Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
595664 | 2n0d RC | 25521 | 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 H1 GLY 1 9.792 4.052 -0.685
2 H2 GLY 1 H2 GLY 1 9.572 5.179 -1.868
3 H3 GLY 1 H3 GLY 1 8.825 5.359 -0.409
4 HA2 GLY 1 HA2 GLY 1 8.314 3.301 -2.410
5 HA3 GLY 1 HA3 GLY 1 7.589 3.332 -0.791
6 H ASN 2 H ASN 2 5.593 3.298 -2.147
7 HA ASN 2 HA ASN 2 4.900 6.066 -3.047
8 HB2 ASN 2 HB2 ASN 2 4.003 3.342 -3.996
9 HB3 ASN 2 HB3 ASN 2 3.017 4.788 -4.292
10 HD21 ASN 2 HD22 ASN 2 3.545 6.152 -5.936
11 HD22 ASN 2 HD21 ASN 2 4.955 5.964 -6.955
12 H HIS 3 H HIS 3 2.977 6.986 -2.394
13 HA HIS 3 HA HIS 3 2.083 6.445 0.213
14 HB2 HIS 3 HB3 HIS 3 1.708 8.570 -0.963
15 HB3 HIS 3 HB2 HIS 3 0.570 7.767 -2.057
16 HD2 HIS 3 HD2 HIS 3 0.261 6.918 1.724
17 HE1 HIS 3 HE1 HIS 3 -2.929 9.516 0.684
18 HE2 HIS 3 HE2 HIS 3 -1.986 8.020 2.519
19 H TRP 4 H TRP 4 0.168 5.869 -2.768
20 HA TRP 4 HA TRP 4 -1.570 4.014 -1.325
21 HB2 TRP 4 HB3 TRP 4 -2.903 3.993 -3.248
22 HB3 TRP 4 HB2 TRP 4 -2.229 5.632 -3.213
23 HD1 TRP 4 HD1 TRP 4 0.593 5.121 -4.556
24 HE1 TRP 4 HE1 TRP 4 0.770 4.507 -7.058
25 HE3 TRP 4 HE3 TRP 4 -4.148 3.342 -5.247
26 HZ2 TRP 4 HZ2 TRP 4 -0.905 3.414 -9.033
27 HZ3 TRP 4 HZ3 TRP 4 -4.788 2.525 -7.480
28 HH2 TRP 4 HH2 TRP 4 -3.187 2.561 -9.346
29 H ALA 5 H ALA 5 -2.138 2.064 -3.151
30 HA ALA 5 HA ALA 5 -1.459 -0.012 -3.870
31 HB1 ALA 5 HB1 ALA 5 0.250 -0.016 -5.334
32 HB2 ALA 5 HB2 ALA 5 0.354 1.727 -4.988
33 HB3 ALA 5 HB3 ALA 5 1.411 0.583 -4.126
34 H VAL 6 H VAL 6 -1.396 0.727 -1.048
35 HA VAL 6 HA VAL 6 0.872 -0.871 -0.008
36 HB VAL 6 HB VAL 6 0.158 -0.134 2.203
37 HG11 VAL 6 HG11 VAL 6 1.628 1.330 0.876
38 HG12 VAL 6 HG12 VAL 6 0.198 2.170 0.229
39 HG13 VAL 6 HG13 VAL 6 0.574 2.262 1.966
40 HG21 VAL 6 HG21 VAL 6 -2.271 -0.148 1.798
41 HG22 VAL 6 HG22 VAL 6 -2.102 1.298 0.773
42 HG23 VAL 6 HG23 VAL 6 -1.726 1.390 2.511
43 H GLY 7 H GLY 7 -1.492 -1.989 -1.529
44 HA2 GLY 7 HA3 GLY 7 -2.229 -3.986 0.565
45 HA3 GLY 7 HA2 GLY 7 -3.454 -3.311 -0.526
46 H HIS 8 H HIS 8 -0.119 -4.190 -1.364
47 HA HIS 8 HA HIS 8 -1.160 -6.532 -2.876
48 HB2 HIS 8 HB3 HIS 8 0.796 -4.578 -4.107
49 HB3 HIS 8 HB2 HIS 8 -0.080 -5.905 -4.890
50 HD2 HIS 8 HD2 HIS 8 -0.287 -2.245 -4.904
51 HE1 HIS 8 HE1 HIS 8 -4.338 -3.481 -5.120
52 HE2 HIS 8 HE2 HIS 8 -2.753 -1.512 -5.420
53 H LEU 9 H LEU 9 1.809 -4.683 -2.076
54 HA LEU 9 HA LEU 9 3.531 -6.977 -2.258
55 HB2 LEU 9 HB2 LEU 9 3.842 -4.240 -1.991
56 HB3 LEU 9 HB3 LEU 9 4.416 -4.856 -0.437
57 HG LEU 9 HG LEU 9 5.750 -6.513 -2.085
58 HD11 LEU 9 HD11 LEU 9 4.813 -5.478 -4.114
59 HD12 LEU 9 HD12 LEU 9 5.504 -3.911 -3.626
60 HD13 LEU 9 HD13 LEU 9 6.579 -5.273 -4.022
61 HD21 LEU 9 HD21 LEU 9 6.695 -5.099 -0.301
62 HD22 LEU 9 HD22 LEU 9 7.687 -5.051 -1.778
63 HD23 LEU 9 HD23 LEU 9 6.612 -3.688 -1.383
64 H MET 10 H MET 10 2.001 -5.290 0.495
65 HA MET 10 HA MET 10 2.534 -7.742 2.120
66 HB2 MET 10 HB2 MET 10 2.746 -6.279 4.098
67 HB3 MET 10 HB3 MET 10 4.014 -5.985 2.896
68 HG2 MET 10 HG3 MET 10 1.551 -4.300 2.764
69 HG3 MET 10 HG2 MET 10 2.681 -4.015 4.102
70 HE1 MET 10 HE1 MET 10 2.934 -2.110 0.146
71 HE2 MET 10 HE2 MET 10 1.895 -3.538 0.374
72 HE3 MET 10 HE3 MET 10 1.725 -2.131 1.452
Start of MODEL 2
1 H1 GLY 1 H1 GLY 1 10.175 6.278 -1.132
2 H2 GLY 1 H2 GLY 1 9.416 6.572 -2.566
3 H3 GLY 1 H3 GLY 1 9.068 7.495 -1.245
4 HA2 GLY 1 HA3 GLY 1 8.527 4.641 -1.525
5 HA3 GLY 1 HA2 GLY 1 8.151 5.641 -0.109
6 H ASN 2 H ASN 2 6.379 4.063 -1.861
7 HA ASN 2 HA ASN 2 4.797 6.182 -3.202
8 HB2 ASN 2 HB2 ASN 2 3.397 4.219 -3.954
9 HB3 ASN 2 HB3 ASN 2 5.074 4.223 -4.535
10 HD21 ASN 2 HD21 ASN 2 6.395 2.528 -4.070
11 HD22 ASN 2 HD22 ASN 2 5.938 1.171 -3.065
12 H HIS 3 H HIS 3 2.804 6.836 -2.571
13 HA HIS 3 HA HIS 3 2.100 6.421 0.205
14 HB2 HIS 3 HB2 HIS 3 1.734 8.514 -1.212
15 HB3 HIS 3 HB3 HIS 3 0.351 7.668 -1.926
16 HD2 HIS 3 HD2 HIS 3 0.363 6.708 1.690
17 HE1 HIS 3 HE1 HIS 3 -1.949 10.261 1.492
18 HE2 HIS 3 HE2 HIS 3 -1.316 8.277 2.962
19 H TRP 4 H TRP 4 0.133 5.894 -2.748
20 HA TRP 4 HA TRP 4 -1.582 4.017 -1.324
21 HB2 TRP 4 HB3 TRP 4 -2.910 3.994 -3.249
22 HB3 TRP 4 HB2 TRP 4 -2.238 5.634 -3.213
23 HD1 TRP 4 HD1 TRP 4 0.588 5.126 -4.547
24 HE1 TRP 4 HE1 TRP 4 0.773 4.515 -7.048
25 HE3 TRP 4 HE3 TRP 4 -4.148 3.342 -5.252
26 HZ2 TRP 4 HZ2 TRP 4 -0.894 3.418 -9.030
27 HZ3 TRP 4 HZ3 TRP 4 -4.782 2.523 -7.486
28 HH2 TRP 4 HH2 TRP 4 -3.175 2.564 -9.349
29 H ALA 5 H ALA 5 -2.144 2.067 -3.150
30 HA ALA 5 HA ALA 5 -1.459 -0.008 -3.868
31 HB1 ALA 5 HB1 ALA 5 0.252 -0.011 -5.328
32 HB2 ALA 5 HB2 ALA 5 1.410 0.588 -4.117
33 HB3 ALA 5 HB3 ALA 5 0.355 1.732 -4.982
34 H VAL 6 H VAL 6 -1.408 0.726 -1.048
35 HA VAL 6 HA VAL 6 0.860 -0.867 0.001
36 HB VAL 6 HB VAL 6 0.144 -0.129 2.209
37 HG11 VAL 6 HG11 VAL 6 1.598 1.349 0.881
38 HG12 VAL 6 HG12 VAL 6 0.160 2.174 0.233
39 HG13 VAL 6 HG13 VAL 6 0.535 2.272 1.970
40 HG21 VAL 6 HG21 VAL 6 -1.753 1.420 2.485
41 HG22 VAL 6 HG22 VAL 6 -2.148 1.233 0.760
42 HG23 VAL 6 HG23 VAL 6 -2.274 -0.162 1.858
43 H GLY 7 H GLY 7 -1.495 -1.987 -1.530
44 HA2 GLY 7 HA3 GLY 7 -2.234 -3.990 0.559
45 HA3 GLY 7 HA2 GLY 7 -3.458 -3.317 -0.536
46 H HIS 8 H HIS 8 -0.117 -4.185 -1.361
47 HA HIS 8 HA HIS 8 -1.144 -6.529 -2.880
48 HB2 HIS 8 HB2 HIS 8 0.807 -4.560 -4.092
49 HB3 HIS 8 HB3 HIS 8 -0.045 -5.892 -4.892
50 HD2 HIS 8 HD2 HIS 8 -0.274 -2.237 -4.897
51 HE1 HIS 8 HE1 HIS 8 -4.323 -3.485 -5.131
52 HE2 HIS 8 HE2 HIS 8 -2.740 -1.510 -5.427
53 H LEU 9 H LEU 9 1.810 -4.673 -2.046
54 HA LEU 9 HA LEU 9 3.536 -6.970 -2.222
55 HB2 LEU 9 HB2 LEU 9 3.847 -4.229 -1.973
56 HB3 LEU 9 HB3 LEU 9 4.422 -4.836 -0.417
57 HG LEU 9 HG LEU 9 5.771 -6.501 -2.023
58 HD11 LEU 9 HD11 LEU 9 4.803 -5.556 -4.083
59 HD12 LEU 9 HD12 LEU 9 6.566 -5.324 -4.014
60 HD13 LEU 9 HD13 LEU 9 5.475 -3.963 -3.662
61 HD21 LEU 9 HD21 LEU 9 6.709 -5.007 -0.302
62 HD22 LEU 9 HD22 LEU 9 7.689 -5.001 -1.788
63 HD23 LEU 9 HD23 LEU 9 6.597 -3.639 -1.436
64 H MET 10 H MET 10 2.184 -5.175 0.572
65 HA MET 10 HA MET 10 2.661 -7.637 2.204
66 HB2 MET 10 HB2 MET 10 2.863 -6.135 4.161
67 HB3 MET 10 HB3 MET 10 4.133 -5.867 2.955
68 HG2 MET 10 HG3 MET 10 1.666 -4.186 2.801
69 HG3 MET 10 HG2 MET 10 2.815 -3.869 4.114
70 HE1 MET 10 HE1 MET 10 3.007 -2.041 0.126
71 HE2 MET 10 HE2 MET 10 1.962 -3.455 0.402
72 HE3 MET 10 HE3 MET 10 1.829 -2.030 1.460
Start of MODEL 3
1 H1 GLY 1 H1 GLY 1 9.904 5.504 -1.021
2 H2 GLY 1 H2 GLY 1 9.047 6.783 -1.613
3 H3 GLY 1 H3 GLY 1 9.038 5.342 -2.415
4 HA2 GLY 1 HA2 GLY 1 7.935 4.276 -0.621
5 HA3 GLY 1 HA3 GLY 1 7.945 5.822 0.249
6 H ASN 2 H ASN 2 6.286 3.809 -1.932
7 HA ASN 2 HA ASN 2 4.716 5.913 -3.208
8 HB2 ASN 2 HB2 ASN 2 4.301 2.908 -3.069
9 HB3 ASN 2 HB3 ASN 2 3.376 4.025 -4.091
10 HD21 ASN 2 HD21 ASN 2 5.761 1.793 -4.181
11 HD22 ASN 2 HD22 ASN 2 6.719 2.405 -5.512
12 H HIS 3 H HIS 3 2.999 6.910 -2.420
13 HA HIS 3 HA HIS 3 2.044 6.511 0.209
14 HB2 HIS 3 HB2 HIS 3 1.771 8.520 -1.391
15 HB3 HIS 3 HB3 HIS 3 0.347 7.664 -2.007
16 HD2 HIS 3 HD2 HIS 3 0.637 7.167 1.752
17 HE1 HIS 3 HE1 HIS 3 -1.963 10.471 1.177
18 HE2 HIS 3 HE2 HIS 3 -1.082 8.797 2.885
19 H TRP 4 H TRP 4 0.224 5.832 -2.809
20 HA TRP 4 HA TRP 4 -1.553 4.025 -1.329
21 HB2 TRP 4 HB3 TRP 4 -2.899 4.002 -3.244
22 HB3 TRP 4 HB2 TRP 4 -2.216 5.638 -3.221
23 HD1 TRP 4 HD1 TRP 4 0.596 5.106 -4.579
24 HE1 TRP 4 HE1 TRP 4 0.753 4.482 -7.079
25 HE3 TRP 4 HE3 TRP 4 -4.160 3.349 -5.229
26 HZ2 TRP 4 HZ2 TRP 4 -0.942 3.386 -9.039
27 HZ3 TRP 4 HZ3 TRP 4 -4.822 2.528 -7.454
28 HH2 TRP 4 HH2 TRP 4 -3.231 2.546 -9.331
29 H ALA 5 H ALA 5 -2.143 2.070 -3.141
30 HA ALA 5 HA ALA 5 -1.481 -0.012 -3.857
31 HB1 ALA 5 HB1 ALA 5 0.216 -0.031 -5.334
32 HB2 ALA 5 HB2 ALA 5 0.332 1.712 -4.995
33 HB3 ALA 5 HB3 ALA 5 1.389 0.566 -4.137
34 H VAL 6 H VAL 6 -1.411 0.718 -1.043
