
19 HB3 LEU 4 2HB LEU 4 0.387 5.494 2.587
20 HG LEU 4 HG LEU 4 1.563 7.037 1.227
21 HD11 LEU 4 1HD1 LEU 4 1.550 7.522 3.692
22 HD12 LEU 4 2HD1 LEU 4 2.974 8.215 2.874
23 HD13 LEU 4 3HD1 LEU 4 3.118 6.724 3.845
24 HD21 LEU 4 1HD2 LEU 4 3.291 5.329 0.435
25 HD22 LEU 4 2HD2 LEU 4 4.210 5.785 1.913
26 HD23 LEU 4 3HD2 LEU 4 3.845 7.006 0.690
27 H PHE 5 H PHE 5 -0.392 3.711 2.184
28 HA PHE 5 HA PHE 5 -0.904 1.186 3.606
29 HB2 PHE 5 1HB PHE 5 -3.077 1.930 4.390
30 HB3 PHE 5 2HB PHE 5 -1.832 2.974 5.093
31 HD1 PHE 5 HD1 PHE 5 -4.811 2.776 3.047
32 HD2 PHE 5 HD2 PHE 5 -1.491 5.357 4.087
33 HE1 PHE 5 HE1 PHE 5 -6.116 4.772 2.267
34 HE2 PHE 5 HE2 PHE 5 -2.782 7.327 3.317
35 HZ PHE 5 HZ PHE 5 -5.123 7.062 2.429
36 H ASP 6 H ASP 6 -3.093 0.423 2.593
37 HA ASP 6 HA ASP 6 -4.124 -0.356 0.736
38 HB2 ASP 6 1HB ASP 6 -4.908 2.006 0.596
39 HB3 ASP 6 2HB ASP 6 -3.583 2.343 -0.547
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -0.866 -0.413 1.351
2 HA2 GLY 1 1HA GLY 1 -0.591 -2.772 0.169
3 HA3 GLY 1 2HA GLY 1 -0.245 -1.754 -1.227
4 H SER 2 H SER 2 1.765 -1.215 -1.585
5 HA SER 2 HA SER 2 3.862 -1.990 0.206
6 HB2 SER 2 1HB SER 2 4.112 -1.979 -2.273
7 HB3 SER 2 2HB SER 2 4.105 -0.221 -2.253
8 HG SER 2 HG SER 2 5.886 -0.530 -0.597
9 HA PRO 3 HA PRO 3 4.333 2.633 1.099
10 HB2 PRO 3 1HB PRO 3 1.533 3.640 0.638
11 HB3 PRO 3 2HB PRO 3 3.135 4.421 0.297
12 HG2 PRO 3 1HG PRO 3 1.659 3.523 -1.701
13 HG3 PRO 3 2HG PRO 3 3.441 3.265 -1.694
14 HD2 PRO 3 1HD PRO 3 1.243 1.336 -0.788
15 HD3 PRO 3 2HD PRO 3 2.538 1.016 -1.962
16 H LEU 4 H LEU 4 3.076 4.085 2.887
17 HA LEU 4 HA LEU 4 2.526 2.348 5.061
18 HB2 LEU 4 1HB LEU 4 1.906 5.274 4.445
19 HB3 LEU 4 2HB LEU 4 1.545 4.566 6.024
20 HG LEU 4 HG LEU 4 4.340 4.588 4.849
21 HD11 LEU 4 1HD1 LEU 4 2.952 6.556 6.689
22 HD12 LEU 4 2HD1 LEU 4 3.553 6.863 5.032
23 HD13 LEU 4 3HD1 LEU 4 4.697 6.541 6.347
24 HD21 LEU 4 1HD2 LEU 4 4.132 2.959 6.581
25 HD22 LEU 4 2HD2 LEU 4 3.351 4.141 7.667
26 HD23 LEU 4 3HD2 LEU 4 5.047 4.336 7.134
27 H PHE 5 H PHE 5 0.398 3.480 2.467
28 HA PHE 5 HA PHE 5 -1.867 2.119 3.820
29 HB2 PHE 5 1HB PHE 5 -2.064 4.702 2.167
30 HB3 PHE 5 2HB PHE 5 -3.391 3.823 2.913
31 HD1 PHE 5 HD1 PHE 5 -3.487 3.652 5.476
32 HD2 PHE 5 HD2 PHE 5 -0.769 6.302 3.387
33 HE1 PHE 5 HE1 PHE 5 -3.132 4.979 7.539
34 HE2 PHE 5 HE2 PHE 5 -0.468 7.646 5.401
35 HZ PHE 5 HZ PHE 5 -1.637 7.022 7.522
36 H ASP 6 H ASP 6 -3.340 1.243 2.253
37 HA ASP 6 HA ASP 6 -3.955 0.117 0.441
38 HB2 ASP 6 1HB ASP 6 -3.965 2.521 -0.323
39 HB3 ASP 6 2HB ASP 6 -2.502 2.124 -1.216
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -0.814 -1.607 0.667
2 HA2 GLY 1 1HA GLY 1 -0.464 -2.364 -1.714
3 HA3 GLY 1 2HA GLY 1 -1.129 -0.797 -2.242
4 H SER 2 H SER 2 0.619 -0.088 0.472
5 HA SER 2 HA SER 2 3.368 -0.090 -0.664
6 HB2 SER 2 1HB SER 2 3.546 2.258 -0.916
7 HB3 SER 2 2HB SER 2 1.969 1.980 -1.653
8 HG SER 2 HG SER 2 1.078 3.150 -0.211
9 HA PRO 3 HA PRO 3 3.975 0.093 3.701
10 HB2 PRO 3 1HB PRO 3 6.055 1.791 4.203
11 HB3 PRO 3 2HB PRO 3 6.218 0.225 3.321
12 HG2 PRO 3 1HG PRO 3 5.934 3.021 2.157
13 HG3 PRO 3 2HG PRO 3 7.221 1.742 1.893
14 HD2 PRO 3 1HD PRO 3 5.104 2.116 0.294
15 HD3 PRO 3 2HD PRO 3 5.788 0.470 0.592
16 H LEU 4 H LEU 4 2.718 2.790 2.041
17 HA LEU 4 HA LEU 4 2.380 4.356 4.592
18 HB2 LEU 4 1HB LEU 4 2.308 5.315 1.703
19 HB3 LEU 4 2HB LEU 4 2.063 6.327 3.135
20 HG LEU 4 HG LEU 4 4.603 4.764 2.629
21 HD11 LEU 4 1HD1 LEU 4 3.903 7.671 2.105
22 HD12 LEU 4 2HD1 LEU 4 4.244 6.423 0.911
23 HD13 LEU 4 3HD1 LEU 4 5.524 6.972 2.026
24 HD21 LEU 4 1HD2 LEU 4 5.509 6.424 4.307
25 HD22 LEU 4 2HD2 LEU 4 4.363 5.235 4.988
