Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
22031 | 2j15 RC | 7341 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H ASN 1 H ASN 1 8.023 -2.354 -5.280
2 HA ASN 1 HA ASN 1 8.439 -3.624 -7.849
3 1HB ASN 1 1HB ASN 1 7.770 -5.689 -6.709
4 2HB ASN 1 2HB ASN 1 9.006 -4.848 -5.780
5 1HD2 ASN 1 1HD2 ASN 1 6.276 -6.547 -5.465
6 2HD2 ASN 1 2HD2 ASN 1 5.651 -5.871 -4.003
7 H GLY 2 H GLY 2 5.850 -2.428 -5.857
8 1HA GLY 2 1HA GLY 2 3.691 -3.656 -7.194
9 2HA GLY 2 2HA GLY 2 4.035 -2.096 -7.934
10 H VAL 3 H VAL 3 1.626 -2.698 -6.628
11 HA VAL 3 HA VAL 3 1.786 -0.824 -4.370
12 HB VAL 3 HB VAL 3 -0.684 -1.548 -5.942
13 1HG1 VAL 3 1HG1 VAL 3 -0.323 -0.175 -3.527
14 2HG1 VAL 3 2HG1 VAL 3 -0.695 1.051 -4.738
15 3HG1 VAL 3 3HG1 VAL 3 -1.798 -0.303 -4.486
16 1HG2 VAL 3 1HG2 VAL 3 1.338 -0.321 -7.135
17 2HG2 VAL 3 2HG2 VAL 3 -0.337 0.144 -7.434
18 3HG2 VAL 3 3HG2 VAL 3 0.651 1.079 -6.311
19 H CYS 4 H CYS 4 1.028 -1.385 -2.410
20 HA CYS 4 HA CYS 4 -0.207 -4.039 -2.118
21 1HB CYS 4 1HB CYS 4 1.983 -2.789 -0.456
22 2HB CYS 4 2HB CYS 4 1.015 -4.138 0.120
23 H CYS 5 H CYS 5 -1.949 -4.138 -0.805
24 HA CYS 5 HA CYS 5 -2.855 -1.617 0.375
25 1HB CYS 5 1HB CYS 5 -4.457 -4.109 -0.258
26 2HB CYS 5 2HB CYS 5 -5.100 -2.558 0.271
27 H GLY 6 H GLY 6 -2.862 -1.412 2.492
28 1HA GLY 6 1HA GLY 6 -1.778 -2.461 4.493
29 2HA GLY 6 2HA GLY 6 -2.764 -3.869 4.137
30 H TYR 7 H TYR 7 -2.584 -0.889 5.720
31 HA TYR 7 HA TYR 7 -4.949 -1.337 7.216
32 1HB TYR 7 1HB TYR 7 -4.337 1.080 8.044
33 2HB TYR 7 2HB TYR 7 -3.327 -0.292 8.479
34 HD1 TYR 7 HD1 TYR 7 -1.089 0.229 8.493
35 HD2 TYR 7 HD2 TYR 7 -3.551 1.991 5.502
36 HE1 TYR 7 HE1 TYR 7 0.879 1.357 7.542
37 HE2 TYR 7 HE2 TYR 7 -1.592 3.121 4.546
38 HH TYR 7 HH TYR 7 1.179 3.605 6.061
39 H LYS 8 H LYS 8 -6.078 -1.403 4.987
40 HA LYS 8 HA LYS 8 -7.656 -0.648 3.572
41 1HB LYS 8 1HB LYS 8 -9.386 0.680 4.427
42 2HB LYS 8 2HB LYS 8 -8.713 -0.118 5.837
43 1HG LYS 8 1HG LYS 8 -7.428 1.960 6.314
44 2HG LYS 8 2HG LYS 8 -8.291 2.736 4.987