35 HA VAL 6 HA VAL 6 0.867 -0.872 -0.008
36 HB VAL 6 HB VAL 6 0.137 -0.142 2.210
37 HG11 VAL 6 HG11 VAL 6 1.641 1.302 0.899
38 HG12 VAL 6 HG12 VAL 6 0.230 2.162 0.238
39 HG13 VAL 6 HG13 VAL 6 0.589 2.248 1.979
40 HG21 VAL 6 HG21 VAL 6 -2.288 -0.122 1.779
41 HG22 VAL 6 HG22 VAL 6 -2.089 1.322 0.757
42 HG23 VAL 6 HG23 VAL 6 -1.730 1.408 2.499
43 H GLY 7 H GLY 7 -1.488 -2.002 -1.522
44 HA2 GLY 7 HA3 GLY 7 -2.216 -4.002 0.573
45 HA3 GLY 7 HA2 GLY 7 -3.449 -3.326 -0.510
46 H HIS 8 H HIS 8 -0.116 -4.191 -1.373
47 HA HIS 8 HA HIS 8 -1.160 -6.536 -2.879
48 HB2 HIS 8 HB3 HIS 8 0.781 -4.575 -4.123
49 HB3 HIS 8 HB2 HIS 8 -0.099 -5.903 -4.901
50 HD2 HIS 8 HD2 HIS 8 -0.313 -2.244 -4.905
51 HE1 HIS 8 HE1 HIS 8 -4.365 -3.491 -5.089
52 HE2 HIS 8 HE2 HIS 8 -2.787 -1.515 -5.403
53 H LEU 9 H LEU 9 1.797 -4.677 -2.066
54 HA LEU 9 HA LEU 9 3.527 -6.970 -2.269
55 HB2 LEU 9 HB2 LEU 9 3.836 -4.231 -2.020
56 HB3 LEU 9 HB3 LEU 9 4.426 -4.838 -0.469
57 HG LEU 9 HG LEU 9 5.768 -6.499 -2.082
58 HD11 LEU 9 HD11 LEU 9 4.772 -5.571 -4.136
59 HD12 LEU 9 HD12 LEU 9 6.535 -5.328 -4.088
60 HD13 LEU 9 HD13 LEU 9 5.440 -3.971 -3.731
61 HD21 LEU 9 HD21 LEU 9 6.718 -4.990 -0.381
62 HD22 LEU 9 HD22 LEU 9 7.680 -4.987 -1.878
63 HD23 LEU 9 HD23 LEU 9 6.585 -3.630 -1.520
64 H MET 10 H MET 10 1.513 -5.646 0.260
65 HA MET 10 HA MET 10 2.701 -7.590 2.190
66 HB2 MET 10 HB2 MET 10 0.936 -5.188 2.756
67 HB3 MET 10 HB3 MET 10 1.721 -6.229 3.957
68 HG2 MET 10 HG2 MET 10 3.626 -5.076 3.836
69 HG3 MET 10 HG3 MET 10 3.645 -5.143 2.063
70 HE1 MET 10 HE1 MET 10 3.031 -3.574 0.559
71 HE2 MET 10 HE2 MET 10 1.321 -3.186 0.862
72 HE3 MET 10 HE3 MET 10 2.538 -1.888 0.842
Start of MODEL 4
1 H1 GLY 1 H1 GLY 1 7.635 1.071 -2.073
2 H2 GLY 1 H2 GLY 1 6.012 1.362 -2.062
3 H3 GLY 1 H3 GLY 1 7.055 2.484 -1.452
4 HA2 GLY 1 HA2 GLY 1 8.079 2.486 -3.741
5 HA3 GLY 1 HA3 GLY 1 6.527 1.764 -4.207
6 H ASN 2 H ASN 2 4.712 3.061 -2.659
7 HA ASN 2 HA ASN 2 5.176 5.954 -2.826
8 HB2 ASN 2 HB3 ASN 2 3.437 4.460 -4.770
9 HB3 ASN 2 HB2 ASN 2 2.938 6.072 -4.220
10 HD21 ASN 2 HD21 ASN 2 3.953 4.931 -6.872
11 HD22 ASN 2 HD22 ASN 2 5.238 6.023 -7.335
12 H HIS 3 H HIS 3 2.883 7.066 -2.425
13 HA HIS 3 HA HIS 3 2.136 6.413 0.207
14 HB2 HIS 3 HB2 HIS 3 1.715 8.546 -1.195
15 HB3 HIS 3 HB3 HIS 3 0.237 7.729 -1.730
16 HD2 HIS 3 HD2 HIS 3 1.078 7.081 1.967
17 HE1 HIS 3 HE1 HIS 3 -1.856 10.142 1.863
18 HE2 HIS 3 HE2 HIS 3 -0.600 8.525 3.376
19 H TRP 4 H TRP 4 0.236 5.831 -2.783
20 HA TRP 4 HA TRP 4 -1.544 4.014 -1.326
21 HB2 TRP 4 HB2 TRP 4 -2.870 3.987 -3.250
22 HB3 TRP 4 HB3 TRP 4 -2.208 5.631 -3.212
23 HD1 TRP 4 HD1 TRP 4 0.626 5.109 -4.555
24 HE1 TRP 4 HE1 TRP 4 0.801 4.494 -7.055
25 HE3 TRP 4 HE3 TRP 4 -4.123 3.352 -5.246
26 HZ2 TRP 4 HZ2 TRP 4 -0.876 3.407 -9.031
27 HZ3 TRP 4 HZ3 TRP 4 -4.768 2.540 -7.479
28 HH2 TRP 4 HH2 TRP 4 -3.164 2.565 -9.346
29 H ALA 5 H ALA 5 -2.121 2.064 -3.145
30 HA ALA 5 HA ALA 5 -1.452 -0.013 -3.868
31 HB1 ALA 5 HB1 ALA 5 0.256 -0.028 -5.331
32 HB2 ALA 5 HB2 ALA 5 0.369 1.715 -4.987
33 HB3 ALA 5 HB3 ALA 5 1.420 0.566 -4.124
34 H VAL 6 H VAL 6 -1.391 0.721 -1.047
35 HA VAL 6 HA VAL 6 0.872 -0.886 -0.005
36 HB VAL 6 HB VAL 6 0.174 -0.140 2.203
37 HG11 VAL 6 HG11 VAL 6 1.619 1.336 0.861
38 HG12 VAL 6 HG12 VAL 6 0.566 2.260 1.960
39 HG13 VAL 6 HG13 VAL 6 0.176 2.163 0.226
40 HG21 VAL 6 HG21 VAL 6 -2.260 -0.173 1.819
41 HG22 VAL 6 HG22 VAL 6 -1.722 1.370 2.525
42 HG23 VAL 6 HG23 VAL 6 -2.112 1.272 0.791
43 H GLY 7 H GLY 7 -1.487 -1.998 -1.529
44 HA2 GLY 7 HA2 GLY 7 -2.225 -3.994 0.561
45 HA3 GLY 7 HA3 GLY 7 -3.460 -3.314 -0.517
46 H HIS 8 H HIS 8 -0.126 -4.197 -1.368
47 HA HIS 8 HA HIS 8 -1.173 -6.539 -2.877
48 HB2 HIS 8 HB3 HIS 8 0.785 -4.591 -4.114
49 HB3 HIS 8 HB2 HIS 8 -0.099 -5.915 -4.894
50 HD2 HIS 8 HD2 HIS 8 -0.294 -2.254 -4.907
51 HE1 HIS 8 HE1 HIS 8 -4.350 -3.478 -5.112
52 HE2 HIS 8 HE2 HIS 8 -2.759 -1.512 -5.419
53 H LEU 9 H LEU 9 1.811 -4.698 -2.117
54 HA LEU 9 HA LEU 9 3.532 -6.981 -2.300
55 HB2 LEU 9 HB2 LEU 9 3.833 -4.248 -1.992
56 HB3 LEU 9 HB3 LEU 9 4.399 -4.882 -0.443
57 HG LEU 9 HG LEU 9 5.734 -6.517 -2.141
58 HD11 LEU 9 HD11 LEU 9 4.839 -5.372 -4.132
59 HD12 LEU 9 HD12 LEU 9 5.541 -3.840 -3.560
60 HD13 LEU 9 HD13 LEU 9 6.606 -5.194 -4.006
61 HD21 LEU 9 HD21 LEU 9 6.669 -5.203 -0.278
62 HD22 LEU 9 HD22 LEU 9 7.683 -5.095 -1.737
63 HD23 LEU 9 HD23 LEU 9 6.618 -3.740 -1.291
64 H MET 10 H MET 10 1.826 -5.435 0.411
65 HA MET 10 HA MET 10 2.393 -7.885 2.011
66 HB2 MET 10 HB3 MET 10 2.701 -6.520 4.018
67 HB3 MET 10 HB2 MET 10 3.907 -6.123 2.781
68 HG2 MET 10 HG2 MET 10 1.427 -4.490 2.784
69 HG3 MET 10 HG3 MET 10 2.525 -4.268 4.160
70 HE1 MET 10 HE1 MET 10 2.791 -2.111 0.334
71 HE2 MET 10 HE2 MET 10 1.785 -3.573 0.457
72 HE3 MET 10 HE3 MET 10 1.566 -2.242 1.618
Start of MODEL 5
1 H1 GLY 1 H1 GLY 1 9.704 8.148 -4.352
2 H2 GLY 1 H2 GLY 1 8.514 7.760 -5.426
3 H3 GLY 1 H3 GLY 1 8.408 9.149 -4.544
4 HA2 GLY 1 HA2 GLY 1 8.342 6.434 -3.481
5 HA3 GLY 1 HA3 GLY 1 8.232 7.925 -2.525
6 H ASN 2 H ASN 2 6.354 5.625 -2.909
7 HA ASN 2 HA ASN 2 4.016 7.217 -3.881
8 HB2 ASN 2 HB2 ASN 2 2.958 5.051 -4.468
9 HB3 ASN 2 HB3 ASN 2 4.425 5.383 -5.409
10 HD21 ASN 2 HD21 ASN 2 3.135 3.581 -2.612
11 HD22 ASN 2 HD22 ASN 2 4.313 2.289 -2.669
12 H HIS 3 H HIS 3 2.067 7.027 -2.750
13 HA HIS 3 HA HIS 3 2.443 6.140 0.067
14 HB2 HIS 3 HB3 HIS 3 1.665 8.525 -0.684
15 HB3 HIS 3 HB2 HIS 3 0.098 7.735 -0.927
16 HD2 HIS 3 HD2 HIS 3 2.218 6.643 2.156
17 HE1 HIS 3 HE1 HIS 3 -1.016 9.016 3.532
18 HE2 HIS 3 HE2 HIS 3 0.908 7.512 4.256
19 H TRP 4 H TRP 4 0.243 5.866 -2.716
20 HA TRP 4 HA TRP 4 -1.524 4.012 -1.316
21 HB2 TRP 4 HB2 TRP 4 -2.815 3.996 -3.264
22 HB3 TRP 4 HB3 TRP 4 -2.145 5.636 -3.210
23 HD1 TRP 4 HD1 TRP 4 0.708 5.103 -4.503
24 HE1 TRP 4 HE1 TRP 4 0.926 4.494 -7.003
25 HE3 TRP 4 HE3 TRP 4 -4.035 3.373 -5.285
26 HZ2 TRP 4 HZ2 TRP 4 -0.722 3.421 -9.012
27 HZ3 TRP 4 HZ3 TRP 4 -4.644 2.566 -7.530
28 HH2 TRP 4 HH2 TRP 4 -3.008 2.591 -9.368
29 H ALA 5 H ALA 5 -2.078 2.071 -3.155
30 HA ALA 5 HA ALA 5 -1.406 -0.010 -3.866
31 HB1 ALA 5 HB1 ALA 5 0.327 -0.030 -5.297
32 HB2 ALA 5 HB2 ALA 5 0.443 1.711 -4.946
33 HB3 ALA 5 HB3 ALA 5 1.472 0.555 -4.067
34 H VAL 6 H VAL 6 -1.401 0.708 -1.044
35 HA VAL 6 HA VAL 6 0.839 -0.904 0.037
36 HB VAL 6 HB VAL 6 0.040 -0.184 2.244
37 HG11 VAL 6 HG11 VAL 6 1.634 1.223 1.003
38 HG12 VAL 6 HG12 VAL 6 0.567 2.192 2.047
39 HG13 VAL 6 HG13 VAL 6 0.275 2.127 0.293
40 HG21 VAL 6 HG21 VAL 6 -2.365 -0.092 1.719
41 HG22 VAL 6 HG22 VAL 6 -2.085 1.351 0.715
42 HG23 VAL 6 HG23 VAL 6 -1.793 1.417 2.469
43 H GLY 7 H GLY 7 -1.495 -2.003 -1.537
44 HA2 GLY 7 HA2 GLY 7 -2.278 -4.004 0.530
45 HA3 GLY 7 HA3 GLY 7 -3.489 -3.318 -0.570
46 H HIS 8 H HIS 8 -0.142 -4.208 -1.360
47 HA HIS 8 HA HIS 8 -1.166 -6.539 -2.898
48 HB2 HIS 8 HB2 HIS 8 0.817 -4.584 -4.077
49 HB3 HIS 8 HB3 HIS 8 -0.036 -5.907 -4.892
50 HD2 HIS 8 HD2 HIS 8 -0.235 -2.248 -4.890
51 HE1 HIS 8 HE1 HIS 8 -4.287 -3.461 -5.182
52 HE2 HIS 8 HE2 HIS 8 -2.686 -1.500 -5.450
53 H LEU 9 H LEU 9 1.808 -4.710 -2.070
54 HA LEU 9 HA LEU 9 3.527 -6.996 -2.229
55 HB2 LEU 9 HB3 LEU 9 3.830 -4.255 -1.884
56 HB3 LEU 9 HB2 LEU 9 4.371 -4.929 -0.342
57 HG LEU 9 HG LEU 9 5.724 -6.540 -2.028
58 HD11 LEU 9 HD11 LEU 9 4.875 -5.378 -4.028
59 HD12 LEU 9 HD12 LEU 9 5.573 -3.853 -3.432
60 HD13 LEU 9 HD13 LEU 9 6.639 -5.210 -3.865
61 HD21 LEU 9 HD21 LEU 9 6.629 -5.242 -0.137
62 HD22 LEU 9 HD22 LEU 9 6.605 -3.773 -1.142
63 HD23 LEU 9 HD23 LEU 9 7.672 -5.130 -1.576
64 H MET 10 H MET 10 1.817 -5.428 0.473
65 HA MET 10 HA MET 10 2.335 -7.893 2.073
66 HB2 MET 10 HB2 MET 10 2.574 -6.518 4.087
67 HB3 MET 10 HB3 MET 10 3.831 -6.147 2.895
68 HG2 MET 10 HG3 MET 10 1.360 -4.484 2.820
69 HG3 MET 10 HG2 MET 10 2.439 -4.268 4.211
70 HE1 MET 10 HE1 MET 10 2.799 -2.125 0.389