26 HD23 LEU 4 3HD2 LEU 4 3.837 6.906 4.654
27 H PHE 5 H PHE 5 0.732 2.536 2.104
28 HA PHE 5 HA PHE 5 -1.830 3.105 3.436
29 HB2 PHE 5 1HB PHE 5 -2.992 3.741 1.315
30 HB3 PHE 5 2HB PHE 5 -1.923 4.995 1.914
31 HD1 PHE 5 HD1 PHE 5 -0.245 5.918 0.668
32 HD2 PHE 5 HD2 PHE 5 -2.082 2.250 -0.655
33 HE1 PHE 5 HE1 PHE 5 0.971 6.110 -1.516
34 HE2 PHE 5 HE2 PHE 5 -0.811 2.349 -2.791
35 HZ PHE 5 HZ PHE 5 0.697 4.263 -3.222
36 H ASP 6 H ASP 6 -3.530 1.572 2.056
37 HA ASP 6 HA ASP 6 -2.437 -1.072 2.016
38 HB2 ASP 6 1HB ASP 6 -4.953 0.151 0.867
39 HB3 ASP 6 2HB ASP 6 -4.563 -1.548 0.604
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -1.050 -1.882 0.684
2 HA2 GLY 1 1HA GLY 1 -0.286 -2.683 -1.385
3 HA3 GLY 1 2HA GLY 1 -1.129 -1.406 -2.259
4 H SER 2 H SER 2 0.612 -0.170 0.454
5 HA SER 2 HA SER 2 3.172 0.099 -0.906
6 HB2 SER 2 1HB SER 2 3.118 2.540 -0.960
7 HB3 SER 2 2HB SER 2 1.684 1.947 -1.853
8 HG SER 2 HG SER 2 0.387 2.728 -0.431
9 HA PRO 3 HA PRO 3 4.151 0.101 3.341
10 HB2 PRO 3 1HB PRO 3 5.976 1.978 4.017
11 HB3 PRO 3 2HB PRO 3 6.383 0.581 3.000
12 HG2 PRO 3 1HG PRO 3 5.627 3.375 2.185
13 HG3 PRO 3 2HG PRO 3 7.040 2.376 1.666
14 HD2 PRO 3 1HD PRO 3 4.865 2.651 0.185
15 HD3 PRO 3 2HD PRO 3 5.726 1.073 0.233
16 H LEU 4 H LEU 4 2.971 3.130 2.077
17 HA LEU 4 HA LEU 4 2.374 4.125 4.793
18 HB2 LEU 4 1HB LEU 4 2.210 5.419 2.036
19 HB3 LEU 4 2HB LEU 4 1.629 6.249 3.468
20 HG LEU 4 HG LEU 4 4.482 5.386 2.913
21 HD11 LEU 4 1HD1 LEU 4 4.987 7.797 2.766
22 HD12 LEU 4 2HD1 LEU 4 3.256 8.210 3.044
23 HD13 LEU 4 3HD1 LEU 4 3.771 7.332 1.566
24 HD21 LEU 4 1HD2 LEU 4 3.665 7.167 5.192
25 HD22 LEU 4 2HD2 LEU 4 5.144 6.284 4.935
26 HD23 LEU 4 3HD2 LEU 4 3.735 5.424 5.409
27 H PHE 5 H PHE 5 0.671 2.781 1.983
28 HA PHE 5 HA PHE 5 -1.927 3.189 3.449
29 HB2 PHE 5 1HB PHE 5 -1.482 5.068 1.698
30 HB3 PHE 5 2HB PHE 5 -1.580 3.786 0.493
31 HD1 PHE 5 HD1 PHE 5 -3.574 2.977 -0.333
32 HD2 PHE 5 HD2 PHE 5 -3.528 5.603 3.036
33 HE1 PHE 5 HE1 PHE 5 -6.118 3.283 -0.528
34 HE2 PHE 5 HE2 PHE 5 -6.062 5.866 2.868
35 HZ PHE 5 HZ PHE 5 -7.309 4.732 1.070
36 H ASP 6 H ASP 6 -3.544 1.675 2.056
37 HA ASP 6 HA ASP 6 -2.482 -0.993 1.935
38 HB2 ASP 6 1HB ASP 6 -4.954 0.435 1.030
39 HB3 ASP 6 2HB ASP 6 -4.568 -1.002 0.118
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -0.953 -0.258 1.379
2 HA2 GLY 1 1HA GLY 1 -0.254 -1.913 -0.817
3 HA3 GLY 1 2HA GLY 1 0.548 -0.345 -1.033
4 H SER 2 H SER 2 2.629 -1.384 -0.693
5 HA SER 2 HA SER 2 3.034 -2.262 2.147
6 HB2 SER 2 1HB SER 2 5.386 -1.833 0.432
7 HB3 SER 2 2HB SER 2 5.004 -3.227 1.440
8 HG SER 2 HG SER 2 3.622 -3.963 -0.131
9 HA PRO 3 HA PRO 3 5.528 1.686 2.270
10 HB2 PRO 3 1HB PRO 3 4.764 3.316 -0.203
11 HB3 PRO 3 2HB PRO 3 6.383 3.050 0.530
12 HG2 PRO 3 1HG PRO 3 5.787 1.850 -1.757
13 HG3 PRO 3 2HG PRO 3 6.603 0.930 -0.412
14 HD2 PRO 3 1HD PRO 3 3.633 1.037 -1.089
15 HD3 PRO 3 2HD PRO 3 4.760 -0.370 -1.006
16 H LEU 4 H LEU 4 2.320 1.508 1.009
17 HA LEU 4 HA LEU 4 1.510 4.047 2.396
18 HB2 LEU 4 1HB LEU 4 0.237 2.566 0.022
19 HB3 LEU 4 2HB LEU 4 -0.343 4.086 0.754
20 HG LEU 4 HG LEU 4 2.268 3.741 -0.710
21 HD11 LEU 4 1HD1 LEU 4 -0.326 5.184 -1.566
22 HD12 LEU 4 2HD1 LEU 4 0.107 3.514 -2.068
23 HD13 LEU 4 3HD1 LEU 4 1.145 4.879 -2.549
24 HD21 LEU 4 1HD2 LEU 4 2.484 5.569 0.939
25 HD22 LEU 4 2HD2 LEU 4 0.932 6.276 0.393
26 HD23 LEU 4 3HD2 LEU 4 2.341 6.246 -0.698
27 H PHE 5 H PHE 5 -0.911 3.843 3.032
28 HA PHE 5 HA PHE 5 -1.271 1.412 4.584
29 HB2 PHE 5 1HB PHE 5 -3.380 2.372 5.252
30 HB3 PHE 5 2HB PHE 5 -2.161 3.642 5.307
31 HD1 PHE 5 HD1 PHE 5 -5.165 2.447 3.614
32 HD2 PHE 5 HD2 PHE 5 -2.198 5.507 3.671
33 HE1 PHE 5 HE1 PHE 5 -6.616 3.882 2.182