45 1HD LYS 8 1HD LYS 8 -10.421 2.275 6.126
46 2HD LYS 8 2HD LYS 8 -9.532 1.542 7.464
47 1HE LYS 8 1HE LYS 8 -9.433 4.412 6.550
48 2HE LYS 8 2HE LYS 8 -10.081 3.795 8.071
49 1HZ LYS 8 1HZ LYS 8 -7.267 3.275 7.402
50 2HZ LYS 8 2HZ LYS 8 -7.702 4.808 7.970
51 3HZ LYS 8 3HZ LYS 8 -7.997 3.439 8.919
52 H LEU 9 H LEU 9 -5.006 0.338 3.280
53 HA LEU 9 HA LEU 9 -5.576 2.500 1.447
54 1HB LEU 9 1HB LEU 9 -5.020 3.678 3.531
55 2HB LEU 9 2HB LEU 9 -3.516 2.785 3.641
56 HG LEU 9 HG LEU 9 -2.769 3.858 1.524
57 1HD1 LEU 9 1HD1 LEU 9 -5.436 4.491 1.214
58 2HD1 LEU 9 2HD1 LEU 9 -4.691 6.031 1.647
59 3HD1 LEU 9 3HD1 LEU 9 -4.094 5.122 0.258
60 1HD2 LEU 9 1HD2 LEU 9 -3.329 5.293 4.044
61 2HD2 LEU 9 2HD2 LEU 9 -1.797 4.988 3.224
62 3HD2 LEU 9 3HD2 LEU 9 -2.858 6.281 2.661
63 H CYS 10 H CYS 10 -4.633 1.959 -0.390
64 HA CYS 10 HA CYS 10 -2.505 -0.019 -0.372
65 1HB CYS 10 1HB CYS 10 -3.847 1.252 -2.765
66 2HB CYS 10 2HB CYS 10 -2.897 -0.228 -2.737
67 H HIS 11 H HIS 11 -0.439 0.380 -0.833
68 HA HIS 11 HA HIS 11 0.376 2.837 -2.136
69 1HB HIS 11 1HB HIS 11 1.939 3.489 -0.337
70 2HB HIS 11 2HB HIS 11 0.269 3.567 0.200
71 HD1 HIS 11 HD1 HIS 11 -0.504 1.328 1.633
72 HD2 HIS 11 HD2 HIS 11 3.566 2.142 1.356
73 HE1 HIS 11 HE1 HIS 11 0.573 0.023 3.491
74 H CYS 13 H CYS 13 4.458 -1.428 -3.050
75 HA CYS 13 HA CYS 13 4.978 -1.678 -0.264
76 1HB CYS 13 1HB CYS 13 6.103 -3.710 -2.093
77 2HB CYS 13 2HB CYS 13 5.074 -3.913 -0.678
78 H ALA 14 H ALA 14 7.109 -1.838 -3.101
79 HA ALA 14 HA ALA 14 9.204 -0.409 -1.805
80 1HB ALA 14 1HB ALA 14 10.571 -2.791 -2.410
81 2HB ALA 14 2HB ALA 14 9.161 -3.256 -1.458
82 3HB ALA 14 3HB ALA 14 10.304 -2.075 -0.821
83 H GLY 15 H GLY 15 7.827 -0.012 -4.155
84 1HA GLY 15 1HA GLY 15 10.000 0.117 -6.035
85 2HA GLY 15 2HA GLY 15 8.377 0.747 -6.272
No H/Q in entry = 85
Start of MODEL 2
1 H ASN 1 H ASN 1 7.919 -3.999 -5.760
2 HA ASN 1 HA ASN 1 7.134 -6.783 -5.883
3 1HB ASN 1 1HB ASN 1 7.295 -6.401 -3.467
4 2HB ASN 1 2HB ASN 1 6.228 -5.007 -3.605