71 HE2 MET 10 HE2 MET 10 1.774 -3.576 0.496
72 HE3 MET 10 HE3 MET 10 1.548 -2.239 1.650
Start of MODEL 6
1 H1 GLY 1 H1 GLY 1 9.094 9.417 -1.030
2 H2 GLY 1 H2 GLY 1 7.769 9.989 -1.828
3 H3 GLY 1 H3 GLY 1 7.581 9.037 -0.494
4 HA2 GLY 1 HA2 GLY 1 8.767 8.221 -3.032
5 HA3 GLY 1 HA3 GLY 1 8.572 7.192 -1.599
6 H ASN 2 H ASN 2 6.884 5.882 -1.643
7 HA ASN 2 HA ASN 2 4.619 6.586 -3.445
8 HB2 ASN 2 HB2 ASN 2 4.097 4.246 -3.505
9 HB3 ASN 2 HB3 ASN 2 5.837 4.420 -3.802
10 HD21 ASN 2 HD21 ASN 2 3.425 2.900 -1.940
11 HD22 ASN 2 HD22 ASN 2 4.458 2.180 -0.726
12 H HIS 3 H HIS 3 2.460 6.308 -2.765
13 HA HIS 3 HA HIS 3 2.135 6.398 0.208
14 HB2 HIS 3 HB2 HIS 3 1.683 8.499 -1.326
15 HB3 HIS 3 HB3 HIS 3 0.155 7.666 -1.655
16 HD2 HIS 3 HD2 HIS 3 1.509 7.367 1.968
17 HE1 HIS 3 HE1 HIS 3 -1.646 10.203 1.986
18 HE2 HIS 3 HE2 HIS 3 -0.077 8.834 3.457
19 H TRP 4 H TRP 4 0.191 5.860 -2.763
20 HA TRP 4 HA TRP 4 -1.561 4.012 -1.324
21 HB2 TRP 4 HB2 TRP 4 -2.881 3.985 -3.251
22 HB3 TRP 4 HB3 TRP 4 -2.223 5.630 -3.211
23 HD1 TRP 4 HD1 TRP 4 0.615 5.118 -4.547
24 HE1 TRP 4 HE1 TRP 4 0.797 4.507 -7.049
25 HE3 TRP 4 HE3 TRP 4 -4.127 3.346 -5.252
26 HZ2 TRP 4 HZ2 TRP 4 -0.874 3.417 -9.030
27 HZ3 TRP 4 HZ3 TRP 4 -4.766 2.534 -7.487
28 HH2 TRP 4 HH2 TRP 4 -3.157 2.567 -9.350
29 H ALA 5 H ALA 5 -2.127 2.065 -3.150
30 HA ALA 5 HA ALA 5 -1.450 -0.012 -3.871
31 HB1 ALA 5 HB1 ALA 5 0.261 -0.018 -5.331
32 HB2 ALA 5 HB2 ALA 5 0.367 1.724 -4.983
33 HB3 ALA 5 HB3 ALA 5 1.421 0.578 -4.120
34 H VAL 6 H VAL 6 -1.393 0.723 -1.049
35 HA VAL 6 HA VAL 6 0.870 -0.879 -0.005
36 HB VAL 6 HB VAL 6 0.162 -0.137 2.203
37 HG11 VAL 6 HG11 VAL 6 1.620 1.333 0.872
38 HG12 VAL 6 HG12 VAL 6 0.565 2.259 1.967
39 HG13 VAL 6 HG13 VAL 6 0.184 2.167 0.231
40 HG21 VAL 6 HG21 VAL 6 -2.269 -0.163 1.806
41 HG22 VAL 6 HG22 VAL 6 -1.729 1.377 2.518
42 HG23 VAL 6 HG23 VAL 6 -2.111 1.285 0.782
43 H GLY 7 H GLY 7 -1.493 -1.989 -1.530
44 HA2 GLY 7 HA3 GLY 7 -2.239 -3.987 0.561
45 HA3 GLY 7 HA2 GLY 7 -3.460 -3.309 -0.533
46 H HIS 8 H HIS 8 -0.124 -4.191 -1.364
47 HA HIS 8 HA HIS 8 -1.164 -6.534 -2.877
48 HB2 HIS 8 HB2 HIS 8 0.792 -4.577 -4.097
49 HB3 HIS 8 HB3 HIS 8 -0.070 -5.906 -4.892
50 HD2 HIS 8 HD2 HIS 8 -0.281 -2.250 -4.904
51 HE1 HIS 8 HE1 HIS 8 -4.336 -3.480 -5.122
52 HE2 HIS 8 HE2 HIS 8 -2.746 -1.512 -5.426
53 H LEU 9 H LEU 9 1.825 -4.693 -2.137
54 HA LEU 9 HA LEU 9 3.552 -6.963 -2.308
55 HB2 LEU 9 HB2 LEU 9 3.839 -4.234 -1.972
56 HB3 LEU 9 HB3 LEU 9 4.396 -4.880 -0.424
57 HG LEU 9 HG LEU 9 5.748 -6.494 -2.130
58 HD11 LEU 9 HD11 LEU 9 4.866 -5.327 -4.114
59 HD12 LEU 9 HD12 LEU 9 5.559 -3.800 -3.517
60 HD13 LEU 9 HD13 LEU 9 6.631 -5.146 -3.972
61 HD21 LEU 9 HD21 LEU 9 6.667 -5.199 -0.244
62 HD22 LEU 9 HD22 LEU 9 6.619 -3.725 -1.239
63 HD23 LEU 9 HD23 LEU 9 7.691 -5.070 -1.694
64 H MET 10 H MET 10 1.795 -5.470 0.395
65 HA MET 10 HA MET 10 2.391 -7.921 1.985
66 HB2 MET 10 HB2 MET 10 2.609 -6.553 4.007
67 HB3 MET 10 HB3 MET 10 3.854 -6.149 2.812
68 HG2 MET 10 HG2 MET 10 1.350 -4.544 2.746
69 HG3 MET 10 HG3 MET 10 2.416 -4.307 4.145
70 HE1 MET 10 HE1 MET 10 2.731 -2.145 0.325
71 HE2 MET 10 HE2 MET 10 1.483 -2.292 1.585
72 HE3 MET 10 HE3 MET 10 1.741 -3.621 0.429
Start of MODEL 7
1 H1 GLY 1 H1 GLY 1 9.472 6.220 -2.194
2 H2 GLY 1 H2 GLY 1 8.421 5.318 -3.088
3 H3 GLY 1 H3 GLY 1 8.241 5.412 -1.452
4 HA2 GLY 1 HA3 GLY 1 7.501 7.544 -1.469
5 HA3 GLY 1 HA2 GLY 1 8.147 7.790 -3.103
6 H ASN 2 H ASN 2 6.199 5.078 -1.859
7 HA ASN 2 HA ASN 2 4.104 5.847 -3.850
8 HB2 ASN 2 HB2 ASN 2 4.948 3.093 -2.886
9 HB3 ASN 2 HB3 ASN 2 3.552 3.412 -3.933
10 HD21 ASN 2 HD21 ASN 2 6.524 2.194 -4.048
11 HD22 ASN 2 HD22 ASN 2 7.055 2.727 -5.627
12 H HIS 3 H HIS 3 2.884 7.083 -2.426
13 HA HIS 3 HA HIS 3 2.153 6.403 0.200
14 HB2 HIS 3 HB3 HIS 3 1.725 8.589 -0.894
15 HB3 HIS 3 HB2 HIS 3 0.457 7.829 -1.870
16 HD2 HIS 3 HD2 HIS 3 0.283 6.557 1.711
17 HE1 HIS 3 HE1 HIS 3 -2.470 9.774 1.434
18 HE2 HIS 3 HE2 HIS 3 -1.694 7.826 2.883
19 H TRP 4 H TRP 4 0.240 5.832 -2.784
20 HA TRP 4 HA TRP 4 -1.543 4.017 -1.325
21 HB2 TRP 4 HB2 TRP 4 -2.867 3.991 -3.250
22 HB3 TRP 4 HB3 TRP 4 -2.202 5.634 -3.213
23 HD1 TRP 4 HD1 TRP 4 0.631 5.108 -4.554
24 HE1 TRP 4 HE1 TRP 4 0.805 4.490 -7.054
25 HE3 TRP 4 HE3 TRP 4 -4.120 3.355 -5.245
26 HZ2 TRP 4 HZ2 TRP 4 -0.873 3.403 -9.029
27 HZ3 TRP 4 HZ3 TRP 4 -4.766 2.539 -7.479
28 HH2 TRP 4 HH2 TRP 4 -3.160 2.563 -9.344
29 H ALA 5 H ALA 5 -2.121 2.068 -3.146
30 HA ALA 5 HA ALA 5 -1.454 -0.011 -3.863
31 HB1 ALA 5 HB1 ALA 5 0.255 -0.030 -5.325
32 HB2 ALA 5 HB2 ALA 5 0.371 1.712 -4.982
33 HB3 ALA 5 HB3 ALA 5 1.419 0.563 -4.116
34 H VAL 6 H VAL 6 -1.401 0.714 -1.045
35 HA VAL 6 HA VAL 6 0.864 -0.886 0.002
36 HB VAL 6 HB VAL 6 0.146 -0.147 2.212
37 HG11 VAL 6 HG11 VAL 6 1.620 1.318 0.889
38 HG12 VAL 6 HG12 VAL 6 0.563 2.249 1.978
39 HG13 VAL 6 HG13 VAL 6 0.191 2.159 0.239
40 HG21 VAL 6 HG21 VAL 6 -2.282 -0.157 1.800
41 HG22 VAL 6 HG22 VAL 6 -1.738 1.379 2.515
42 HG23 VAL 6 HG23 VAL 6 -2.109 1.289 0.776
43 H GLY 7 H GLY 7 -1.490 -2.001 -1.527
44 HA2 GLY 7 HA2 GLY 7 -2.229 -4.000 0.558
45 HA3 GLY 7 HA3 GLY 7 -3.462 -3.321 -0.522
46 H HIS 8 H HIS 8 -0.126 -4.198 -1.368
47 HA HIS 8 HA HIS 8 -1.167 -6.538 -2.882
48 HB2 HIS 8 HB2 HIS 8 0.785 -4.577 -4.102
49 HB3 HIS 8 HB3 HIS 8 -0.078 -5.906 -4.898
50 HD2 HIS 8 HD2 HIS 8 -0.289 -2.250 -4.902
51 HE1 HIS 8 HE1 HIS 8 -4.344 -3.480 -5.117
52 HE2 HIS 8 HE2 HIS 8 -2.754 -1.510 -5.418
53 H LEU 9 H LEU 9 1.817 -4.694 -2.126
54 HA LEU 9 HA LEU 9 3.544 -6.968 -2.310
55 HB2 LEU 9 HB3 LEU 9 3.836 -4.226 -1.959
56 HB3 LEU 9 HB2 LEU 9 4.404 -4.901 -0.428
57 HG LEU 9 HG LEU 9 5.752 -6.497 -2.118
58 HD11 LEU 9 HD11 LEU 9 4.851 -5.378 -4.120
59 HD12 LEU 9 HD12 LEU 9 5.534 -3.834 -3.557
60 HD13 LEU 9 HD13 LEU 9 6.615 -5.180 -3.990
61 HD21 LEU 9 HD21 LEU 9 6.669 -5.158 -0.263
62 HD22 LEU 9 HD22 LEU 9 6.604 -3.704 -1.288
63 HD23 LEU 9 HD23 LEU 9 7.685 -5.051 -1.720
64 H MET 10 H MET 10 1.786 -5.475 0.391
65 HA MET 10 HA MET 10 2.359 -7.933 1.975
66 HB2 MET 10 HB2 MET 10 2.663 -6.592 3.995
67 HB3 MET 10 HB3 MET 10 3.882 -6.187 2.774
68 HG2 MET 10 HG2 MET 10 1.394 -4.549 2.818
69 HG3 MET 10 HG3 MET 10 2.525 -4.340 4.168
70 HE1 MET 10 HE1 MET 10 2.694 -2.123 0.378
71 HE2 MET 10 HE2 MET 10 1.679 -3.579 0.508
72 HE3 MET 10 HE3 MET 10 1.511 -2.268 1.700
Start of MODEL 8
1 H1 GLY 1 H1 GLY 1 9.028 3.958 0.437
2 H2 GLY 1 H2 GLY 1 7.427 4.312 0.617
3 H3 GLY 1 H3 GLY 1 8.490 5.496 0.184
4 HA2 GLY 1 HA2 GLY 1 8.948 4.426 -1.869
5 HA3 GLY 1 HA3 GLY 1 7.809 3.147 -1.408
6 H ASN 2 H ASN 2 5.721 3.365 -1.931
7 HA ASN 2 HA ASN 2 4.891 6.018 -3.025
8 HB2 ASN 2 HB2 ASN 2 4.976 3.790 -4.445
9 HB3 ASN 2 HB3 ASN 2 3.429 3.465 -3.638
10 HD21 ASN 2 HD21 ASN 2 3.916 3.915 -6.481
11 HD22 ASN 2 HD22 ASN 2 2.988 5.329 -6.928
12 H HIS 3 H HIS 3 2.985 6.945 -2.407
13 HA HIS 3 HA HIS 3 2.055 6.488 0.214
14 HB2 HIS 3 HB3 HIS 3 1.746 8.533 -1.315
15 HB3 HIS 3 HB2 HIS 3 0.348 7.669 -1.976
16 HD2 HIS 3 HD2 HIS 3 0.039 6.708 1.519
17 HE1 HIS 3 HE1 HIS 3 -1.692 10.580 1.419
18 HE2 HIS 3 HE2 HIS 3 -1.464 8.444 2.790
19 H TRP 4 H TRP 4 0.207 5.841 -2.795
20 HA TRP 4 HA TRP 4 -1.557 4.017 -1.325
21 HB2 TRP 4 HB2 TRP 4 -2.894 3.986 -3.243
22 HB3 TRP 4 HB3 TRP 4 -2.234 5.631 -3.211
23 HD1 TRP 4 HD1 TRP 4 0.593 5.114 -4.570
24 HE1 TRP 4 HE1 TRP 4 0.755 4.496 -7.071
25 HE3 TRP 4 HE3 TRP 4 -4.156 3.346 -5.233
26 HZ2 TRP 4 HZ2 TRP 4 -0.932 3.404 -9.035
27 HZ3 TRP 4 HZ3 TRP 4 -4.811 2.527 -7.460
28 HH2 TRP 4 HH2 TRP 4 -3.218 2.557 -9.337
29 H ALA 5 H ALA 5 -2.140 2.066 -3.143
30 HA ALA 5 HA ALA 5 -1.471 -0.012 -3.866
31 HB1 ALA 5 HB1 ALA 5 0.231 -0.023 -5.338
32 HB2 ALA 5 HB2 ALA 5 0.342 1.719 -4.995
33 HB3 ALA 5 HB3 ALA 5 1.399 0.574 -4.136
34 H VAL 6 H VAL 6 -1.397 0.721 -1.047
35 HA VAL 6 HA VAL 6 0.876 -0.876 -0.015