34 HE2 PHE 5 HE2 PHE 5 -3.628 6.933 2.235
35 HZ PHE 5 HZ PHE 5 -5.830 6.112 1.482
36 H ASP 6 H ASP 6 -1.883 2.402 1.304
37 HA ASP 6 HA ASP 6 -3.778 0.096 0.886
38 HB2 ASP 6 1HB ASP 6 -4.515 2.467 0.189
39 HB3 ASP 6 2HB ASP 6 -3.133 2.491 -0.943
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -1.244 -2.098 0.594
2 HA2 GLY 1 1HA GLY 1 -0.384 -2.796 -1.495
3 HA3 GLY 1 2HA GLY 1 -1.167 -1.411 -2.264
4 H SER 2 H SER 2 0.412 -0.272 0.397
5 HA SER 2 HA SER 2 3.034 0.125 -0.972
6 HB2 SER 2 1HB SER 2 1.163 2.390 -0.052
7 HB3 SER 2 2HB SER 2 2.812 2.573 -0.669
8 HG SER 2 HG SER 2 0.625 1.501 -2.129
9 HA PRO 3 HA PRO 3 4.110 0.125 3.248
10 HB2 PRO 3 1HB PRO 3 5.925 2.109 3.795
11 HB3 PRO 3 2HB PRO 3 6.341 0.680 2.808
12 HG2 PRO 3 1HG PRO 3 5.476 3.393 1.864
13 HG3 PRO 3 2HG PRO 3 6.905 2.419 1.365
14 HD2 PRO 3 1HD PRO 3 4.658 2.426 -0.111
15 HD3 PRO 3 2HD PRO 3 5.580 0.909 0.162
16 H LEU 4 H LEU 4 2.929 3.278 2.131
17 HA LEU 4 HA LEU 4 2.403 4.124 4.914
18 HB2 LEU 4 1HB LEU 4 2.390 5.413 2.202
19 HB3 LEU 4 2HB LEU 4 1.330 6.092 3.433
20 HG LEU 4 HG LEU 4 3.237 6.548 4.887
21 HD11 LEU 4 1HD1 LEU 4 5.584 6.481 4.002
22 HD12 LEU 4 2HD1 LEU 4 5.040 5.544 2.599
23 HD13 LEU 4 3HD1 LEU 4 4.909 4.855 4.234
24 HD21 LEU 4 1HD2 LEU 4 2.317 8.132 3.285
25 HD22 LEU 4 2HD2 LEU 4 3.565 7.638 2.121
26 HD23 LEU 4 3HD2 LEU 4 4.043 8.384 3.656
27 H PHE 5 H PHE 5 0.644 3.014 2.002
28 HA PHE 5 HA PHE 5 -1.948 3.095 3.470
29 HB2 PHE 5 1HB PHE 5 -1.499 4.073 0.608
30 HB3 PHE 5 2HB PHE 5 -3.065 3.753 1.318
31 HD1 PHE 5 HD1 PHE 5 -3.855 5.134 3.291
32 HD2 PHE 5 HD2 PHE 5 -0.361 6.201 0.982
33 HE1 PHE 5 HE1 PHE 5 -3.918 7.455 4.196
34 HE2 PHE 5 HE2 PHE 5 -0.455 8.453 1.862
35 HZ PHE 5 HZ PHE 5 -2.242 9.135 3.460
36 H ASP 6 H ASP 6 -3.438 1.628 2.068
37 HA ASP 6 HA ASP 6 -2.262 -0.909 2.013
38 HB2 ASP 6 1HB ASP 6 -4.370 -1.695 0.997
39 HB3 ASP 6 2HB ASP 6 -4.715 -0.467 2.234
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -1.475 -1.165 1.366
2 HA2 GLY 1 1HA GLY 1 -0.132 -2.763 0.242
3 HA3 GLY 1 2HA GLY 1 -0.675 -2.161 -1.322
4 H SER 2 H SER 2 0.041 0.634 -0.399
5 HA SER 2 HA SER 2 2.819 0.562 -1.311
6 HB2 SER 2 1HB SER 2 1.006 2.813 -0.256
7 HB3 SER 2 2HB SER 2 2.568 3.021 -1.094
8 HG SER 2 HG SER 2 0.130 2.737 -2.118
9 HA PRO 3 HA PRO 3 4.739 0.414 2.708
10 HB2 PRO 3 1HB PRO 3 5.854 3.181 2.342
11 HB3 PRO 3 2HB PRO 3 6.767 1.665 2.752
12 HG2 PRO 3 1HG PRO 3 6.982 2.604 0.329
13 HG3 PRO 3 2HG PRO 3 6.679 0.841 0.544
14 HD2 PRO 3 1HD PRO 3 4.721 3.044 -0.167
15 HD3 PRO 3 2HD PRO 3 4.955 1.385 -0.900
16 H LEU 4 H LEU 4 2.892 3.306 1.969
17 HA LEU 4 HA LEU 4 2.619 3.887 4.888
18 HB2 LEU 4 1HB LEU 4 2.937 5.831 3.409
19 HB3 LEU 4 2HB LEU 4 1.495 5.357 2.481
20 HG LEU 4 HG LEU 4 0.078 5.743 4.422
21 HD11 LEU 4 1HD1 LEU 4 1.170 6.901 6.459
22 HD12 LEU 4 2HD1 LEU 4 2.698 6.218 5.829
23 HD13 LEU 4 3HD1 LEU 4 1.362 5.135 6.291
24 HD21 LEU 4 1HD2 LEU 4 0.385 8.210 4.663
25 HD22 LEU 4 2HD2 LEU 4 0.502 7.688 2.970
26 HD23 LEU 4 3HD2 LEU 4 1.982 8.073 3.908
27 H PHE 5 H PHE 5 0.385 3.365 2.057
28 HA PHE 5 HA PHE 5 -1.348 1.731 3.679
29 HB2 PHE 5 1HB PHE 5 -3.285 3.120 3.564
30 HB3 PHE 5 2HB PHE 5 -2.006 4.129 4.200
31 HD1 PHE 5 HD1 PHE 5 -4.648 3.903 1.797
32 HD2 PHE 5 HD2 PHE 5 -0.714 5.540 2.276
33 HE1 PHE 5 HE1 PHE 5 -5.150 5.596 0.018
34 HE2 PHE 5 HE2 PHE 5 -1.166 7.132 0.438
35 HZ PHE 5 HZ PHE 5 -3.377 7.176 -0.687
36 H ASP 6 H ASP 6 -3.243 0.897 2.466
37 HA ASP 6 HA ASP 6 -4.016 -0.307 0.703
38 HB2 ASP 6 1HB ASP 6 -3.277 2.318 -0.696
39 HB3 ASP 6 2HB ASP 6 -4.135 1.005 -1.513
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -1.171 -1.597 1.061