5 1HD2 ASN 1 1HD2 ASN 1 4.196 -5.378 -3.102
6 2HD2 ASN 1 2HD2 ASN 1 3.378 -6.894 -3.212
7 H GLY 2 H GLY 2 5.902 -3.472 -5.408
8 1HA GLY 2 1HA GLY 2 3.687 -4.143 -7.235
9 2HA GLY 2 2HA GLY 2 4.637 -2.690 -7.490
10 H VAL 3 H VAL 3 1.777 -3.223 -6.782
11 HA VAL 3 HA VAL 3 1.600 -1.154 -4.745
12 HB VAL 3 HB VAL 3 -0.694 -2.506 -6.161
13 1HG1 VAL 3 1HG1 VAL 3 -0.756 -0.864 -4.008
14 2HG1 VAL 3 2HG1 VAL 3 -0.896 0.299 -5.327
15 3HG1 VAL 3 3HG1 VAL 3 -2.061 -1.017 -5.185
16 1HG2 VAL 3 1HG2 VAL 3 1.268 -1.041 -7.419
17 2HG2 VAL 3 2HG2 VAL 3 -0.366 -1.311 -8.022
18 3HG2 VAL 3 3HG2 VAL 3 0.008 0.152 -7.113
19 H CYS 4 H CYS 4 0.864 -1.469 -2.704
20 HA CYS 4 HA CYS 4 -0.111 -4.142 -1.986
21 1HB CYS 4 1HB CYS 4 1.286 -3.883 0.154
22 2HB CYS 4 2HB CYS 4 2.146 -4.296 -1.324
23 H CYS 5 H CYS 5 -1.996 -3.980 -0.986
24 HA CYS 5 HA CYS 5 -2.700 -1.435 0.280
25 1HB CYS 5 1HB CYS 5 -4.581 -3.671 -0.498
26 2HB CYS 5 2HB CYS 5 -4.997 -2.009 -0.095
27 H GLY 6 H GLY 6 -2.784 -1.341 2.403
28 1HA GLY 6 1HA GLY 6 -2.016 -2.484 4.440
29 2HA GLY 6 2HA GLY 6 -2.918 -3.889 3.901
30 H TYR 7 H TYR 7 -3.015 -0.934 5.584
31 HA TYR 7 HA TYR 7 -5.454 -1.551 6.885
32 1HB TYR 7 1HB TYR 7 -5.050 0.902 7.772
33 2HB TYR 7 2HB TYR 7 -4.042 -0.433 8.312
34 HD1 TYR 7 HD1 TYR 7 -1.838 0.159 8.561
35 HD2 TYR 7 HD2 TYR 7 -4.032 1.864 5.339
36 HE1 TYR 7 HE1 TYR 7 0.175 1.368 7.836
37 HE2 TYR 7 HE2 TYR 7 -2.024 3.075 4.605
38 HH TYR 7 HH TYR 7 0.474 3.724 6.344
39 H LYS 8 H LYS 8 -6.504 -1.685 4.713
40 HA LYS 8 HA LYS 8 -7.930 -0.992 3.108
41 1HB LYS 8 1HB LYS 8 -9.744 0.518 3.783
42 2HB LYS 8 2HB LYS 8 -9.443 -0.729 4.977
43 1HG LYS 8 1HG LYS 8 -8.603 0.771 6.522
44 2HG LYS 8 2HG LYS 8 -8.214 1.975 5.294
45 1HD LYS 8 1HD LYS 8 -11.067 1.231 5.625
46 2HD LYS 8 2HD LYS 8 -10.326 2.199 6.901
47 1HE LYS 8 1HE LYS 8 -11.399 3.608 5.209
48 2HE LYS 8 2HE LYS 8 -9.658 3.876 5.269
49 1HZ LYS 8 1HZ LYS 8 -10.983 2.104 3.292
50 2HZ LYS 8 2HZ LYS 8 -10.602 3.723 2.994