36 HB VAL 6 HB VAL 6 0.186 -0.132 2.196
37 HG11 VAL 6 HG11 VAL 6 1.619 1.349 0.847
38 HG12 VAL 6 HG12 VAL 6 0.170 2.169 0.219
39 HG13 VAL 6 HG13 VAL 6 0.568 2.269 1.951
40 HG21 VAL 6 HG21 VAL 6 -1.712 1.412 2.495
41 HG22 VAL 6 HG22 VAL 6 -2.129 1.222 0.775
42 HG23 VAL 6 HG23 VAL 6 -2.236 -0.173 1.876
43 H GLY 7 H GLY 7 -1.493 -1.991 -1.525
44 HA2 GLY 7 HA3 GLY 7 -2.224 -3.990 0.570
45 HA3 GLY 7 HA2 GLY 7 -3.452 -3.314 -0.518
46 H HIS 8 H HIS 8 -0.120 -4.191 -1.369
47 HA HIS 8 HA HIS 8 -1.165 -6.536 -2.874
48 HB2 HIS 8 HB3 HIS 8 0.783 -4.580 -4.115
49 HB3 HIS 8 HB2 HIS 8 -0.095 -5.909 -4.893
50 HD2 HIS 8 HD2 HIS 8 -0.306 -2.251 -4.911
51 HE1 HIS 8 HE1 HIS 8 -4.358 -3.488 -5.099
52 HE2 HIS 8 HE2 HIS 8 -2.775 -1.518 -5.414
53 H LEU 9 H LEU 9 1.825 -4.686 -2.151
54 HA LEU 9 HA LEU 9 3.553 -6.956 -2.333
55 HB2 LEU 9 HB2 LEU 9 3.840 -4.226 -2.011
56 HB3 LEU 9 HB3 LEU 9 4.410 -4.864 -0.465
57 HG LEU 9 HG LEU 9 5.762 -6.482 -2.152
58 HD11 LEU 9 HD11 LEU 9 4.842 -5.377 -4.153
59 HD12 LEU 9 HD12 LEU 9 6.606 -5.173 -4.038
60 HD13 LEU 9 HD13 LEU 9 5.525 -3.827 -3.605
61 HD21 LEU 9 HD21 LEU 9 6.689 -5.130 -0.312
62 HD22 LEU 9 HD22 LEU 9 7.694 -5.027 -1.777
63 HD23 LEU 9 HD23 LEU 9 6.612 -3.681 -1.344
64 H MET 10 H MET 10 2.030 -5.331 0.462
65 HA MET 10 HA MET 10 2.560 -7.821 2.029
66 HB2 MET 10 HB2 MET 10 2.838 -6.442 4.031
67 HB3 MET 10 HB3 MET 10 4.053 -6.047 2.802
68 HG2 MET 10 HG2 MET 10 1.549 -4.436 2.807
69 HG3 MET 10 HG3 MET 10 2.669 -4.190 4.160
70 HE1 MET 10 HE1 MET 10 2.839 -2.044 0.330
71 HE2 MET 10 HE2 MET 10 1.649 -2.177 1.647
72 HE3 MET 10 HE3 MET 10 1.840 -3.509 0.482
Start of MODEL 9
1 H1 GLY 1 H1 GLY 1 6.240 0.837 -3.973
2 H2 GLY 1 H2 GLY 1 5.628 1.944 -5.032
3 H3 GLY 1 H3 GLY 1 4.973 1.794 -3.525
4 HA2 GLY 1 HA3 GLY 1 7.253 2.357 -2.671
5 HA3 GLY 1 HA2 GLY 1 7.506 2.949 -4.325
6 H ASN 2 H ASN 2 4.534 3.608 -4.439
7 HA ASN 2 HA ASN 2 4.851 6.323 -3.358
8 HB2 ASN 2 HB2 ASN 2 2.666 5.004 -4.998
9 HB3 ASN 2 HB3 ASN 2 2.638 6.703 -4.485
10 HD21 ASN 2 HD21 ASN 2 3.903 4.372 -6.725
11 HD22 ASN 2 HD22 ASN 2 4.849 5.482 -7.692
12 H HIS 3 H HIS 3 2.689 7.285 -2.448
13 HA HIS 3 HA HIS 3 2.325 6.246 0.138
14 HB2 HIS 3 HB2 HIS 3 1.659 8.537 -0.978
15 HB3 HIS 3 HB3 HIS 3 0.097 7.735 -1.216
16 HD2 HIS 3 HD2 HIS 3 2.058 7.069 2.097
17 HE1 HIS 3 HE1 HIS 3 -1.260 9.562 2.981
18 HE2 HIS 3 HE2 HIS 3 0.636 8.194 3.995
19 H TRP 4 H TRP 4 0.243 5.855 -2.745
20 HA TRP 4 HA TRP 4 -1.533 4.021 -1.322
21 HB2 TRP 4 HB2 TRP 4 -2.836 4.000 -3.263
22 HB3 TRP 4 HB3 TRP 4 -2.165 5.640 -3.218
23 HD1 TRP 4 HD1 TRP 4 0.681 5.102 -4.525
24 HE1 TRP 4 HE1 TRP 4 0.885 4.486 -7.023
25 HE3 TRP 4 HE3 TRP 4 -4.067 3.369 -5.274
26 HZ2 TRP 4 HZ2 TRP 4 -0.776 3.405 -9.019
27 HZ3 TRP 4 HZ3 TRP 4 -4.689 2.557 -7.514
28 HH2 TRP 4 HH2 TRP 4 -3.061 2.572 -9.360
29 H ALA 5 H ALA 5 -2.098 2.074 -3.150
30 HA ALA 5 HA ALA 5 -1.431 -0.009 -3.860
31 HB1 ALA 5 HB1 ALA 5 0.296 -0.032 -5.303
32 HB2 ALA 5 HB2 ALA 5 0.413 1.710 -4.958
33 HB3 ALA 5 HB3 ALA 5 1.448 0.557 -4.082
34 H VAL 6 H VAL 6 -1.410 0.714 -1.042
35 HA VAL 6 HA VAL 6 0.838 -0.892 0.032
36 HB VAL 6 HB VAL 6 0.071 -0.161 2.239
37 HG11 VAL 6 HG11 VAL 6 1.604 1.279 0.958
38 HG12 VAL 6 HG12 VAL 6 0.536 2.228 2.020
39 HG13 VAL 6 HG13 VAL 6 0.209 2.145 0.272
40 HG21 VAL 6 HG21 VAL 6 -2.344 -0.130 1.763
41 HG22 VAL 6 HG22 VAL 6 -2.121 1.313 0.746
42 HG23 VAL 6 HG23 VAL 6 -1.794 1.396 2.494
43 H GLY 7 H GLY 7 -1.484 -2.012 -1.532
44 HA2 GLY 7 HA2 GLY 7 -2.255 -4.011 0.541
45 HA3 GLY 7 HA3 GLY 7 -3.476 -3.328 -0.550
46 H HIS 8 H HIS 8 -0.133 -4.201 -1.365
47 HA HIS 8 HA HIS 8 -1.157 -6.540 -2.896
48 HB2 HIS 8 HB2 HIS 8 0.807 -4.576 -4.091
49 HB3 HIS 8 HB3 HIS 8 -0.049 -5.901 -4.899
50 HD2 HIS 8 HD2 HIS 8 -0.259 -2.245 -4.898
51 HE1 HIS 8 HE1 HIS 8 -4.312 -3.470 -5.150
52 HE2 HIS 8 HE2 HIS 8 -2.720 -1.504 -5.434
53 H LEU 9 H LEU 9 1.804 -4.695 -2.063
54 HA LEU 9 HA LEU 9 3.533 -6.980 -2.240
55 HB2 LEU 9 HB2 LEU 9 3.832 -4.246 -1.938
56 HB3 LEU 9 HB3 LEU 9 4.382 -4.876 -0.381
57 HG LEU 9 HG LEU 9 5.754 -6.514 -2.014
58 HD11 LEU 9 HD11 LEU 9 4.837 -5.485 -4.057
59 HD12 LEU 9 HD12 LEU 9 5.509 -3.913 -3.560
60 HD13 LEU 9 HD13 LEU 9 6.600 -5.267 -3.941
61 HD21 LEU 9 HD21 LEU 9 6.665 -5.091 -0.217
62 HD22 LEU 9 HD22 LEU 9 6.585 -3.681 -1.301
63 HD23 LEU 9 HD23 LEU 9 7.676 -5.035 -1.682
64 H MET 10 H MET 10 1.501 -5.664 0.292
65 HA MET 10 HA MET 10 2.705 -7.520 2.276
66 HB2 MET 10 HB3 MET 10 0.503 -5.496 2.750
67 HB3 MET 10 HB2 MET 10 1.536 -6.295 3.948
68 HG2 MET 10 HG3 MET 10 2.939 -4.580 3.861
69 HG3 MET 10 HG2 MET 10 3.271 -4.964 2.161
70 HE1 MET 10 HE1 MET 10 2.349 -1.804 0.523
71 HE2 MET 10 HE2 MET 10 2.636 -3.531 0.202
72 HE3 MET 10 HE3 MET 10 3.747 -2.626 1.256
Start of MODEL 10
1 H1 GLY 1 H1 GLY 1 7.552 0.724 -1.714
2 H2 GLY 1 H2 GLY 1 6.228 1.403 -1.002
3 H3 GLY 1 H3 GLY 1 6.470 1.574 -2.624
4 HA2 GLY 1 HA2 GLY 1 7.903 2.799 -0.418
5 HA3 GLY 1 HA3 GLY 1 8.614 2.686 -2.040
6 H ASN 2 H ASN 2 5.172 2.955 -1.834
7 HA ASN 2 HA ASN 2 5.362 5.881 -2.401
8 HB2 ASN 2 HB3 ASN 2 4.906 4.095 -4.373
9 HB3 ASN 2 HB2 ASN 2 3.246 4.304 -3.783
10 HD21 ASN 2 HD21 ASN 2 2.130 6.171 -4.205
11 HD22 ASN 2 HD22 ASN 2 2.774 7.486 -5.162
12 H HIS 3 H HIS 3 2.998 6.806 -2.446
13 HA HIS 3 HA HIS 3 1.992 6.551 0.213
14 HB2 HIS 3 HB2 HIS 3 1.780 8.520 -1.401
15 HB3 HIS 3 HB3 HIS 3 0.439 7.635 -2.147
16 HD2 HIS 3 HD2 HIS 3 -0.051 6.863 1.413
17 HE1 HIS 3 HE1 HIS 3 -1.918 10.643 0.924
18 HE2 HIS 3 HE2 HIS 3 -1.687 8.627 2.466
19 H TRP 4 H TRP 4 0.202 5.837 -2.811
20 HA TRP 4 HA TRP 4 -1.560 4.020 -1.331
21 HB2 TRP 4 HB2 TRP 4 -2.905 3.986 -3.240
22 HB3 TRP 4 HB3 TRP 4 -2.246 5.631 -3.213
23 HD1 TRP 4 HD1 TRP 4 0.574 5.114 -4.584
24 HE1 TRP 4 HE1 TRP 4 0.726 4.491 -7.086
25 HE3 TRP 4 HE3 TRP 4 -4.175 3.341 -5.223
26 HZ2 TRP 4 HZ2 TRP 4 -0.969 3.397 -9.042
27 HZ3 TRP 4 HZ3 TRP 4 -4.841 2.522 -7.448
28 HH2 TRP 4 HH2 TRP 4 -3.257 2.547 -9.331
29 H ALA 5 H ALA 5 -2.150 2.066 -3.143
30 HA ALA 5 HA ALA 5 -1.483 -0.013 -3.864
31 HB1 ALA 5 HB1 ALA 5 0.210 -0.026 -5.345
32 HB2 ALA 5 HB2 ALA 5 0.322 1.718 -5.004
33 HB3 ALA 5 HB3 ALA 5 1.385 0.574 -4.149
34 H VAL 6 H VAL 6 -1.399 0.723 -1.046
35 HA VAL 6 HA VAL 6 0.881 -0.870 -0.022
36 HB VAL 6 HB VAL 6 0.220 -0.115 2.184
37 HG11 VAL 6 HG11 VAL 6 1.600 1.387 0.808
38 HG12 VAL 6 HG12 VAL 6 0.126 2.181 0.205
39 HG13 VAL 6 HG13 VAL 6 0.554 2.290 1.929
40 HG21 VAL 6 HG21 VAL 6 -2.220 -0.204 1.856
41 HG22 VAL 6 HG22 VAL 6 -1.700 1.351 2.548
42 HG23 VAL 6 HG23 VAL 6 -2.129 1.243 0.824
43 H GLY 7 H GLY 7 -1.488 -1.996 -1.523
44 HA2 GLY 7 HA2 GLY 7 -2.197 -3.993 0.577
45 HA3 GLY 7 HA3 GLY 7 -3.445 -3.320 -0.490
46 H HIS 8 H HIS 8 -0.116 -4.189 -1.372
47 HA HIS 8 HA HIS 8 -1.166 -6.537 -2.869
48 HB2 HIS 8 HB2 HIS 8 0.766 -4.574 -4.119
49 HB3 HIS 8 HB3 HIS 8 -0.103 -5.907 -4.900
50 HD2 HIS 8 HD2 HIS 8 -0.325 -2.252 -4.915
51 HE1 HIS 8 HE1 HIS 8 -4.379 -3.493 -5.074
52 HE2 HIS 8 HE2 HIS 8 -2.799 -1.521 -5.400
53 H LEU 9 H LEU 9 1.825 -4.682 -2.167
54 HA LEU 9 HA LEU 9 3.557 -6.946 -2.361
55 HB2 LEU 9 HB2 LEU 9 3.839 -4.215 -2.030
56 HB3 LEU 9 HB3 LEU 9 4.417 -4.858 -0.488
57 HG LEU 9 HG LEU 9 5.768 -6.465 -2.183
58 HD11 LEU 9 HD11 LEU 9 4.835 -5.364 -4.180
59 HD12 LEU 9 HD12 LEU 9 6.599 -5.154 -4.072
60 HD13 LEU 9 HD13 LEU 9 5.515 -3.812 -3.636
61 HD21 LEU 9 HD21 LEU 9 6.695 -5.110 -0.345
62 HD22 LEU 9 HD22 LEU 9 7.695 -5.004 -1.814
63 HD23 LEU 9 HD23 LEU 9 6.611 -3.662 -1.378
64 H MET 10 H MET 10 1.981 -5.366 0.425
65 HA MET 10 HA MET 10 2.549 -7.850 1.987
66 HB2 MET 10 HB3 MET 10 2.839 -6.483 3.996
67 HB3 MET 10 HB2 MET 10 4.028 -6.059 2.752
68 HG2 MET 10 HG2 MET 10 1.508 -4.481 2.804
69 HG3 MET 10 HG3 MET 10 2.649 -4.228 4.139
70 HE1 MET 10 HE1 MET 10 2.736 -2.112 0.274
71 HE2 MET 10 HE2 MET 10 1.549 -2.261 1.592