2 HA2 GLY 1 1HA GLY 1 -0.100 -2.899 -0.534
3 HA3 GLY 1 2HA GLY 1 -0.873 -1.954 -1.818
4 H SER 2 H SER 2 0.099 0.563 -0.260
5 HA SER 2 HA SER 2 2.911 0.474 -1.272
6 HB2 SER 2 1HB SER 2 1.236 2.296 -1.931
7 HB3 SER 2 2HB SER 2 1.250 2.889 -0.267
8 HG SER 2 HG SER 2 2.954 3.538 -2.166
9 HA PRO 3 HA PRO 3 4.132 0.037 2.965
10 HB2 PRO 3 1HB PRO 3 5.758 2.562 2.794
11 HB3 PRO 3 2HB PRO 3 6.290 0.966 3.333
12 HG2 PRO 3 1HG PRO 3 7.033 1.876 0.981
13 HG3 PRO 3 2HG PRO 3 6.528 0.178 1.172
14 HD2 PRO 3 1HD PRO 3 4.970 2.507 0.044
15 HD3 PRO 3 2HD PRO 3 5.062 0.814 -0.524
16 H LEU 4 H LEU 4 2.929 3.238 2.054
17 HA LEU 4 HA LEU 4 2.550 3.926 4.893
18 HB2 LEU 4 1HB LEU 4 1.739 5.378 2.350
19 HB3 LEU 4 2HB LEU 4 1.565 6.019 3.965
20 HG LEU 4 HG LEU 4 4.196 5.485 2.540
21 HD11 LEU 4 1HD1 LEU 4 4.404 7.842 2.431
22 HD12 LEU 4 2HD1 LEU 4 2.828 8.083 3.280
23 HD13 LEU 4 3HD1 LEU 4 2.885 7.335 1.608
24 HD21 LEU 4 1HD2 LEU 4 3.567 6.596 5.334
25 HD22 LEU 4 2HD2 LEU 4 5.126 6.914 4.500
26 HD23 LEU 4 3HD2 LEU 4 4.624 5.262 4.891
27 H PHE 5 H PHE 5 0.502 3.310 1.973
28 HA PHE 5 HA PHE 5 -1.745 2.475 3.695
29 HB2 PHE 5 1HB PHE 5 -1.889 4.654 1.562
30 HB3 PHE 5 2HB PHE 5 -3.269 3.868 2.362
31 HD1 PHE 5 HD1 PHE 5 -0.850 6.563 2.634
32 HD2 PHE 5 HD2 PHE 5 -3.572 4.103 4.892
33 HE1 PHE 5 HE1 PHE 5 -0.754 8.170 4.443
34 HE2 PHE 5 HE2 PHE 5 -3.531 5.825 6.715
35 HZ PHE 5 HZ PHE 5 -2.120 7.845 6.503
36 H ASP 6 H ASP 6 -3.084 1.128 2.670
37 HA ASP 6 HA ASP 6 -3.204 -0.791 1.444
38 HB2 ASP 6 1HB ASP 6 -4.802 -0.447 -0.365
39 HB3 ASP 6 2HB ASP 6 -5.176 0.449 1.101
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -0.856 -2.119 0.567
2 HA2 GLY 1 1HA GLY 1 -0.410 -2.714 -1.705
3 HA3 GLY 1 2HA GLY 1 -1.344 -1.306 -2.299
4 H SER 2 H SER 2 0.539 -0.414 0.309
5 HA SER 2 HA SER 2 3.075 0.118 -1.047
6 HB2 SER 2 1HB SER 2 2.869 2.577 -0.807
7 HB3 SER 2 2HB SER 2 1.550 2.005 -1.847
8 HG SER 2 HG SER 2 0.430 3.102 -0.333
9 HA PRO 3 HA PRO 3 3.782 -0.303 3.293
10 HB2 PRO 3 1HB PRO 3 5.534 2.135 3.351
11 HB3 PRO 3 2HB PRO 3 5.885 0.464 3.939
12 HG2 PRO 3 1HG PRO 3 6.979 1.395 1.670
13 HG3 PRO 3 2HG PRO 3 6.351 -0.281 1.727
14 HD2 PRO 3 1HD PRO 3 5.023 2.175 0.581
15 HD3 PRO 3 2HD PRO 3 5.179 0.539 -0.073
16 H LEU 4 H LEU 4 2.660 2.828 2.100
17 HA LEU 4 HA LEU 4 1.996 3.626 4.913
18 HB2 LEU 4 1HB LEU 4 2.271 5.335 2.420
19 HB3 LEU 4 2HB LEU 4 1.882 5.924 4.030
20 HG LEU 4 HG LEU 4 4.507 4.688 3.142
21 HD11 LEU 4 1HD1 LEU 4 5.440 6.972 3.616
22 HD12 LEU 4 2HD1 LEU 4 3.753 7.539 3.836
23 HD13 LEU 4 3HD1 LEU 4 4.269 6.947 2.270
24 HD21 LEU 4 1HD2 LEU 4 4.332 4.078 5.422
25 HD22 LEU 4 2HD2 LEU 4 3.595 5.631 5.850
26 HD23 LEU 4 3HD2 LEU 4 5.314 5.551 5.449
27 H PHE 5 H PHE 5 0.256 2.819 1.963
28 HA PHE 5 HA PHE 5 -2.262 3.712 3.317
29 HB2 PHE 5 1HB PHE 5 -3.015 4.784 1.142
30 HB3 PHE 5 2HB PHE 5 -1.752 5.614 2.049
31 HD1 PHE 5 HD1 PHE 5 -2.390 3.562 -1.047
32 HD2 PHE 5 HD2 PHE 5 0.387 5.978 1.114
33 HE1 PHE 5 HE1 PHE 5 -0.983 3.614 -3.067
34 HE2 PHE 5 HE2 PHE 5 1.861 6.071 -0.973
35 HZ PHE 5 HZ PHE 5 1.155 4.908 -3.009
36 H ASP 6 H ASP 6 -1.085 1.129 2.712
37 HA ASP 6 HA ASP 6 -1.704 -0.937 2.094
38 HB2 ASP 6 1HB ASP 6 -4.330 0.419 1.813
39 HB3 ASP 6 2HB ASP 6 -4.138 -1.159 1.048
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -0.812 0.294 0.803
2 HA2 GLY 1 1HA GLY 1 -0.388 -1.977 -1.039
3 HA3 GLY 1 2HA GLY 1 0.240 -0.347 -1.539
4 H SER 2 H SER 2 2.405 -1.635 -1.250
5 HA SER 2 HA SER 2 3.249 -2.547 1.352
6 HB2 SER 2 1HB SER 2 4.361 -3.303 -0.681
7 HB3 SER 2 2HB SER 2 4.868 -1.645 -1.078
8 HG SER 2 HG SER 2 5.645 -3.125 1.229
9 HA PRO 3 HA PRO 3 5.084 1.490 2.377