51 3HZ LYS 8 3HZ LYS 8 -9.364 2.605 3.292
52 H LEU 9 H LEU 9 -5.396 0.138 2.991
53 HA LEU 9 HA LEU 9 -5.933 2.353 1.216
54 1HB LEU 9 1HB LEU 9 -5.541 3.451 3.394
55 2HB LEU 9 2HB LEU 9 -4.010 2.610 3.538
56 HG LEU 9 HG LEU 9 -3.202 3.812 1.515
57 1HD1 LEU 9 1HD1 LEU 9 -5.956 4.525 1.321
58 2HD1 LEU 9 2HD1 LEU 9 -4.992 5.992 1.488
59 3HD1 LEU 9 3HD1 LEU 9 -4.644 4.849 0.191
60 1HD2 LEU 9 1HD2 LEU 9 -3.116 4.611 4.033
61 2HD2 LEU 9 2HD2 LEU 9 -2.507 5.620 2.721
62 3HD2 LEU 9 3HD2 LEU 9 -4.107 5.925 3.398
63 H CYS 10 H CYS 10 -4.628 2.188 -0.525
64 HA CYS 10 HA CYS 10 -2.664 0.051 -0.482
65 1HB CYS 10 1HB CYS 10 -3.672 1.699 -2.809
66 2HB CYS 10 2HB CYS 10 -2.654 0.267 -2.917
67 H HIS 11 H HIS 11 -0.557 0.288 -0.644
68 HA HIS 11 HA HIS 11 0.567 2.985 -1.022
69 1HB HIS 11 1HB HIS 11 0.525 2.252 1.389
70 2HB HIS 11 2HB HIS 11 1.533 0.886 0.945
71 HD1 HIS 11 HD1 HIS 11 3.975 1.657 -0.133
72 HD2 HIS 11 HD2 HIS 11 1.905 4.422 2.189
73 HE1 HIS 11 HE1 HIS 11 5.680 3.366 0.564
74 H CYS 13 H CYS 13 4.356 -0.974 -3.593
75 HA CYS 13 HA CYS 13 6.310 -0.993 -1.393
76 1HB CYS 13 1HB CYS 13 4.616 -3.130 -2.641
77 2HB CYS 13 2HB CYS 13 6.144 -3.577 -1.893
78 H ALA 14 H ALA 14 8.362 -0.850 -1.974
79 HA ALA 14 HA ALA 14 9.215 -0.852 -4.660
80 1HB ALA 14 1HB ALA 14 10.288 -0.121 -2.171
81 2HB ALA 14 2HB ALA 14 10.970 0.170 -3.771
82 3HB ALA 14 3HB ALA 14 11.411 -1.285 -2.875
83 H GLY 15 H GLY 15 9.912 -2.417 -5.951
84 1HA GLY 15 1HA GLY 15 11.214 -4.770 -5.038
85 2HA GLY 15 2HA GLY 15 10.716 -4.440 -6.686
No H/Q in entry = 85
Start of MODEL 3
1 H ASN 1 H ASN 1 8.034 -3.813 -5.671
2 HA ASN 1 HA ASN 1 7.253 -6.593 -5.437
3 1HB ASN 1 1HB ASN 1 7.617 -5.766 -3.092
4 2HB ASN 1 2HB ASN 1 6.339 -4.590 -3.365
5 1HD2 ASN 1 1HD2 ASN 1 5.554 -7.359 -5.041
6 2HD2 ASN 1 2HD2 ASN 1 4.544 -8.102 -3.854
7 H GLY 2 H GLY 2 6.007 -3.254 -5.237
8 1HA GLY 2 1HA GLY 2 3.765 -4.118 -6.956
9 2HA GLY 2 2HA GLY 2 4.644 -2.635 -7.290
10 H VAL 3 H VAL 3 1.812 -3.144 -6.589