72 HE3 MET 10 HE3 MET 10 1.779 -3.603 0.446
Start of MODEL 11
1 H1 GLY 1 H1 GLY 1 10.642 6.442 -0.750
2 H2 GLY 1 H2 GLY 1 9.924 6.692 -2.213
3 H3 GLY 1 H3 GLY 1 9.659 7.748 -0.973
4 HA2 GLY 1 HA2 GLY 1 8.892 4.936 -0.942
5 HA3 GLY 1 HA3 GLY 1 8.494 6.164 0.275
6 H ASN 2 H ASN 2 6.507 4.657 -0.873
7 HA ASN 2 HA ASN 2 5.241 6.561 -2.798
8 HB2 ASN 2 HB2 ASN 2 3.880 4.707 -3.571
9 HB3 ASN 2 HB3 ASN 2 5.596 4.266 -3.670
10 HD21 ASN 2 HD21 ASN 2 6.410 2.610 -2.402
11 HD22 ASN 2 HD22 ASN 2 5.395 1.573 -1.424
12 H HIS 3 H HIS 3 2.684 6.140 -2.666
13 HA HIS 3 HA HIS 3 1.983 6.563 0.210
14 HB2 HIS 3 HB2 HIS 3 1.779 8.537 -1.354
15 HB3 HIS 3 HB3 HIS 3 0.504 7.646 -2.202
16 HD2 HIS 3 HD2 HIS 3 -0.878 6.559 0.727
17 HE1 HIS 3 HE1 HIS 3 -1.606 10.713 1.191
18 HE2 HIS 3 HE2 HIS 3 -2.264 8.388 2.003
19 H TRP 4 H TRP 4 0.204 5.836 -2.815
20 HA TRP 4 HA TRP 4 -1.560 4.021 -1.330
21 HB2 TRP 4 HB2 TRP 4 -2.906 3.985 -3.242
22 HB3 TRP 4 HB3 TRP 4 -2.248 5.631 -3.216
23 HD1 TRP 4 HD1 TRP 4 0.575 5.112 -4.588
24 HE1 TRP 4 HE1 TRP 4 0.722 4.492 -7.088
25 HE3 TRP 4 HE3 TRP 4 -4.177 3.340 -5.222
26 HZ2 TRP 4 HZ2 TRP 4 -0.972 3.393 -9.042
27 HZ3 TRP 4 HZ3 TRP 4 -4.844 2.518 -7.445
28 HH2 TRP 4 HH2 TRP 4 -3.260 2.544 -9.329
29 H ALA 5 H ALA 5 -2.150 2.065 -3.140
30 HA ALA 5 HA ALA 5 -1.484 -0.014 -3.861
31 HB1 ALA 5 HB1 ALA 5 0.210 -0.028 -5.344
32 HB2 ALA 5 HB2 ALA 5 0.322 1.716 -5.005
33 HB3 ALA 5 HB3 ALA 5 1.385 0.573 -4.149
34 H VAL 6 H VAL 6 -1.404 0.717 -1.047
35 HA VAL 6 HA VAL 6 0.880 -0.871 -0.021
36 HB VAL 6 HB VAL 6 0.158 -0.138 2.200
37 HG11 VAL 6 HG11 VAL 6 1.668 1.294 0.884
38 HG12 VAL 6 HG12 VAL 6 0.261 2.163 0.226
39 HG13 VAL 6 HG13 VAL 6 0.624 2.248 1.966
40 HG21 VAL 6 HG21 VAL 6 -2.268 -0.104 1.774
41 HG22 VAL 6 HG22 VAL 6 -2.062 1.338 0.751
42 HG23 VAL 6 HG23 VAL 6 -1.699 1.423 2.491
43 H GLY 7 H GLY 7 -1.485 -1.999 -1.522
44 HA2 GLY 7 HA2 GLY 7 -2.195 -3.995 0.578
45 HA3 GLY 7 HA3 GLY 7 -3.444 -3.322 -0.489
46 H HIS 8 H HIS 8 -0.115 -4.191 -1.374
47 HA HIS 8 HA HIS 8 -1.168 -6.538 -2.869
48 HB2 HIS 8 HB3 HIS 8 0.768 -4.582 -4.129
49 HB3 HIS 8 HB2 HIS 8 -0.119 -5.911 -4.898
50 HD2 HIS 8 HD2 HIS 8 -0.330 -2.250 -4.912
51 HE1 HIS 8 HE1 HIS 8 -4.382 -3.494 -5.069
52 HE2 HIS 8 HE2 HIS 8 -2.805 -1.523 -5.399
53 H LEU 9 H LEU 9 1.821 -4.682 -2.160
54 HA LEU 9 HA LEU 9 3.554 -6.948 -2.359
55 HB2 LEU 9 HB2 LEU 9 3.837 -4.217 -2.036
56 HB3 LEU 9 HB3 LEU 9 4.418 -4.855 -0.493
57 HG LEU 9 HG LEU 9 5.775 -6.466 -2.166
58 HD11 LEU 9 HD11 LEU 9 4.820 -5.418 -4.181
59 HD12 LEU 9 HD12 LEU 9 5.486 -3.848 -3.674
60 HD13 LEU 9 HD13 LEU 9 6.583 -5.187 -4.089
61 HD21 LEU 9 HD21 LEU 9 6.702 -5.060 -0.365
62 HD22 LEU 9 HD22 LEU 9 6.594 -3.637 -1.428
63 HD23 LEU 9 HD23 LEU 9 7.691 -4.976 -1.844
64 H MET 10 H MET 10 2.123 -5.292 0.476
65 HA MET 10 HA MET 10 2.679 -7.781 2.037
66 HB2 MET 10 HB3 MET 10 2.860 -6.347 4.042
67 HB3 MET 10 HB2 MET 10 4.103 -5.989 2.830
68 HG2 MET 10 HG2 MET 10 1.595 -4.386 2.729
69 HG3 MET 10 HG3 MET 10 2.707 -4.080 4.077
70 HE1 MET 10 HE1 MET 10 2.898 -2.093 0.166
71 HE2 MET 10 HE2 MET 10 1.891 -3.545 0.374
72 HE3 MET 10 HE3 MET 10 1.707 -2.167 1.486
Start of MODEL 12
1 H1 GLY 1 H1 GLY 1 9.572 7.139 -2.922
2 H2 GLY 1 H2 GLY 1 8.711 6.990 -4.321
3 H3 GLY 1 H3 GLY 1 8.738 5.751 -3.233
4 HA2 GLY 1 HA3 GLY 1 7.610 7.064 -1.619
5 HA3 GLY 1 HA2 GLY 1 7.581 8.392 -2.795
6 H ASN 2 H ASN 2 6.149 5.409 -1.766
7 HA ASN 2 HA ASN 2 4.078 5.744 -3.896
8 HB2 ASN 2 HB2 ASN 2 3.740 3.224 -3.623
9 HB3 ASN 2 HB3 ASN 2 5.190 3.752 -4.499
10 HD21 ASN 2 HD21 ASN 2 6.066 1.628 -4.025
11 HD22 ASN 2 HD22 ASN 2 6.775 1.313 -2.457
12 H HIS 3 H HIS 3 2.900 7.073 -2.427
13 HA HIS 3 HA HIS 3 2.158 6.396 0.195
14 HB2 HIS 3 HB2 HIS 3 1.718 8.534 -1.199
15 HB3 HIS 3 HB3 HIS 3 0.239 7.712 -1.722
16 HD2 HIS 3 HD2 HIS 3 0.573 6.662 1.809
17 HE1 HIS 3 HE1 HIS 3 -1.436 10.393 2.011
18 HE2 HIS 3 HE2 HIS 3 -0.821 8.296 3.320
19 H TRP 4 H TRP 4 0.206 5.858 -2.771
20 HA TRP 4 HA TRP 4 -1.553 4.023 -1.324
21 HB2 TRP 4 HB2 TRP 4 -2.874 3.991 -3.252
22 HB3 TRP 4 HB3 TRP 4 -2.213 5.636 -3.216
23 HD1 TRP 4 HD1 TRP 4 0.624 5.113 -4.550
24 HE1 TRP 4 HE1 TRP 4 0.807 4.494 -7.050
25 HE3 TRP 4 HE3 TRP 4 -4.122 3.353 -5.252
26 HZ2 TRP 4 HZ2 TRP 4 -0.866 3.402 -9.028
27 HZ3 TRP 4 HZ3 TRP 4 -4.760 2.534 -7.486
28 HH2 TRP 4 HH2 TRP 4 -3.151 2.561 -9.348
29 H ALA 5 H ALA 5 -2.126 2.072 -3.146
30 HA ALA 5 HA ALA 5 -1.453 -0.009 -3.860
31 HB1 ALA 5 HB1 ALA 5 0.259 -0.026 -5.319
32 HB2 ALA 5 HB2 ALA 5 0.371 1.717 -4.977
33 HB3 ALA 5 HB3 ALA 5 1.420 0.570 -4.108
34 H VAL 6 H VAL 6 -1.414 0.714 -1.044
35 HA VAL 6 HA VAL 6 0.853 -0.879 0.012
36 HB VAL 6 HB VAL 6 0.105 -0.150 2.223
37 HG11 VAL 6 HG11 VAL 6 1.620 1.296 0.926
38 HG12 VAL 6 HG12 VAL 6 0.215 2.157 0.253
39 HG13 VAL 6 HG13 VAL 6 0.559 2.241 1.998
40 HG21 VAL 6 HG21 VAL 6 -2.316 -0.127 1.771
41 HG22 VAL 6 HG22 VAL 6 -1.763 1.401 2.497
42 HG23 VAL 6 HG23 VAL 6 -2.107 1.317 0.753
43 H GLY 7 H GLY 7 -1.488 -2.005 -1.529
44 HA2 GLY 7 HA2 GLY 7 -2.228 -4.003 0.556
45 HA3 GLY 7 HA3 GLY 7 -3.462 -3.328 -0.525
46 H HIS 8 H HIS 8 -0.124 -4.195 -1.368
47 HA HIS 8 HA HIS 8 -1.154 -6.538 -2.885
48 HB2 HIS 8 HB2 HIS 8 0.793 -4.572 -4.104
49 HB3 HIS 8 HB3 HIS 8 -0.067 -5.901 -4.900
50 HD2 HIS 8 HD2 HIS 8 -0.287 -2.244 -4.902
51 HE1 HIS 8 HE1 HIS 8 -4.338 -3.484 -5.118
52 HE2 HIS 8 HE2 HIS 8 -2.754 -1.512 -5.417
53 H LEU 9 H LEU 9 1.818 -4.684 -2.108
54 HA LEU 9 HA LEU 9 3.552 -6.955 -2.292
55 HB2 LEU 9 HB2 LEU 9 3.837 -4.223 -1.973
56 HB3 LEU 9 HB3 LEU 9 4.399 -4.859 -0.423
57 HG LEU 9 HG LEU 9 5.785 -6.474 -2.047
58 HD11 LEU 9 HD11 LEU 9 4.829 -5.501 -4.099
59 HD12 LEU 9 HD12 LEU 9 6.588 -5.249 -4.006
60 HD13 LEU 9 HD13 LEU 9 5.477 -3.908 -3.639
61 HD21 LEU 9 HD21 LEU 9 6.689 -5.003 -0.287
62 HD22 LEU 9 HD22 LEU 9 7.683 -4.955 -1.762
63 HD23 LEU 9 HD23 LEU 9 6.572 -3.615 -1.395
64 H MET 10 H MET 10 1.681 -5.535 0.350
65 HA MET 10 HA MET 10 2.908 -7.274 2.358
66 HB2 MET 10 HB3 MET 10 0.479 -5.455 2.473
67 HB3 MET 10 HB2 MET 10 1.176 -6.317 3.857
68 HG2 MET 10 HG2 MET 10 2.571 -4.634 4.208
69 HG3 MET 10 HG3 MET 10 3.293 -4.893 2.608
70 HE1 MET 10 HE1 MET 10 2.257 -1.967 0.573
71 HE2 MET 10 HE2 MET 10 3.637 -2.887 1.218
72 HE3 MET 10 HE3 MET 10 2.319 -3.734 0.372
Start of MODEL 13
1 H1 GLY 1 H1 GLY 1 9.733 7.711 -0.882
2 H2 GLY 1 H2 GLY 1 8.121 7.789 -0.543
3 H3 GLY 1 H3 GLY 1 8.718 8.537 -1.886
4 HA2 GLY 1 HA3 GLY 1 9.338 6.461 -2.840
5 HA3 GLY 1 HA2 GLY 1 8.690 5.662 -1.395
6 H ASN 2 H ASN 2 6.545 5.258 -1.220
7 HA ASN 2 HA ASN 2 4.758 6.434 -3.292
8 HB2 ASN 2 HB2 ASN 2 3.808 4.310 -3.843
9 HB3 ASN 2 HB3 ASN 2 5.567 4.163 -4.017
10 HD21 ASN 2 HD21 ASN 2 6.666 2.661 -2.835
11 HD22 ASN 2 HD22 ASN 2 5.921 1.608 -1.654
12 H HIS 3 H HIS 3 2.570 6.556 -2.731
13 HA HIS 3 HA HIS 3 2.121 6.421 0.204
14 HB2 HIS 3 HB3 HIS 3 1.704 8.506 -1.347
15 HB3 HIS 3 HB2 HIS 3 0.201 7.655 -1.746
16 HD2 HIS 3 HD2 HIS 3 1.185 7.206 1.932
17 HE1 HIS 3 HE1 HIS 3 -1.697 10.313 1.781
18 HE2 HIS 3 HE2 HIS 3 -0.410 8.749 3.328
19 H TRP 4 H TRP 4 0.187 5.864 -2.770
20 HA TRP 4 HA TRP 4 -1.563 4.020 -1.325
21 HB2 TRP 4 HB2 TRP 4 -2.886 3.987 -3.252
22 HB3 TRP 4 HB3 TRP 4 -2.228 5.633 -3.214
23 HD1 TRP 4 HD1 TRP 4 0.608 5.117 -4.553
24 HE1 TRP 4 HE1 TRP 4 0.788 4.501 -7.055
25 HE3 TRP 4 HE3 TRP 4 -4.135 3.347 -5.248
26 HZ2 TRP 4 HZ2 TRP 4 -0.887 3.407 -9.031
27 HZ3 TRP 4 HZ3 TRP 4 -4.777 2.531 -7.480
28 HH2 TRP 4 HH2 TRP 4 -3.171 2.560 -9.346
29 H ALA 5 H ALA 5 -2.133 2.067 -3.144
30 HA ALA 5 HA ALA 5 -1.458 -0.010 -3.865
31 HB1 ALA 5 HB1 ALA 5 0.252 -0.020 -5.328
32 HB2 ALA 5 HB2 ALA 5 0.360 1.722 -4.983
33 HB3 ALA 5 HB3 ALA 5 1.413 0.577 -4.119
34 H VAL 6 H VAL 6 -1.408 0.718 -1.046
35 HA VAL 6 HA VAL 6 0.862 -0.875 0.002
36 HB VAL 6 HB VAL 6 0.128 -0.144 2.214