10 HB2 PRO 3 1HB PRO 3 5.141 3.743 0.927
11 HB3 PRO 3 2HB PRO 3 6.338 2.448 0.681
12 HG2 PRO 3 1HG PRO 3 3.824 3.089 -0.844
13 HG3 PRO 3 2HG PRO 3 5.428 2.746 -1.495
14 HD2 PRO 3 1HD PRO 3 3.483 0.842 -1.321
15 HD3 PRO 3 2HD PRO 3 5.221 0.449 -1.248
16 H LEU 4 H LEU 4 3.949 3.043 3.713
17 HA LEU 4 HA LEU 4 2.200 4.134 4.620
18 HB2 LEU 4 1HB LEU 4 1.494 4.769 1.769
19 HB3 LEU 4 2HB LEU 4 0.835 5.578 3.193
20 HG LEU 4 HG LEU 4 3.761 5.670 2.291
21 HD11 LEU 4 1HD1 LEU 4 1.522 7.807 2.152
22 HD12 LEU 4 2HD1 LEU 4 2.213 6.985 0.766
23 HD13 LEU 4 3HD1 LEU 4 3.186 8.105 1.741
24 HD21 LEU 4 1HD2 LEU 4 3.834 7.573 4.004
25 HD22 LEU 4 2HD2 LEU 4 3.657 5.939 4.719
26 HD23 LEU 4 3HD2 LEU 4 2.238 7.007 4.600
27 H PHE 5 H PHE 5 -0.130 3.894 2.171
28 HA PHE 5 HA PHE 5 -1.556 1.808 3.795
29 HB2 PHE 5 1HB PHE 5 -2.750 4.407 2.777
30 HB3 PHE 5 2HB PHE 5 -3.568 3.158 3.749
31 HD1 PHE 5 HD1 PHE 5 -1.686 6.182 3.873
32 HD2 PHE 5 HD2 PHE 5 -2.664 2.630 6.079
33 HE1 PHE 5 HE1 PHE 5 -1.043 7.371 5.972
34 HE2 PHE 5 HE2 PHE 5 -1.985 3.825 8.221
35 HZ PHE 5 HZ PHE 5 -1.139 6.144 8.212
36 H ASP 6 H ASP 6 -3.310 0.862 2.688
37 HA ASP 6 HA ASP 6 -3.988 -0.553 1.092
38 HB2 ASP 6 1HB ASP 6 -5.025 0.270 -0.780
39 HB3 ASP 6 2HB ASP 6 -5.147 1.558 0.468
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -2.154 -0.442 -1.252
2 HA2 GLY 1 1HA GLY 1 -0.446 -2.716 -0.606
3 HA3 GLY 1 2HA GLY 1 -0.751 -2.084 -2.241
4 H SER 2 H SER 2 0.015 0.672 -0.911
5 HA SER 2 HA SER 2 2.889 0.412 -1.523
6 HB2 SER 2 1HB SER 2 1.104 2.818 -0.964
7 HB3 SER 2 2HB SER 2 2.811 2.938 -1.465
8 HG SER 2 HG SER 2 1.208 3.171 -3.151
9 HA PRO 3 HA PRO 3 3.776 0.639 2.763
10 HB2 PRO 3 1HB PRO 3 5.560 2.688 3.241
11 HB3 PRO 3 2HB PRO 3 6.004 1.049 2.604
12 HG2 PRO 3 1HG PRO 3 5.483 3.604 1.049
13 HG3 PRO 3 2HG PRO 3 6.889 2.489 0.907
14 HD2 PRO 3 1HD PRO 3 4.844 2.223 -0.843
15 HD3 PRO 3 2HD PRO 3 5.598 0.797 -0.114
16 H LEU 4 H LEU 4 2.571 1.314 4.312
17 HA LEU 4 HA LEU 4 1.115 2.510 5.590
18 HB2 LEU 4 1HB LEU 4 2.340 5.063 4.498
19 HB3 LEU 4 2HB LEU 4 1.557 4.786 6.064
20 HG LEU 4 HG LEU 4 4.178 3.513 5.326
21 HD11 LEU 4 1HD1 LEU 4 5.269 5.350 6.418
22 HD12 LEU 4 2HD1 LEU 4 3.727 6.051 6.916
23 HD13 LEU 4 3HD1 LEU 4 4.169 6.023 5.206
24 HD21 LEU 4 1HD2 LEU 4 2.981 4.004 8.055
25 HD22 LEU 4 2HD2 LEU 4 4.545 3.235 7.702
26 HD23 LEU 4 3HD2 LEU 4 3.025 2.428 7.238
27 H PHE 5 H PHE 5 0.693 2.361 2.447
28 HA PHE 5 HA PHE 5 -1.873 3.716 2.604
29 HB2 PHE 5 1HB PHE 5 -0.204 5.381 1.594
30 HB3 PHE 5 2HB PHE 5 0.040 4.284 0.280
31 HD1 PHE 5 HD1 PHE 5 -2.433 6.501 1.968
32 HD2 PHE 5 HD2 PHE 5 -1.659 4.040 -1.426
33 HE1 PHE 5 HE1 PHE 5 -4.458 7.476 0.820
34 HE2 PHE 5 HE2 PHE 5 -3.678 5.031 -2.585
35 HZ PHE 5 HZ PHE 5 -5.022 6.699 -1.467
36 H ASP 6 H ASP 6 -2.578 1.523 2.806
37 HA ASP 6 HA ASP 6 -3.386 -0.471 1.952
38 HB2 ASP 6 1HB ASP 6 -3.232 1.043 -0.675
39 HB3 ASP 6 2HB ASP 6 -4.152 -0.449 -0.363
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -1.445 -1.069 1.426
2 HA2 GLY 1 1HA GLY 1 -0.295 -2.914 0.547
3 HA3 GLY 1 2HA GLY 1 -0.835 -2.521 -1.074
4 H SER 2 H SER 2 -0.062 0.316 -0.797
5 HA SER 2 HA SER 2 2.772 0.191 -1.585
6 HB2 SER 2 1HB SER 2 0.782 2.446 -1.234
7 HB3 SER 2 2HB SER 2 2.428 2.718 -1.822
8 HG SER 2 HG SER 2 1.967 1.506 -3.623
9 HA PRO 3 HA PRO 3 4.292 1.120 2.404
10 HB2 PRO 3 1HB PRO 3 5.758 3.488 2.277
11 HB3 PRO 3 2HB PRO 3 6.357 1.918 1.656
12 HG2 PRO 3 1HG PRO 3 5.002 4.111 0.079
13 HG3 PRO 3 2HG PRO 3 6.595 3.291 -0.190
14 HD2 PRO 3 1HD PRO 3 4.431 2.399 -1.473
15 HD3 PRO 3 2HD PRO 3 5.551 1.217 -0.671
16 H LEU 4 H LEU 4 3.530 2.071 4.209
17 HA LEU 4 HA LEU 4 2.287 3.355 5.579