11 HA VAL 3 HA VAL 3 1.646 -1.098 -4.531
12 HB VAL 3 HB VAL 3 0.267 -0.683 -6.427
13 1HG1 VAL 3 1HG1 VAL 3 -0.965 -3.390 -5.949
14 2HG1 VAL 3 2HG1 VAL 3 -1.567 -2.197 -7.100
15 3HG1 VAL 3 3HG1 VAL 3 0.030 -2.910 -7.324
16 1HG2 VAL 3 1HG2 VAL 3 -1.212 -1.456 -3.947
17 2HG2 VAL 3 2HG2 VAL 3 -0.796 0.151 -4.542
18 3HG2 VAL 3 3HG2 VAL 3 -2.061 -0.784 -5.339
19 H CYS 4 H CYS 4 0.978 -1.411 -2.529
20 HA CYS 4 HA CYS 4 0.033 -4.110 -1.794
21 1HB CYS 4 1HB CYS 4 1.658 -2.293 -0.016
22 2HB CYS 4 2HB CYS 4 1.263 -3.984 0.254
23 H CYS 5 H CYS 5 -1.971 -4.086 -1.017
24 HA CYS 5 HA CYS 5 -3.001 -1.608 0.161
25 1HB CYS 5 1HB CYS 5 -4.519 -3.987 -0.934
26 2HB CYS 5 2HB CYS 5 -5.236 -2.500 -0.321
27 H GLY 6 H GLY 6 -3.165 -1.542 2.280
28 1HA GLY 6 1HA GLY 6 -2.609 -2.553 4.394
29 2HA GLY 6 2HA GLY 6 -3.189 -4.087 3.767
30 H TYR 7 H TYR 7 -3.869 -1.642 5.808
31 HA TYR 7 HA TYR 7 -6.494 -2.554 6.380
32 1HB TYR 7 1HB TYR 7 -6.396 -0.485 7.976
33 2HB TYR 7 2HB TYR 7 -5.374 -1.882 8.285
34 HD1 TYR 7 HD1 TYR 7 -3.293 -1.312 9.064
35 HD2 TYR 7 HD2 TYR 7 -5.102 1.191 6.137
36 HE1 TYR 7 HE1 TYR 7 -1.302 0.131 9.073
37 HE2 TYR 7 HE2 TYR 7 -3.116 2.637 6.138
38 HH TYR 7 HH TYR 7 -1.012 2.877 8.355
39 H LYS 8 H LYS 8 -6.906 -1.963 3.943
40 HA LYS 8 HA LYS 8 -8.304 -0.895 2.510
41 1HB LYS 8 1HB LYS 8 -9.075 0.766 4.921
42 2HB LYS 8 2HB LYS 8 -9.895 0.806 3.367
43 1HG LYS 8 1HG LYS 8 -9.686 -1.587 5.182
44 2HG LYS 8 2HG LYS 8 -11.102 -0.555 4.986
45 1HD LYS 8 1HD LYS 8 -11.241 -1.188 2.629
46 2HD LYS 8 2HD LYS 8 -9.815 -2.210 2.816
47 1HE LYS 8 1HE LYS 8 -12.440 -2.559 4.259
48 2HE LYS 8 2HE LYS 8 -11.883 -3.519 2.890
49 1HZ LYS 8 1HZ LYS 8 -10.315 -3.332 5.391
50 2HZ LYS 8 2HZ LYS 8 -11.548 -4.475 5.203
51 3HZ LYS 8 3HZ LYS 8 -10.211 -4.496 4.168
52 H LEU 9 H LEU 9 -5.606 -0.174 2.804
53 HA LEU 9 HA LEU 9 -5.667 2.391 1.467
54 1HB LEU 9 1HB LEU 9 -5.326 2.984 3.835
55 2HB LEU 9 2HB LEU 9 -3.943 1.910 3.904
56 HG LEU 9 HG LEU 9 -2.796 3.332 2.223