37 HG11 VAL 6 HG11 VAL 6 1.626 1.308 0.906
38 HG12 VAL 6 HG12 VAL 6 0.567 2.249 1.985
39 HG13 VAL 6 HG13 VAL 6 0.211 2.161 0.243
40 HG21 VAL 6 HG21 VAL 6 -1.744 1.441 2.468
41 HG22 VAL 6 HG22 VAL 6 -2.121 1.262 0.738
42 HG23 VAL 6 HG23 VAL 6 -2.286 -0.131 1.833
43 H GLY 7 H GLY 7 -1.493 -1.996 -1.527
44 HA2 GLY 7 HA3 GLY 7 -2.234 -3.995 0.561
45 HA3 GLY 7 HA2 GLY 7 -3.458 -3.318 -0.530
46 H HIS 8 H HIS 8 -0.121 -4.191 -1.366
47 HA HIS 8 HA HIS 8 -1.155 -6.535 -2.880
48 HB2 HIS 8 HB2 HIS 8 0.793 -4.570 -4.101
49 HB3 HIS 8 HB3 HIS 8 -0.067 -5.901 -4.896
50 HD2 HIS 8 HD2 HIS 8 -0.287 -2.245 -4.901
51 HE1 HIS 8 HE1 HIS 8 -4.339 -3.487 -5.119
52 HE2 HIS 8 HE2 HIS 8 -2.755 -1.513 -5.420
53 H LEU 9 H LEU 9 1.826 -4.684 -2.130
54 HA LEU 9 HA LEU 9 3.561 -6.950 -2.311
55 HB2 LEU 9 HB2 LEU 9 3.840 -4.219 -1.977
56 HB3 LEU 9 HB3 LEU 9 4.399 -4.861 -0.429
57 HG LEU 9 HG LEU 9 5.762 -6.471 -2.123
58 HD11 LEU 9 HD11 LEU 9 4.865 -5.334 -4.117
59 HD12 LEU 9 HD12 LEU 9 5.548 -3.795 -3.540
60 HD13 LEU 9 HD13 LEU 9 6.629 -5.138 -3.982
61 HD21 LEU 9 HD21 LEU 9 6.674 -5.149 -0.254
62 HD22 LEU 9 HD22 LEU 9 7.694 -5.030 -1.709
63 HD23 LEU 9 HD23 LEU 9 6.613 -3.686 -1.267
64 H MET 10 H MET 10 1.890 -5.406 0.433
65 HA MET 10 HA MET 10 2.444 -7.885 2.002
66 HB2 MET 10 HB3 MET 10 2.757 -6.546 4.018
67 HB3 MET 10 HB2 MET 10 3.945 -6.104 2.778
68 HG2 MET 10 HG2 MET 10 1.434 -4.519 2.837
69 HG3 MET 10 HG3 MET 10 2.547 -4.300 4.201
70 HE1 MET 10 HE1 MET 10 2.716 -2.075 0.408
71 HE2 MET 10 HE2 MET 10 1.512 -2.251 1.707
72 HE3 MET 10 HE3 MET 10 1.740 -3.559 0.522
Start of MODEL 14
1 H1 GLY 1 H1 GLY 1 9.880 4.626 0.387
2 H2 GLY 1 H2 GLY 1 9.604 5.822 -0.715
3 H3 GLY 1 H3 GLY 1 8.546 5.586 0.527
4 HA2 GLY 1 HA2 GLY 1 9.097 3.709 -1.636
5 HA3 GLY 1 HA3 GLY 1 7.960 3.446 -0.300
6 H ASN 2 H ASN 2 5.914 3.774 -0.804
7 HA ASN 2 HA ASN 2 5.243 6.033 -2.619
8 HB2 ASN 2 HB2 ASN 2 4.478 3.130 -2.986
9 HB3 ASN 2 HB3 ASN 2 3.500 4.445 -3.668
10 HD21 ASN 2 HD21 ASN 2 5.914 2.269 -4.327
11 HD22 ASN 2 HD22 ASN 2 6.708 3.100 -5.645
12 H HIS 3 H HIS 3 2.941 6.601 -2.564
13 HA HIS 3 HA HIS 3 1.990 6.582 0.189
14 HB2 HIS 3 HB2 HIS 3 1.801 8.554 -1.295
15 HB3 HIS 3 HB3 HIS 3 0.676 7.655 -2.327
16 HD2 HIS 3 HD2 HIS 3 -0.308 6.764 1.157
17 HE1 HIS 3 HE1 HIS 3 -2.478 10.303 0.283
18 HE2 HIS 3 HE2 HIS 3 -2.274 8.338 1.892
19 H TRP 4 H TRP 4 0.203 5.842 -2.826
20 HA TRP 4 HA TRP 4 -1.557 4.039 -1.328
21 HB2 TRP 4 HB3 TRP 4 -2.918 4.010 -3.231
22 HB3 TRP 4 HB2 TRP 4 -2.234 5.645 -3.220
23 HD1 TRP 4 HD1 TRP 4 0.567 5.102 -4.599
24 HE1 TRP 4 HE1 TRP 4 0.704 4.468 -7.096
25 HE3 TRP 4 HE3 TRP 4 -4.196 3.352 -5.206
26 HZ2 TRP 4 HZ2 TRP 4 -1.007 3.371 -9.039
27 HZ3 TRP 4 HZ3 TRP 4 -4.876 2.524 -7.422
28 HH2 TRP 4 HH2 TRP 4 -3.300 2.532 -9.312
29 H ALA 5 H ALA 5 -2.166 2.078 -3.126
30 HA ALA 5 HA ALA 5 -1.514 -0.009 -3.840
31 HB1 ALA 5 HB1 ALA 5 0.173 -0.038 -5.329
32 HB2 ALA 5 HB2 ALA 5 0.295 1.707 -4.999
33 HB3 ALA 5 HB3 ALA 5 1.356 0.562 -4.143
34 H VAL 6 H VAL 6 -1.437 0.714 -1.034
35 HA VAL 6 HA VAL 6 0.853 -0.859 -0.001
36 HB VAL 6 HB VAL 6 0.165 -0.120 2.206
37 HG11 VAL 6 HG11 VAL 6 1.549 1.397 0.848
38 HG12 VAL 6 HG12 VAL 6 0.075 2.182 0.232
39 HG13 VAL 6 HG13 VAL 6 0.484 2.290 1.961
40 HG21 VAL 6 HG21 VAL 6 -1.768 1.376 2.521
41 HG22 VAL 6 HG22 VAL 6 -2.194 1.175 0.805
42 HG23 VAL 6 HG23 VAL 6 -2.256 -0.222 1.907
43 H GLY 7 H GLY 7 -1.507 -1.998 -1.516
44 HA2 GLY 7 HA3 GLY 7 -2.207 -4.012 0.573
45 HA3 GLY 7 HA2 GLY 7 -3.447 -3.346 -0.507
46 H HIS 8 H HIS 8 -0.107 -4.182 -1.371
47 HA HIS 8 HA HIS 8 -1.131 -6.530 -2.886
48 HB2 HIS 8 HB2 HIS 8 0.789 -4.541 -4.113
49 HB3 HIS 8 HB3 HIS 8 -0.061 -5.878 -4.908
50 HD2 HIS 8 HD2 HIS 8 -0.323 -2.225 -4.900
51 HE1 HIS 8 HE1 HIS 8 -4.362 -3.507 -5.089
52 HE2 HIS 8 HE2 HIS 8 -2.801 -1.517 -5.398
53 H LEU 9 H LEU 9 1.747 -4.654 -1.891
54 HA LEU 9 HA LEU 9 3.480 -6.992 -2.107
55 HB2 LEU 9 HB2 LEU 9 3.839 -4.241 -2.049
56 HB3 LEU 9 HB3 LEU 9 4.473 -4.767 -0.486
57 HG LEU 9 HG LEU 9 5.708 -6.552 -2.070
58 HD11 LEU 9 HD11 LEU 9 4.684 -5.657 -4.125
59 HD12 LEU 9 HD12 LEU 9 5.415 -4.069 -3.791
60 HD13 LEU 9 HD13 LEU 9 6.454 -5.472 -4.134
61 HD21 LEU 9 HD21 LEU 9 6.756 -5.022 -0.446
62 HD22 LEU 9 HD22 LEU 9 6.635 -3.695 -1.626
63 HD23 LEU 9 HD23 LEU 9 7.674 -5.098 -1.969
64 H MET 10 H MET 10 1.545 -5.453 0.358
65 HA MET 10 HA MET 10 2.595 -7.447 2.324
66 HB2 MET 10 HB3 MET 10 1.972 -5.796 4.096
67 HB3 MET 10 HB2 MET 10 3.302 -5.275 3.046
68 HG2 MET 10 HG3 MET 10 0.971 -4.305 1.818
69 HG3 MET 10 HG2 MET 10 0.749 -4.014 3.554
70 HE1 MET 10 HE1 MET 10 3.535 -3.163 0.523
71 HE2 MET 10 HE2 MET 10 2.905 -1.506 0.671
72 HE3 MET 10 HE3 MET 10 1.782 -2.866 0.429
Start of MODEL 15
1 H1 GLY 1 H1 GLY 1 7.724 10.530 -3.810
2 H2 GLY 1 H2 GLY 1 6.119 10.338 -3.482
3 H3 GLY 1 H3 GLY 1 7.216 9.253 -2.899
4 HA2 GLY 1 HA2 GLY 1 6.998 9.695 -5.747
5 HA3 GLY 1 HA3 GLY 1 7.584 8.265 -4.875
6 H ASN 2 H ASN 2 5.630 7.675 -3.118
7 HA ASN 2 HA ASN 2 2.967 7.839 -4.149
8 HB2 ASN 2 HB2 ASN 2 2.654 5.606 -5.023
9 HB3 ASN 2 HB3 ASN 2 3.943 6.412 -5.939
10 HD21 ASN 2 HD21 ASN 2 3.400 3.539 -5.638
11 HD22 ASN 2 HD22 ASN 2 4.841 2.842 -4.933
12 H HIS 3 H HIS 3 1.600 7.380 -2.552
13 HA HIS 3 HA HIS 3 2.708 5.921 -0.198
14 HB2 HIS 3 HB3 HIS 3 0.706 8.121 -0.547
15 HB3 HIS 3 HB2 HIS 3 0.512 7.006 0.816
16 HD2 HIS 3 HD2 HIS 3 3.944 6.875 1.220
17 HE1 HIS 3 HE1 HIS 3 3.247 10.887 2.411
18 HE2 HIS 3 HE2 HIS 3 4.913 8.960 2.487
19 H TRP 4 H TRP 4 0.234 5.898 -2.652
20 HA TRP 4 HA TRP 4 -1.503 4.001 -1.318
21 HB2 TRP 4 HB2 TRP 4 -2.768 4.000 -3.283
22 HB3 TRP 4 HB3 TRP 4 -2.090 5.637 -3.216
23 HD1 TRP 4 HD1 TRP 4 0.778 5.092 -4.473
24 HE1 TRP 4 HE1 TRP 4 1.025 4.487 -6.970
25 HE3 TRP 4 HE3 TRP 4 -3.964 3.383 -5.320
26 HZ2 TRP 4 HZ2 TRP 4 -0.601 3.424 -9.002
27 HZ3 TRP 4 HZ3 TRP 4 -4.546 2.587 -7.576
28 HH2 TRP 4 HH2 TRP 4 -2.885 2.608 -9.392
29 H ALA 5 H ALA 5 -2.040 2.068 -3.166
30 HA ALA 5 HA ALA 5 -1.370 -0.014 -3.876
31 HB1 ALA 5 HB1 ALA 5 0.380 -0.036 -5.290
32 HB2 ALA 5 HB2 ALA 5 0.499 1.703 -4.933
33 HB3 ALA 5 HB3 ALA 5 1.514 0.541 -4.046
34 H VAL 6 H VAL 6 -1.378 0.713 -1.050
35 HA VAL 6 HA VAL 6 0.839 -0.922 0.048
36 HB VAL 6 HB VAL 6 0.105 -0.169 2.234
37 HG11 VAL 6 HG11 VAL 6 1.565 1.317 0.921
38 HG12 VAL 6 HG12 VAL 6 0.129 2.140 0.265
39 HG13 VAL 6 HG13 VAL 6 0.491 2.233 2.005
40 HG21 VAL 6 HG21 VAL 6 -2.323 -0.212 1.811
41 HG22 VAL 6 HG22 VAL 6 -2.165 1.237 0.790
42 HG23 VAL 6 HG23 VAL 6 -1.803 1.331 2.530
43 H GLY 7 H GLY 7 -1.496 -1.999 -1.544
44 HA2 GLY 7 HA3 GLY 7 -2.320 -3.994 0.520
45 HA3 GLY 7 HA2 GLY 7 -3.504 -3.297 -0.603
46 H HIS 8 H HIS 8 -0.159 -4.220 -1.349
47 HA HIS 8 HA HIS 8 -1.189 -6.542 -2.900
48 HB2 HIS 8 HB2 HIS 8 0.824 -4.604 -4.055
49 HB3 HIS 8 HB3 HIS 8 -0.031 -5.920 -4.880
50 HD2 HIS 8 HD2 HIS 8 -0.198 -2.261 -4.883
51 HE1 HIS 8 HE1 HIS 8 -4.259 -3.437 -5.218
52 HE2 HIS 8 HE2 HIS 8 -2.639 -1.490 -5.468
53 H LEU 9 H LEU 9 1.780 -4.738 -2.004
54 HA LEU 9 HA LEU 9 3.473 -7.056 -2.147
55 HB2 LEU 9 HB2 LEU 9 3.817 -4.325 -1.861
56 HB3 LEU 9 HB3 LEU 9 4.337 -4.954 -0.294
57 HG LEU 9 HG LEU 9 5.687 -6.627 -1.926
58 HD11 LEU 9 HD11 LEU 9 4.838 -5.531 -3.964
59 HD12 LEU 9 HD12 LEU 9 5.545 -3.990 -3.423
60 HD13 LEU 9 HD13 LEU 9 6.603 -5.367 -3.812
61 HD21 LEU 9 HD21 LEU 9 6.603 -5.270 -0.086
62 HD22 LEU 9 HD22 LEU 9 7.642 -5.214 -1.529
63 HD23 LEU 9 HD23 LEU 9 6.585 -3.836 -1.141
64 H MET 10 H MET 10 1.763 -5.424 0.516
65 HA MET 10 HA MET 10 2.219 -7.874 2.152
66 HB2 MET 10 HB3 MET 10 2.540 -6.501 4.147
67 HB3 MET 10 HB2 MET 10 3.776 -6.154 2.926
68 HG2 MET 10 HG2 MET 10 1.351 -4.442 2.875
69 HG3 MET 10 HG3 MET 10 2.432 -4.243 4.267
70 HE1 MET 10 HE1 MET 10 2.828 -2.116 0.439
71 HE2 MET 10 HE2 MET 10 1.584 -2.197 1.710