18 HB2 LEU 4 1HB LEU 4 2.007 5.465 3.448
19 HB3 LEU 4 2HB LEU 4 1.649 5.622 5.155
20 HG LEU 4 HG LEU 4 4.414 5.083 3.994
21 HD11 LEU 4 1HD1 LEU 4 3.052 7.625 4.888
22 HD12 LEU 4 2HD1 LEU 4 3.712 7.244 3.265
23 HD13 LEU 4 3HD1 LEU 4 4.796 7.478 4.641
24 HD21 LEU 4 1HD2 LEU 4 4.176 4.240 6.286
25 HD22 LEU 4 2HD2 LEU 4 3.630 5.859 6.775
26 HD23 LEU 4 3HD2 LEU 4 5.262 5.628 6.189
27 H PHE 5 H PHE 5 0.778 3.080 2.285
28 HA PHE 5 HA PHE 5 -1.581 2.071 3.634
29 HB2 PHE 5 1HB PHE 5 -3.127 3.658 2.599
30 HB3 PHE 5 2HB PHE 5 -2.062 4.399 3.780
31 HD1 PHE 5 HD1 PHE 5 -2.969 4.251 0.170
32 HD2 PHE 5 HD2 PHE 5 -0.273 5.941 3.096
33 HE1 PHE 5 HE1 PHE 5 -2.276 6.021 -1.412
34 HE2 PHE 5 HE2 PHE 5 0.447 7.660 1.450
35 HZ PHE 5 HZ PHE 5 -0.568 7.675 -0.854
36 H ASP 6 H ASP 6 -3.207 1.192 2.274
37 HA ASP 6 HA ASP 6 -3.914 -0.172 0.663
38 HB2 ASP 6 1HB ASP 6 -3.121 2.256 -0.870
39 HB3 ASP 6 2HB ASP 6 -3.959 0.946 -1.692
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -1.259 -2.043 0.673
2 HA2 GLY 1 1HA GLY 1 -0.280 -2.891 -1.228
3 HA3 GLY 1 2HA GLY 1 -1.164 -1.661 -2.216
4 H SER 2 H SER 2 0.411 -0.219 0.410
5 HA SER 2 HA SER 2 2.990 0.203 -1.006
6 HB2 SER 2 1HB SER 2 0.844 2.275 -0.436
7 HB3 SER 2 2HB SER 2 2.546 2.763 -0.609
8 HG SER 2 HG SER 2 1.006 1.378 -2.568
9 HA PRO 3 HA PRO 3 4.546 0.254 3.121
10 HB2 PRO 3 1HB PRO 3 5.746 2.949 2.694
11 HB3 PRO 3 2HB PRO 3 6.584 1.448 3.183
12 HG2 PRO 3 1HG PRO 3 6.899 2.347 0.770
13 HG3 PRO 3 2HG PRO 3 6.568 0.608 0.998
14 HD2 PRO 3 1HD PRO 3 4.663 2.817 0.180
15 HD3 PRO 3 2HD PRO 3 4.903 1.197 -0.566
16 H LEU 4 H LEU 4 2.869 3.278 2.131
17 HA LEU 4 HA LEU 4 2.139 3.751 5.002
18 HB2 LEU 4 1HB LEU 4 2.119 6.016 4.651
19 HB3 LEU 4 2HB LEU 4 3.679 5.422 4.160
20 HG LEU 4 HG LEU 4 1.461 6.330 2.315
21 HD11 LEU 4 1HD1 LEU 4 2.910 8.282 1.878
22 HD12 LEU 4 2HD1 LEU 4 4.047 7.696 3.108
23 HD13 LEU 4 3HD1 LEU 4 2.410 8.172 3.588
24 HD21 LEU 4 1HD2 LEU 4 2.732 4.784 1.035
25 HD22 LEU 4 2HD2 LEU 4 4.265 5.442 1.666
26 HD23 LEU 4 3HD2 LEU 4 3.280 6.413 0.566
27 H PHE 5 H PHE 5 0.681 2.619 2.391
28 HA PHE 5 HA PHE 5 -1.913 3.074 3.524
29 HB2 PHE 5 1HB PHE 5 -3.038 4.030 1.547
30 HB3 PHE 5 2HB PHE 5 -1.869 5.172 2.188
31 HD1 PHE 5 HD1 PHE 5 0.106 5.745 0.887
32 HD2 PHE 5 HD2 PHE 5 -2.625 2.835 -0.625
33 HE1 PHE 5 HE1 PHE 5 1.144 6.041 -1.338
34 HE2 PHE 5 HE2 PHE 5 -1.640 3.085 -2.854
35 HZ PHE 5 HZ PHE 5 0.233 4.691 -3.288
36 H ASP 6 H ASP 6 -3.548 1.715 1.967
37 HA ASP 6 HA ASP 6 -2.372 -0.833 1.913
38 HB2 ASP 6 1HB ASP 6 -4.324 -1.643 1.038
39 HB3 ASP 6 2HB ASP 6 -4.770 -0.331 2.106
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -1.129 -0.490 1.270
2 HA2 GLY 1 1HA GLY 1 -0.236 -1.561 -1.200
3 HA3 GLY 1 2HA GLY 1 0.446 0.102 -0.947
4 H SER 2 H SER 2 2.580 -0.744 -0.702
5 HA SER 2 HA SER 2 2.885 -2.165 1.906
6 HB2 SER 2 1HB SER 2 3.873 -3.340 0.042
7 HB3 SER 2 2HB SER 2 4.846 -1.873 -0.413
8 HG SER 2 HG SER 2 5.044 -3.263 2.123
9 HA PRO 3 HA PRO 3 5.818 1.268 2.765
10 HB2 PRO 3 1HB PRO 3 6.463 3.360 1.156
11 HB3 PRO 3 2HB PRO 3 7.225 1.768 0.890
12 HG2 PRO 3 1HG PRO 3 4.925 2.997 -0.542
13 HG3 PRO 3 2HG PRO 3 6.334 2.132 -1.209
14 HD2 PRO 3 1HD PRO 3 3.829 0.939 -0.822
15 HD3 PRO 3 2HD PRO 3 5.404 0.069 -0.843
16 H LEU 4 H LEU 4 2.704 1.695 1.511
17 HA LEU 4 HA LEU 4 2.134 3.933 3.442
18 HB2 LEU 4 1HB LEU 4 0.735 4.983 1.571
19 HB3 LEU 4 2HB LEU 4 2.423 5.359 1.660
20 HG LEU 4 HG LEU 4 2.856 3.926 -0.304
21 HD11 LEU 4 1HD1 LEU 4 1.073 2.304 -0.162
22 HD12 LEU 4 2HD1 LEU 4 1.011 3.175 -1.727
23 HD13 LEU 4 3HD1 LEU 4 -0.144 3.589 -0.432
24 HD21 LEU 4 1HD2 LEU 4 1.901 5.340 -1.997