57 1HD1 LEU 9 1HD1 LEU 9 -5.114 4.250 1.437
58 2HD1 LEU 9 2HD1 LEU 9 -4.828 5.459 2.687
59 3HD1 LEU 9 3HD1 LEU 9 -3.677 5.269 1.365
60 1HD2 LEU 9 1HD2 LEU 9 -2.575 3.610 4.721
61 2HD2 LEU 9 2HD2 LEU 9 -2.150 5.019 3.748
62 3HD2 LEU 9 3HD2 LEU 9 -3.702 4.960 4.582
63 H CYS 10 H CYS 10 -4.479 2.167 -0.296
64 HA CYS 10 HA CYS 10 -2.526 -0.002 -0.403
65 1HB CYS 10 1HB CYS 10 -3.628 1.657 -2.677
66 2HB CYS 10 2HB CYS 10 -2.674 0.186 -2.813
67 H HIS 11 H HIS 11 -0.407 0.305 -0.793
68 HA HIS 11 HA HIS 11 0.570 2.981 -1.422
69 1HB HIS 11 1HB HIS 11 2.247 2.907 0.392
70 2HB HIS 11 2HB HIS 11 0.606 2.948 1.018
71 HD1 HIS 11 HD1 HIS 11 3.260 0.289 0.282
72 HD2 HIS 11 HD2 HIS 11 0.186 1.124 2.958
73 HE1 HIS 11 HE1 HIS 11 3.341 -1.544 1.999
74 H CYS 13 H CYS 13 4.750 -0.869 -3.713
75 HA CYS 13 HA CYS 13 6.642 -0.525 -1.478
76 1HB CYS 13 1HB CYS 13 5.483 -3.103 -2.571
77 2HB CYS 13 2HB CYS 13 6.617 -2.969 -1.235
78 H ALA 14 H ALA 14 8.726 -0.510 -2.044
79 HA ALA 14 HA ALA 14 9.542 -0.593 -4.735
80 1HB ALA 14 1HB ALA 14 10.628 0.384 -2.461
81 2HB ALA 14 2HB ALA 14 11.512 0.179 -3.973
82 3HB ALA 14 3HB ALA 14 11.627 -1.049 -2.712
83 H GLY 15 H GLY 15 10.013 -2.235 -6.014
84 1HA GLY 15 1HA GLY 15 11.391 -4.562 -5.156
85 2HA GLY 15 2HA GLY 15 10.704 -4.299 -6.746
No H/Q in entry = 85
Start of MODEL 4
1 H ASN 1 H ASN 1 7.890 -3.835 -5.169
2 HA ASN 1 HA ASN 1 7.004 -6.638 -5.143
3 1HB ASN 1 1HB ASN 1 6.366 -4.542 -3.061
4 2HB ASN 1 2HB ASN 1 5.493 -6.060 -3.212
5 1HD2 ASN 1 1HD2 ASN 1 6.220 -7.729 -2.096
6 2HD2 ASN 1 2HD2 ASN 1 7.778 -7.850 -1.366
7 H GLY 2 H GLY 2 6.054 -3.239 -5.356
8 1HA GLY 2 1HA GLY 2 3.719 -4.113 -6.943
9 2HA GLY 2 2HA GLY 2 4.620 -2.644 -7.280
10 H VAL 3 H VAL 3 1.772 -3.154 -6.572
11 HA VAL 3 HA VAL 3 1.586 -1.040 -4.575
12 HB VAL 3 HB VAL 3 -0.735 -2.380 -5.938
13 1HG1 VAL 3 1HG1 VAL 3 -0.330 0.130 -4.385
14 2HG1 VAL 3 2HG1 VAL 3 -1.599 0.062 -5.608
15 3HG1 VAL 3 3HG1 VAL 3 -1.611 -1.076 -4.263
16 1HG2 VAL 3 1HG2 VAL 3 0.861 -1.585 -7.648