72 HE3 MET 10 HE3 MET 10 1.766 -3.540 0.556
Start of MODEL 16
1 H1 GLY 1 H1 GLY 1 8.143 9.657 -5.303
2 H2 GLY 1 H2 GLY 1 6.728 9.675 -6.149
3 H3 GLY 1 H3 GLY 1 7.284 8.263 -5.501
4 HA2 GLY 1 HA3 GLY 1 7.029 9.103 -3.303
5 HA3 GLY 1 HA2 GLY 1 6.428 10.617 -4.006
6 H ASN 2 H ASN 2 5.802 7.114 -3.814
7 HA ASN 2 HA ASN 2 2.903 7.735 -4.208
8 HB2 ASN 2 HB3 ASN 2 2.676 5.387 -4.989
9 HB3 ASN 2 HB2 ASN 2 3.735 6.368 -6.022
10 HD21 ASN 2 HD21 ASN 2 3.409 3.451 -4.362
11 HD22 ASN 2 HD22 ASN 2 5.084 2.948 -4.375
12 H HIS 3 H HIS 3 1.651 7.471 -2.500
13 HA HIS 3 HA HIS 3 2.711 5.918 -0.201
14 HB2 HIS 3 HB2 HIS 3 0.718 8.121 -0.550
15 HB3 HIS 3 HB3 HIS 3 0.504 7.009 0.812
16 HD2 HIS 3 HD2 HIS 3 3.945 6.873 1.219
17 HE1 HIS 3 HE1 HIS 3 3.246 10.884 2.411
18 HE2 HIS 3 HE2 HIS 3 4.916 8.960 2.484
19 H TRP 4 H TRP 4 0.227 5.903 -2.647
20 HA TRP 4 HA TRP 4 -1.505 4.001 -1.318
21 HB2 TRP 4 HB2 TRP 4 -2.769 4.001 -3.284
22 HB3 TRP 4 HB3 TRP 4 -2.089 5.637 -3.217
23 HD1 TRP 4 HD1 TRP 4 0.777 5.093 -4.471
24 HE1 TRP 4 HE1 TRP 4 1.026 4.489 -6.968
25 HE3 TRP 4 HE3 TRP 4 -3.962 3.385 -5.322
26 HZ2 TRP 4 HZ2 TRP 4 -0.598 3.425 -9.002
27 HZ3 TRP 4 HZ3 TRP 4 -4.544 2.586 -7.578
28 HH2 TRP 4 HH2 TRP 4 -2.881 2.609 -9.392
29 H ALA 5 H ALA 5 -2.040 2.068 -3.167
30 HA ALA 5 HA ALA 5 -1.368 -0.014 -3.877
31 HB1 ALA 5 HB1 ALA 5 0.383 -0.035 -5.290
32 HB2 ALA 5 HB2 ALA 5 0.501 1.705 -4.931
33 HB3 ALA 5 HB3 ALA 5 1.515 0.542 -4.044
34 H VAL 6 H VAL 6 -1.379 0.712 -1.050
35 HA VAL 6 HA VAL 6 0.838 -0.921 0.048
36 HB VAL 6 HB VAL 6 0.058 -0.184 2.245
37 HG11 VAL 6 HG11 VAL 6 1.610 1.250 0.980
38 HG12 VAL 6 HG12 VAL 6 0.538 2.202 2.035
39 HG13 VAL 6 HG13 VAL 6 0.226 2.126 0.284
40 HG21 VAL 6 HG21 VAL 6 -2.354 -0.138 1.749
41 HG22 VAL 6 HG22 VAL 6 -1.801 1.383 2.488
42 HG23 VAL 6 HG23 VAL 6 -2.113 1.307 0.738
43 H GLY 7 H GLY 7 -1.496 -1.999 -1.544
44 HA2 GLY 7 HA3 GLY 7 -2.322 -3.993 0.519
45 HA3 GLY 7 HA2 GLY 7 -3.505 -3.297 -0.605
46 H HIS 8 H HIS 8 -0.158 -4.218 -1.349
47 HA HIS 8 HA HIS 8 -1.189 -6.540 -2.899
48 HB2 HIS 8 HB3 HIS 8 0.829 -4.610 -4.066
49 HB3 HIS 8 HB2 HIS 8 -0.043 -5.922 -4.879
50 HD2 HIS 8 HD2 HIS 8 -0.197 -2.260 -4.883
51 HE1 HIS 8 HE1 HIS 8 -4.259 -3.439 -5.218
52 HE2 HIS 8 HE2 HIS 8 -2.638 -1.488 -5.471
53 H LEU 9 H LEU 9 1.790 -4.738 -2.033
54 HA LEU 9 HA LEU 9 3.489 -7.043 -2.174
55 HB2 LEU 9 HB3 LEU 9 3.817 -4.304 -1.838
56 HB3 LEU 9 HB2 LEU 9 4.338 -4.977 -0.289
57 HG LEU 9 HG LEU 9 5.707 -6.606 -1.915
58 HD11 LEU 9 HD11 LEU 9 4.851 -5.534 -3.963
59 HD12 LEU 9 HD12 LEU 9 5.539 -3.981 -3.431
60 HD13 LEU 9 HD13 LEU 9 6.614 -5.349 -3.807
61 HD21 LEU 9 HD21 LEU 9 6.603 -5.224 -0.082
62 HD22 LEU 9 HD22 LEU 9 6.569 -3.799 -1.148
63 HD23 LEU 9 HD23 LEU 9 7.645 -5.166 -1.524
64 H MET 10 H MET 10 1.668 -5.511 0.459
65 HA MET 10 HA MET 10 2.172 -7.956 2.084
66 HB2 MET 10 HB3 MET 10 2.400 -6.564 4.108
67 HB3 MET 10 HB2 MET 10 3.694 -6.268 2.934
68 HG2 MET 10 HG2 MET 10 1.305 -4.504 2.776
69 HG3 MET 10 HG3 MET 10 2.368 -4.298 4.181
70 HE1 MET 10 HE1 MET 10 2.883 -2.313 0.277
71 HE2 MET 10 HE2 MET 10 1.599 -2.333 1.509
72 HE3 MET 10 HE3 MET 10 1.807 -3.724 0.418
Start of MODEL 17
1 H1 GLY 1 H1 GLY 1 8.835 7.887 -1.255
2 H2 GLY 1 H2 GLY 1 7.737 6.656 -1.233
3 H3 GLY 1 H3 GLY 1 7.281 8.176 -0.783
4 HA2 GLY 1 HA3 GLY 1 7.664 9.002 -2.969
5 HA3 GLY 1 HA2 GLY 1 8.149 7.364 -3.447
6 H ASN 2 H ASN 2 6.485 5.622 -2.975
7 HA ASN 2 HA ASN 2 3.900 6.607 -4.024
8 HB2 ASN 2 HB3 ASN 2 5.026 3.806 -3.681
9 HB3 ASN 2 HB2 ASN 2 3.425 4.177 -4.352
10 HD21 ASN 2 HD21 ASN 2 3.221 4.980 -6.431
11 HD22 ASN 2 HD22 ASN 2 4.567 5.080 -7.544
12 H HIS 3 H HIS 3 2.372 7.153 -2.639
13 HA HIS 3 HA HIS 3 2.389 6.157 0.106
14 HB2 HIS 3 HB2 HIS 3 0.842 8.148 -1.481
15 HB3 HIS 3 HB3 HIS 3 0.038 7.448 -0.067
16 HD2 HIS 3 HD2 HIS 3 2.878 7.419 1.790
17 HE1 HIS 3 HE1 HIS 3 2.532 11.618 1.297
18 HE2 HIS 3 HE2 HIS 3 3.630 9.773 2.671
19 H TRP 4 H TRP 4 0.129 5.932 -2.668
20 HA TRP 4 HA TRP 4 -1.570 4.014 -1.314
21 HB2 TRP 4 HB3 TRP 4 -2.860 4.004 -3.266
22 HB3 TRP 4 HB2 TRP 4 -2.182 5.641 -3.211
23 HD1 TRP 4 HD1 TRP 4 0.670 5.127 -4.491
24 HE1 TRP 4 HE1 TRP 4 0.901 4.522 -6.989
25 HE3 TRP 4 HE3 TRP 4 -4.060 3.361 -5.294
26 HZ2 TRP 4 HZ2 TRP 4 -0.731 3.437 -9.007
27 HZ3 TRP 4 HZ3 TRP 4 -4.653 2.554 -7.545
28 HH2 TRP 4 HH2 TRP 4 -3.007 2.591 -9.374
29 H ALA 5 H ALA 5 -2.102 2.071 -3.158
30 HA ALA 5 HA ALA 5 -1.412 -0.003 -3.869
31 HB1 ALA 5 HB1 ALA 5 0.328 -0.008 -5.294
32 HB2 ALA 5 HB2 ALA 5 1.464 0.584 -4.058
33 HB3 ALA 5 HB3 ALA 5 0.430 1.733 -4.940
34 H VAL 6 H VAL 6 -1.417 0.720 -1.045
35 HA VAL 6 HA VAL 6 0.827 -0.883 0.042
36 HB VAL 6 HB VAL 6 0.082 -0.146 2.236
37 HG11 VAL 6 HG11 VAL 6 1.538 1.349 0.927
38 HG12 VAL 6 HG12 VAL 6 0.099 2.163 0.267
39 HG13 VAL 6 HG13 VAL 6 0.455 2.259 2.008
40 HG21 VAL 6 HG21 VAL 6 -2.343 -0.201 1.805
41 HG22 VAL 6 HG22 VAL 6 -1.834 1.345 2.526
42 HG23 VAL 6 HG23 VAL 6 -2.190 1.249 0.785
43 H GLY 7 H GLY 7 -1.500 -1.993 -1.540
44 HA2 GLY 7 HA2 GLY 7 -2.278 -3.999 0.525
45 HA3 GLY 7 HA3 GLY 7 -3.487 -3.322 -0.582
46 H HIS 8 H HIS 8 -0.130 -4.190 -1.355
47 HA HIS 8 HA HIS 8 -1.132 -6.529 -2.898
48 HB2 HIS 8 HB2 HIS 8 0.844 -4.560 -4.067
49 HB3 HIS 8 HB3 HIS 8 0.005 -5.890 -4.887
50 HD2 HIS 8 HD2 HIS 8 -0.218 -2.236 -4.890
51 HE1 HIS 8 HE1 HIS 8 -4.264 -3.474 -5.194
52 HE2 HIS 8 HE2 HIS 8 -2.674 -1.501 -5.461
53 H LEU 9 H LEU 9 1.794 -4.677 -1.970
54 HA LEU 9 HA LEU 9 3.524 -6.981 -2.125
55 HB2 LEU 9 HB2 LEU 9 3.835 -4.236 -1.878
56 HB3 LEU 9 HB3 LEU 9 4.398 -4.849 -0.319
57 HG LEU 9 HG LEU 9 5.802 -6.495 -1.824
58 HD11 LEU 9 HD11 LEU 9 4.764 -5.785 -3.944
59 HD12 LEU 9 HD12 LEU 9 5.373 -4.134 -3.683
60 HD13 LEU 9 HD13 LEU 9 6.516 -5.476 -3.930
61 HD21 LEU 9 HD21 LEU 9 6.703 -4.811 -0.267
62 HD22 LEU 9 HD22 LEU 9 7.658 -4.902 -1.766
63 HD23 LEU 9 HD23 LEU 9 6.515 -3.560 -1.519
64 H MET 10 H MET 10 2.092 -5.179 0.621
65 HA MET 10 HA MET 10 2.465 -7.652 2.258
66 HB2 MET 10 HB3 MET 10 2.902 -6.259 4.209
67 HB3 MET 10 HB2 MET 10 4.082 -5.927 2.929
68 HG2 MET 10 HG2 MET 10 1.649 -4.212 3.027
69 HG3 MET 10 HG3 MET 10 2.860 -3.990 4.305
70 HE1 MET 10 HE1 MET 10 2.891 -1.956 0.399
71 HE2 MET 10 HE2 MET 10 1.764 -2.009 1.776
72 HE3 MET 10 HE3 MET 10 1.854 -3.382 0.646
Start of MODEL 18
1 H1 GLY 1 H1 GLY 1 7.607 1.522 0.486
2 H2 GLY 1 H2 GLY 1 6.418 2.663 0.553
3 H3 GLY 1 H3 GLY 1 6.386 1.506 -0.622
4 HA2 GLY 1 HA3 GLY 1 8.605 3.360 -0.372
5 HA3 GLY 1 HA2 GLY 1 8.139 2.366 -1.766
6 H ASN 2 H ASN 2 5.307 2.927 -1.587
7 HA ASN 2 HA ASN 2 5.333 5.816 -2.365
8 HB2 ASN 2 HB2 ASN 2 3.838 3.505 -3.647
9 HB3 ASN 2 HB3 ASN 2 3.576 5.215 -4.042
10 HD21 ASN 2 HD22 ASN 2 5.366 2.397 -4.719
11 HD22 ASN 2 HD21 ASN 2 6.585 3.112 -5.750
12 H HIS 3 H HIS 3 3.085 6.767 -2.400
13 HA HIS 3 HA HIS 3 1.957 6.597 0.200
14 HB2 HIS 3 HB3 HIS 3 1.768 8.568 -1.268
15 HB3 HIS 3 HB2 HIS 3 0.709 7.651 -2.353
16 HD2 HIS 3 HD2 HIS 3 -0.148 7.023 1.323
17 HE1 HIS 3 HE1 HIS 3 -2.831 9.992 -0.088
18 HE2 HIS 3 HE2 HIS 3 -2.329 8.395 1.833
19 H TRP 4 H TRP 4 0.201 5.834 -2.825
20 HA TRP 4 HA TRP 4 -1.560 4.027 -1.328
21 HB2 TRP 4 HB3 TRP 4 -2.922 4.002 -3.231
22 HB3 TRP 4 HB2 TRP 4 -2.241 5.638 -3.216
23 HD1 TRP 4 HD1 TRP 4 0.559 5.109 -4.597
24 HE1 TRP 4 HE1 TRP 4 0.698 4.484 -7.097
25 HE3 TRP 4 HE3 TRP 4 -4.196 3.343 -5.208
26 HZ2 TRP 4 HZ2 TRP 4 -1.009 3.386 -9.043
27 HZ3 TRP 4 HZ3 TRP 4 -4.874 2.518 -7.428
28 HH2 TRP 4 HH2 TRP 4 -3.299 2.540 -9.319
29 H ALA 5 H ALA 5 -2.162 2.070 -3.136
30 HA ALA 5 HA ALA 5 -1.501 -0.013 -3.855
31 HB1 ALA 5 HB1 ALA 5 0.184 -0.030 -5.345
32 HB2 ALA 5 HB2 ALA 5 0.299 1.714 -5.008
33 HB3 ALA 5 HB3 ALA 5 1.366 0.571 -4.158
34 H VAL 6 H VAL 6 -1.412 0.719 -1.041
35 HA VAL 6 HA VAL 6 0.877 -0.865 -0.022
36 HB VAL 6 HB VAL 6 0.140 -0.143 2.205