25 HD22 LEU 4 2HD2 LEU 4 2.460 6.319 -0.613
26 HD23 LEU 4 3HD2 LEU 4 0.720 5.977 -0.821
27 H PHE 5 H PHE 5 -0.453 4.170 3.387
28 HA PHE 5 HA PHE 5 -1.583 1.633 3.834
29 HB2 PHE 5 1HB PHE 5 -3.755 2.892 3.902
30 HB3 PHE 5 2HB PHE 5 -2.467 3.549 4.965
31 HD1 PHE 5 HD1 PHE 5 -4.362 4.070 1.745
32 HD2 PHE 5 HD2 PHE 5 -1.534 5.748 4.577
33 HE1 PHE 5 HE1 PHE 5 -4.641 6.366 0.694
34 HE2 PHE 5 HE2 PHE 5 -1.809 8.063 3.506
35 HZ PHE 5 HZ PHE 5 -3.357 8.316 1.587
36 H ASP 6 H ASP 6 -3.251 0.477 2.733
37 HA ASP 6 HA ASP 6 -3.950 -0.665 0.830
38 HB2 ASP 6 1HB ASP 6 -5.406 1.288 0.589
39 HB3 ASP 6 2HB ASP 6 -4.129 2.132 -0.314
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -0.889 0.521 0.630
2 HA2 GLY 1 1HA GLY 1 -0.413 -1.872 -1.127
3 HA3 GLY 1 2HA GLY 1 0.385 -0.342 -1.504
4 H SER 2 H SER 2 2.343 -1.645 -1.157
5 HA SER 2 HA SER 2 3.052 -2.578 1.506
6 HB2 SER 2 1HB SER 2 5.410 -1.933 0.006
7 HB3 SER 2 2HB SER 2 4.714 -3.501 0.302
8 HG SER 2 HG SER 2 3.855 -3.496 -1.653
9 HA PRO 3 HA PRO 3 5.024 1.511 2.409
10 HB2 PRO 3 1HB PRO 3 4.955 3.685 0.733
11 HB3 PRO 3 2HB PRO 3 6.208 2.385 0.611
12 HG2 PRO 3 1HG PRO 3 3.609 2.743 -0.968
13 HG3 PRO 3 2HG PRO 3 5.306 2.551 -1.529
14 HD2 PRO 3 1HD PRO 3 3.538 0.438 -1.297
15 HD3 PRO 3 2HD PRO 3 5.307 0.257 -1.050
16 H LEU 4 H LEU 4 3.977 3.331 3.516
17 HA LEU 4 HA LEU 4 2.260 4.434 4.437
18 HB2 LEU 4 1HB LEU 4 1.383 4.701 1.551
19 HB3 LEU 4 2HB LEU 4 0.756 5.648 2.924
20 HG LEU 4 HG LEU 4 3.702 5.604 2.135
21 HD11 LEU 4 1HD1 LEU 4 1.490 7.599 1.432
22 HD12 LEU 4 2HD1 LEU 4 2.414 6.613 0.286
23 HD13 LEU 4 3HD1 LEU 4 3.224 7.908 1.207
24 HD21 LEU 4 1HD2 LEU 4 2.018 7.373 4.012
25 HD22 LEU 4 2HD2 LEU 4 3.700 7.725 3.575
26 HD23 LEU 4 3HD2 LEU 4 3.310 6.260 4.512
27 H PHE 5 H PHE 5 -0.246 3.823 2.202
28 HA PHE 5 HA PHE 5 -1.286 1.618 3.797
29 HB2 PHE 5 1HB PHE 5 -3.459 2.703 3.961
30 HB3 PHE 5 2HB PHE 5 -2.264 3.764 4.698
31 HD1 PHE 5 HD1 PHE 5 -1.533 5.889 3.499
32 HD2 PHE 5 HD2 PHE 5 -4.617 3.316 1.878
33 HE1 PHE 5 HE1 PHE 5 -2.319 7.677 2.064
34 HE2 PHE 5 HE2 PHE 5 -5.333 5.145 0.319
35 HZ PHE 5 HZ PHE 5 -4.196 7.315 0.424
36 H ASP 6 H ASP 6 -3.221 0.707 2.617
37 HA ASP 6 HA ASP 6 -4.125 -0.370 0.884
38 HB2 ASP 6 1HB ASP 6 -3.606 2.239 -0.386
39 HB3 ASP 6 2HB ASP 6 -4.033 0.879 -1.409
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -0.914 -1.751 0.682
2 HA2 GLY 1 1HA GLY 1 -0.452 -2.645 -1.577
3 HA3 GLY 1 2HA GLY 1 -1.053 -1.096 -2.249
4 H SER 2 H SER 2 0.471 0.095 0.189
5 HA SER 2 HA SER 2 3.271 -0.040 -0.784
6 HB2 SER 2 1HB SER 2 1.750 2.585 -0.214
7 HB3 SER 2 2HB SER 2 3.444 2.447 -0.690
8 HG SER 2 HG SER 2 1.165 1.781 -2.269
9 HA PRO 3 HA PRO 3 3.709 0.012 3.772
10 HB2 PRO 3 1HB PRO 3 5.650 2.277 3.467
11 HB3 PRO 3 2HB PRO 3 5.826 0.741 4.346
12 HG2 PRO 3 1HG PRO 3 7.115 0.918 1.999
13 HG3 PRO 3 2HG PRO 3 6.112 -0.455 2.336
14 HD2 PRO 3 1HD PRO 3 5.382 2.010 0.809
15 HD3 PRO 3 2HD PRO 3 5.310 0.293 0.289
16 H LEU 4 H LEU 4 3.231 3.061 2.059
17 HA LEU 4 HA LEU 4 2.569 4.655 4.373
18 HB2 LEU 4 1HB LEU 4 1.864 5.009 1.445
19 HB3 LEU 4 2HB LEU 4 1.585 6.198 2.693
20 HG LEU 4 HG LEU 4 3.364 6.922 1.387
21 HD11 LEU 4 1HD1 LEU 4 3.569 7.204 3.890
22 HD12 LEU 4 2HD1 LEU 4 5.062 7.380 2.988
23 HD13 LEU 4 3HD1 LEU 4 4.749 5.897 3.895
24 HD21 LEU 4 1HD2 LEU 4 4.072 4.797 0.418
25 HD22 LEU 4 2HD2 LEU 4 4.883 4.342 1.943
26 HD23 LEU 4 3HD2 LEU 4 5.449 5.740 1.026
27 H PHE 5 H PHE 5 0.510 3.101 1.789
28 HA PHE 5 HA PHE 5 -1.599 2.671 3.779
29 HB2 PHE 5 1HB PHE 5 -3.344 3.844 2.566
30 HB3 PHE 5 2HB PHE 5 -2.027 4.982 2.912
31 HD1 PHE 5 HD1 PHE 5 -3.715 3.114 0.201
32 HD2 PHE 5 HD2 PHE 5 -0.603 5.935 1.186
33 HE1 PHE 5 HE1 PHE 5 -3.505 3.605 -2.152
34 HE2 PHE 5 HE2 PHE 5 -0.426 6.546 -1.229
35 HZ PHE 5 HZ PHE 5 -1.892 5.317 -2.907
36 H ASP 6 H ASP 6 -3.291 1.282 2.630
37 HA ASP 6 HA ASP 6 -2.580 -1.065 1.777
38 HB2 ASP 6 1HB ASP 6 -4.832 0.609 0.631
39 HB3 ASP 6 2HB ASP 6 -4.593 -1.052 0.103
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -0.778 -0.256 1.191
2 HA2 GLY 1 1HA GLY 1 -0.332 -2.131 -0.937
3 HA3 GLY 1 2HA GLY 1 0.335 -0.521 -1.336
4 H SER 2 H SER 2 2.356 -1.579 -1.430
5 HA SER 2 HA SER 2 3.643 -2.668 0.945
6 HB2 SER 2 1HB SER 2 4.383 -3.065 -1.393
7 HB3 SER 2 2HB SER 2 4.890 -1.360 -1.516
8 HG SER 2 HG SER 2 6.315 -1.751 0.250
9 HA PRO 3 HA PRO 3 5.115 1.702 1.816
10 HB2 PRO 3 1HB PRO 3 4.145 3.898 0.574
11 HB3 PRO 3 2HB PRO 3 5.438 2.968 -0.127
12 HG2 PRO 3 1HG PRO 3 2.508 2.752 -0.694
13 HG3 PRO 3 2HG PRO 3 3.824 3.052 -1.856
14 HD2 PRO 3 1HD PRO 3 2.811 0.606 -1.381
15 HD3 PRO 3 2HD PRO 3 4.570 0.853 -1.714
16 H LEU 4 H LEU 4 3.853 3.800 2.777
17 HA LEU 4 HA LEU 4 1.837 2.648 4.408
18 HB2 LEU 4 1HB LEU 4 1.487 4.824 5.285
19 HB3 LEU 4 2HB LEU 4 3.203 4.682 4.995
20 HG LEU 4 HG LEU 4 1.317 6.258 3.195
21 HD11 LEU 4 1HD1 LEU 4 1.246 7.133 5.427
22 HD12 LEU 4 2HD1 LEU 4 2.426 8.139 4.612
23 HD13 LEU 4 3HD1 LEU 4 2.979 6.865 5.701
24 HD21 LEU 4 1HD2 LEU 4 4.421 6.190 3.372
25 HD22 LEU 4 2HD2 LEU 4 3.479 7.459 2.534
26 HD23 LEU 4 3HD2 LEU 4 3.396 5.788 1.938
27 H PHE 5 H PHE 5 -0.298 2.669 4.425
28 HA PHE 5 HA PHE 5 -2.424 2.547 3.683
29 HB2 PHE 5 1HB PHE 5 -1.560 4.958 2.089
30 HB3 PHE 5 2HB PHE 5 -3.221 4.341 2.095
31 HD1 PHE 5 HD1 PHE 5 -4.531 4.407 4.251
32 HD2 PHE 5 HD2 PHE 5 -0.649 6.267 3.947
33 HE1 PHE 5 HE1 PHE 5 -4.988 5.651 6.336
34 HE2 PHE 5 HE2 PHE 5 -1.110 7.511 6.023
35 HZ PHE 5 HZ PHE 5 -3.288 7.228 7.219
36 H ASP 6 H ASP 6 -3.282 0.986 2.626
37 HA ASP 6 HA ASP 6 -3.819 -0.546 1.082
38 HB2 ASP 6 1HB ASP 6 -4.749 1.881 0.384
39 HB3 ASP 6 2HB ASP 6 -3.769 1.552 -1.056
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -0.883 -1.232 1.246
2 HA2 GLY 1 1HA GLY 1 -0.432 -2.535 -1.133
3 HA3 GLY 1 2HA GLY 1 -0.185 -0.828 -1.628
4 H SER 2 H SER 2 2.186 -1.185 -1.890
5 HA SER 2 HA SER 2 3.797 -2.194 0.271
6 HB2 SER 2 1HB SER 2 5.619 -0.748 -1.110
7 HB3 SER 2 2HB SER 2 4.920 -2.244 -1.732
8 HG SER 2 HG SER 2 4.856 -0.635 -3.275
9 HA PRO 3 HA PRO 3 4.569 2.343 1.550
10 HB2 PRO 3 1HB PRO 3 2.021 3.752 0.929
11 HB3 PRO 3 2HB PRO 3 3.671 4.310 0.778
12 HG2 PRO 3 1HG PRO 3 2.347 3.794 -1.384
13 HG3 PRO 3 2HG PRO 3 4.045 3.250 -1.226
14 HD2 PRO 3 1HD PRO 3 1.537 1.635 -0.761
15 HD3 PRO 3 2HD PRO 3 2.941 1.258 -1.792
16 H LEU 4 H LEU 4 3.056 3.939 3.229
17 HA LEU 4 HA LEU 4 2.027 2.118 5.192
18 HB2 LEU 4 1HB LEU 4 1.566 5.103 4.860
19 HB3 LEU 4 2HB LEU 4 1.193 4.150 6.314
20 HG LEU 4 HG LEU 4 3.992 4.410 5.061
21 HD11 LEU 4 1HD1 LEU 4 4.371 6.090 6.923
22 HD12 LEU 4 2HD1 LEU 4 2.629 6.090 7.188
23 HD13 LEU 4 3HD1 LEU 4 3.328 6.675 5.652
24 HD21 LEU 4 1HD2 LEU 4 3.774 2.512 6.631
25 HD22 LEU 4 2HD2 LEU 4 2.966 3.549 7.811
26 HD23 LEU 4 3HD2 LEU 4 4.702 3.807 7.417
27 H PHE 5 H PHE 5 0.648 3.812 2.529
28 HA PHE 5 HA PHE 5 -2.106 3.529 3.180
29 HB2 PHE 5 1HB PHE 5 -0.970 5.067 1.398
30 HB3 PHE 5 2HB PHE 5 -0.884 3.665 0.337
31 HD1 PHE 5 HD1 PHE 5 -3.294 5.667 2.407
32 HD2 PHE 5 HD2 PHE 5 -2.676 3.228 -1.032
33 HE1 PHE 5 HE1 PHE 5 -5.611 6.116 1.704
34 HE2 PHE 5 HE2 PHE 5 -5.025 3.710 -1.850
35 HZ PHE 5 HZ PHE 5 -6.542 5.176 -0.396
36 H ASP 6 H ASP 6 -3.472 2.139 1.400
37 HA ASP 6 HA ASP 6 -2.914 -0.624 1.925
38 HB2 ASP 6 1HB ASP 6 -5.025 1.031 1.020
39 HB3 ASP 6 2HB ASP 6 -4.715 -0.097 -0.321