37 HG11 VAL 6 HG11 VAL 6 1.668 1.283 0.904
38 HG12 VAL 6 HG12 VAL 6 0.622 2.240 1.979
39 HG13 VAL 6 HG13 VAL 6 0.272 2.161 0.236
40 HG21 VAL 6 HG21 VAL 6 -2.283 -0.092 1.760
41 HG22 VAL 6 HG22 VAL 6 -1.710 1.429 2.484
42 HG23 VAL 6 HG23 VAL 6 -2.060 1.350 0.741
43 H GLY 7 H GLY 7 -1.498 -1.992 -1.518
44 HA2 GLY 7 HA2 GLY 7 -2.193 -3.997 0.578
45 HA3 GLY 7 HA3 GLY 7 -3.444 -3.328 -0.487
46 H HIS 8 H HIS 8 -0.112 -4.183 -1.374
47 HA HIS 8 HA HIS 8 -1.155 -6.534 -2.872
48 HB2 HIS 8 HB2 HIS 8 0.769 -4.560 -4.117
49 HB3 HIS 8 HB3 HIS 8 -0.092 -5.896 -4.902
50 HD2 HIS 8 HD2 HIS 8 -0.332 -2.242 -4.909
51 HE1 HIS 8 HE1 HIS 8 -4.379 -3.501 -5.074
52 HE2 HIS 8 HE2 HIS 8 -2.809 -1.523 -5.397
53 H LEU 9 H LEU 9 1.832 -4.670 -2.174
54 HA LEU 9 HA LEU 9 3.572 -6.928 -2.369
55 HB2 LEU 9 HB3 LEU 9 3.845 -4.185 -2.019
56 HB3 LEU 9 HB2 LEU 9 4.435 -4.856 -0.495
57 HG LEU 9 HG LEU 9 5.789 -6.439 -2.178
58 HD11 LEU 9 HD11 LEU 9 4.832 -5.381 -4.188
59 HD12 LEU 9 HD12 LEU 9 5.495 -3.812 -3.671
60 HD13 LEU 9 HD13 LEU 9 6.594 -5.146 -4.094
61 HD21 LEU 9 HD21 LEU 9 6.712 -5.043 -0.370
62 HD22 LEU 9 HD22 LEU 9 7.700 -4.948 -1.847
63 HD23 LEU 9 HD23 LEU 9 6.601 -3.613 -1.424
64 H MET 10 H MET 10 2.055 -5.321 0.443
65 HA MET 10 HA MET 10 2.610 -7.813 1.997
66 HB2 MET 10 HB3 MET 10 2.904 -6.439 4.003
67 HB3 MET 10 HB2 MET 10 4.092 -6.023 2.755
68 HG2 MET 10 HG2 MET 10 1.570 -4.443 2.821
69 HG3 MET 10 HG3 MET 10 2.734 -4.178 4.133
70 HE1 MET 10 HE1 MET 10 2.754 -2.093 0.252
71 HE2 MET 10 HE2 MET 10 1.592 -2.228 1.594
72 HE3 MET 10 HE3 MET 10 1.796 -3.580 0.453
Start of MODEL 19
1 H1 GLY 1 H1 GLY 1 9.280 9.450 -1.296
2 H2 GLY 1 H2 GLY 1 8.011 10.045 -2.165
3 H3 GLY 1 H3 GLY 1 7.740 9.265 -0.737
4 HA2 GLY 1 HA3 GLY 1 8.854 8.068 -3.155
5 HA3 GLY 1 HA2 GLY 1 8.556 7.233 -1.618
6 H ASN 2 H ASN 2 6.901 5.899 -1.855
7 HA ASN 2 HA ASN 2 4.611 6.765 -3.545
8 HB2 ASN 2 HB2 ASN 2 4.076 4.514 -3.837
9 HB3 ASN 2 HB3 ASN 2 5.851 4.505 -3.827
10 HD21 ASN 2 HD21 ASN 2 2.937 3.445 -2.262
11 HD22 ASN 2 HD22 ASN 2 3.693 2.500 -0.998
12 H HIS 3 H HIS 3 2.423 6.235 -2.804
13 HA HIS 3 HA HIS 3 2.194 6.400 0.173
14 HB2 HIS 3 HB3 HIS 3 1.757 8.584 -0.995
15 HB3 HIS 3 HB2 HIS 3 0.406 7.800 -1.832
16 HD2 HIS 3 HD2 HIS 3 -1.291 6.438 0.415
17 HE1 HIS 3 HE1 HIS 3 -0.898 10.028 2.641
18 HE2 HIS 3 HE2 HIS 3 -2.226 7.866 2.409
19 H TRP 4 H TRP 4 0.236 5.852 -2.787
20 HA TRP 4 HA TRP 4 -1.538 4.040 -1.321
21 HB2 TRP 4 HB2 TRP 4 -2.866 4.010 -3.243
22 HB3 TRP 4 HB3 TRP 4 -2.193 5.650 -3.217
23 HD1 TRP 4 HD1 TRP 4 0.636 5.102 -4.561
24 HE1 TRP 4 HE1 TRP 4 0.804 4.471 -7.057
25 HE3 TRP 4 HE3 TRP 4 -4.124 3.367 -5.235
26 HZ2 TRP 4 HZ2 TRP 4 -0.881 3.380 -9.023
27 HZ3 TRP 4 HZ3 TRP 4 -4.776 2.541 -7.461
28 HH2 TRP 4 HH2 TRP 4 -3.174 2.548 -9.330
29 H ALA 5 H ALA 5 -2.127 2.082 -3.128
30 HA ALA 5 HA ALA 5 -1.470 -0.004 -3.836
31 HB1 ALA 5 HB1 ALA 5 0.236 -0.038 -5.300
32 HB2 ALA 5 HB2 ALA 5 0.359 1.706 -4.967
33 HB3 ALA 5 HB3 ALA 5 1.405 0.558 -4.097
34 H VAL 6 H VAL 6 -1.452 0.690 -1.033
35 HA VAL 6 HA VAL 6 0.828 -0.878 0.034
36 HB VAL 6 HB VAL 6 0.033 -0.172 2.246
37 HG11 VAL 6 HG11 VAL 6 1.593 1.261 0.992
38 HG12 VAL 6 HG12 VAL 6 0.519 2.212 2.046
39 HG13 VAL 6 HG13 VAL 6 0.213 2.142 0.294
40 HG21 VAL 6 HG21 VAL 6 -2.377 -0.123 1.740
41 HG22 VAL 6 HG22 VAL 6 -2.130 1.325 0.735
42 HG23 VAL 6 HG23 VAL 6 -1.825 1.396 2.487
43 H GLY 7 H GLY 7 -1.510 -2.010 -1.521
44 HA2 GLY 7 HA2 GLY 7 -2.237 -4.032 0.548
45 HA3 GLY 7 HA3 GLY 7 -3.473 -3.360 -0.534
46 H HIS 8 H HIS 8 -0.121 -4.196 -1.367
47 HA HIS 8 HA HIS 8 -1.130 -6.536 -2.903
48 HB2 HIS 8 HB3 HIS 8 0.816 -4.556 -4.107
49 HB3 HIS 8 HB2 HIS 8 -0.045 -5.884 -4.905
50 HD2 HIS 8 HD2 HIS 8 -0.282 -2.226 -4.890
51 HE1 HIS 8 HE1 HIS 8 -4.322 -3.498 -5.138
52 HE2 HIS 8 HE2 HIS 8 -2.753 -1.510 -5.419
53 H LEU 9 H LEU 9 1.798 -4.666 -2.020
54 HA LEU 9 HA LEU 9 3.541 -6.957 -2.214
55 HB2 LEU 9 HB3 LEU 9 3.843 -4.203 -1.950
56 HB3 LEU 9 HB2 LEU 9 4.426 -4.838 -0.407
57 HG LEU 9 HG LEU 9 5.763 -6.482 -2.037
58 HD11 LEU 9 HD11 LEU 9 4.810 -5.490 -4.082
59 HD12 LEU 9 HD12 LEU 9 6.575 -5.269 -4.000
60 HD13 LEU 9 HD13 LEU 9 5.489 -3.909 -3.625
61 HD21 LEU 9 HD21 LEU 9 6.702 -5.029 -0.282
62 HD22 LEU 9 HD22 LEU 9 6.602 -3.638 -1.388
63 HD23 LEU 9 HD23 LEU 9 7.688 -4.997 -1.764
64 H MET 10 H MET 10 1.965 -5.267 0.507
65 HA MET 10 HA MET 10 3.028 -7.237 2.415
66 HB2 MET 10 HB2 MET 10 1.052 -4.972 2.830
67 HB3 MET 10 HB3 MET 10 1.849 -5.914 4.102
68 HG2 MET 10 HG3 MET 10 3.724 -4.684 3.988
69 HG3 MET 10 HG2 MET 10 3.733 -4.703 2.214
70 HE1 MET 10 HE1 MET 10 3.158 -3.069 0.772
71 HE2 MET 10 HE2 MET 10 2.438 -1.473 1.094
72 HE3 MET 10 HE3 MET 10 1.398 -2.914 0.992
Start of MODEL 20
1 H1 GLY 1 H1 GLY 1 8.925 5.266 0.857
2 H2 GLY 1 H2 GLY 1 7.288 5.432 0.743
3 H3 GLY 1 H3 GLY 1 8.035 4.130 0.059
4 HA2 GLY 1 HA2 GLY 1 8.733 6.822 -0.744
5 HA3 GLY 1 HA3 GLY 1 8.943 5.301 -1.634
6 H ASN 2 H ASN 2 6.426 4.167 -1.371
7 HA ASN 2 HA ASN 2 4.855 6.026 -3.080
8 HB2 ASN 2 HB2 ASN 2 3.538 3.899 -3.577
9 HB3 ASN 2 HB3 ASN 2 5.206 3.962 -4.180
10 HD21 ASN 2 HD21 ASN 2 6.195 2.058 -4.003
11 HD22 ASN 2 HD22 ASN 2 6.023 0.935 -2.672
12 H HIS 3 H HIS 3 2.850 6.720 -2.576
13 HA HIS 3 HA HIS 3 2.036 6.519 0.208
14 HB2 HIS 3 HB2 HIS 3 1.778 8.517 -1.393
15 HB3 HIS 3 HB3 HIS 3 0.376 7.654 -2.046
16 HD2 HIS 3 HD2 HIS 3 0.220 6.915 1.580
17 HE1 HIS 3 HE1 HIS 3 -1.783 10.633 1.172
18 HE2 HIS 3 HE2 HIS 3 -1.356 8.664 2.736
19 H TRP 4 H TRP 4 0.217 5.834 -2.809
20 HA TRP 4 HA TRP 4 -1.555 4.025 -1.329
21 HB2 TRP 4 HB3 TRP 4 -2.902 4.005 -3.240
22 HB3 TRP 4 HB2 TRP 4 -2.217 5.640 -3.218
23 HD1 TRP 4 HD1 TRP 4 0.591 5.106 -4.580
24 HE1 TRP 4 HE1 TRP 4 0.746 4.482 -7.079
25 HE3 TRP 4 HE3 TRP 4 -4.165 3.351 -5.226
26 HZ2 TRP 4 HZ2 TRP 4 -0.950 3.386 -9.038
27 HZ3 TRP 4 HZ3 TRP 4 -4.829 2.527 -7.450
28 HH2 TRP 4 HH2 TRP 4 -3.240 2.546 -9.330
29 H ALA 5 H ALA 5 -2.147 2.070 -3.140
30 HA ALA 5 HA ALA 5 -1.485 -0.012 -3.857
31 HB1 ALA 5 HB1 ALA 5 0.210 -0.033 -5.334
32 HB2 ALA 5 HB2 ALA 5 0.327 1.711 -4.997
33 HB3 ALA 5 HB3 ALA 5 1.385 0.566 -4.138
34 H VAL 6 H VAL 6 -1.413 0.719 -1.041
35 HA VAL 6 HA VAL 6 0.866 -0.869 -0.007
36 HB VAL 6 HB VAL 6 0.127 -0.144 2.213
37 HG11 VAL 6 HG11 VAL 6 1.648 1.290 0.910
38 HG12 VAL 6 HG12 VAL 6 0.597 2.243 1.984
39 HG13 VAL 6 HG13 VAL 6 0.246 2.160 0.241
40 HG21 VAL 6 HG21 VAL 6 -2.295 -0.106 1.769
41 HG22 VAL 6 HG22 VAL 6 -1.730 1.419 2.491
42 HG23 VAL 6 HG23 VAL 6 -2.081 1.336 0.748
43 H GLY 7 H GLY 7 -1.491 -2.000 -1.523
44 HA2 GLY 7 HA3 GLY 7 -2.215 -3.999 0.573
45 HA3 GLY 7 HA2 GLY 7 -3.449 -3.327 -0.510
46 H HIS 8 H HIS 8 -0.115 -4.187 -1.374
47 HA HIS 8 HA HIS 8 -1.155 -6.536 -2.876
48 HB2 HIS 8 HB2 HIS 8 0.776 -4.566 -4.114
49 HB3 HIS 8 HB3 HIS 8 -0.086 -5.899 -4.902
50 HD2 HIS 8 HD2 HIS 8 -0.319 -2.244 -4.910
51 HE1 HIS 8 HE1 HIS 8 -4.366 -3.495 -5.086
52 HE2 HIS 8 HE2 HIS 8 -2.792 -1.519 -5.403
53 H LEU 9 H LEU 9 1.830 -4.673 -2.165
54 HA LEU 9 HA LEU 9 3.571 -6.931 -2.357
55 HB2 LEU 9 HB2 LEU 9 3.840 -4.200 -2.016
56 HB3 LEU 9 HB3 LEU 9 4.414 -4.844 -0.473
57 HG LEU 9 HG LEU 9 5.779 -6.443 -2.166
58 HD11 LEU 9 HD11 LEU 9 4.849 -5.340 -4.165
59 HD12 LEU 9 HD12 LEU 9 5.520 -3.786 -3.613
60 HD13 LEU 9 HD13 LEU 9 6.612 -5.122 -4.050
61 HD21 LEU 9 HD21 LEU 9 6.694 -5.089 -0.322
62 HD22 LEU 9 HD22 LEU 9 7.699 -4.975 -1.786
63 HD23 LEU 9 HD23 LEU 9 6.607 -3.638 -1.350
64 H MET 10 H MET 10 1.881 -5.424 0.391
65 HA MET 10 HA MET 10 2.489 -7.890 1.958
66 HB2 MET 10 HB2 MET 10 2.699 -6.506 3.984
67 HB3 MET 10 HB3 MET 10 3.954 -6.136 2.788
68 HG2 MET 10 HG3 MET 10 1.460 -4.495 2.738
69 HG3 MET 10 HG2 MET 10 2.585 -4.248 4.087
70 HE1 MET 10 HE1 MET 10 2.802 -2.160 0.223
71 HE2 MET 10 HE2 MET 10 1.597 -2.260 1.530
72 HE3 MET 10 HE3 MET 10 1.787 -3.613 0.388