17 2HG2 VAL 3 2HG2 VAL 3 -0.662 -0.696 -7.675
18 3HG2 VAL 3 3HG2 VAL 3 0.771 0.030 -6.946
19 H CYS 4 H CYS 4 1.043 -1.381 -2.519
20 HA CYS 4 HA CYS 4 0.124 -4.079 -1.758
21 1HB CYS 4 1HB CYS 4 1.703 -2.167 -0.029
22 2HB CYS 4 2HB CYS 4 1.315 -3.844 0.325
23 H CYS 5 H CYS 5 -1.877 -4.114 -0.982
24 HA CYS 5 HA CYS 5 -2.998 -1.663 0.171
25 1HB CYS 5 1HB CYS 5 -4.430 -4.081 -0.959
26 2HB CYS 5 2HB CYS 5 -5.203 -2.623 -0.336
27 H GLY 6 H GLY 6 -3.509 -1.634 2.259
28 1HA GLY 6 1HA GLY 6 -2.647 -2.966 4.282
29 2HA GLY 6 2HA GLY 6 -3.714 -4.220 3.671
30 H TYR 7 H TYR 7 -3.460 -1.344 5.474
31 HA TYR 7 HA TYR 7 -5.977 -1.691 6.725
32 1HB TYR 7 1HB TYR 7 -5.274 0.664 7.700
33 2HB TYR 7 2HB TYR 7 -4.441 -0.806 8.191
34 HD1 TYR 7 HD1 TYR 7 -4.155 1.594 5.317
35 HD2 TYR 7 HD2 TYR 7 -2.171 -0.532 8.423
36 HE1 TYR 7 HE1 TYR 7 -2.009 2.552 4.593
37 HE2 TYR 7 HE2 TYR 7 -0.021 0.423 7.709
38 HH TYR 7 HH TYR 7 0.636 2.697 6.362
39 H LYS 8 H LYS 8 -6.938 -1.593 4.448
40 HA LYS 8 HA LYS 8 -8.263 -0.651 2.883
41 1HB LYS 8 1HB LYS 8 -9.988 0.812 3.616
42 2HB LYS 8 2HB LYS 8 -9.631 -0.266 4.954
43 1HG LYS 8 1HG LYS 8 -8.513 1.441 6.149
44 2HG LYS 8 2HG LYS 8 -8.500 2.510 4.742
45 1HD LYS 8 1HD LYS 8 -11.002 2.513 4.836
46 2HD LYS 8 2HD LYS 8 -10.884 1.643 6.369
47 1HE LYS 8 1HE LYS 8 -11.153 4.082 6.666
48 2HE LYS 8 2HE LYS 8 -9.656 3.464 7.362
49 1HZ LYS 8 1HZ LYS 8 -8.823 4.117 4.925
50 2HZ LYS 8 2HZ LYS 8 -10.052 5.264 5.115
51 3HZ LYS 8 3HZ LYS 8 -8.785 5.192 6.230
52 H LEU 9 H LEU 9 -5.586 0.182 2.929
53 HA LEU 9 HA LEU 9 -5.796 2.525 1.254
54 1HB LEU 9 1HB LEU 9 -5.406 3.472 3.495
55 2HB LEU 9 2HB LEU 9 -3.988 2.459 3.680
56 HG LEU 9 HG LEU 9 -2.930 3.655 1.775
57 1HD1 LEU 9 1HD1 LEU 9 -5.563 4.665 1.432
58 2HD1 LEU 9 2HD1 LEU 9 -4.489 6.019 1.785
59 3HD1 LEU 9 3HD1 LEU 9 -4.136 4.941 0.434
60 1HD2 LEU 9 1HD2 LEU 9 -2.954 4.324 4.346
61 2HD2 LEU 9 2HD2 LEU 9 -2.099 5.277 3.133
62 3HD2 LEU 9 3HD2 LEU 9 -3.694 5.784 3.690
63 H CYS 10 H CYS 10 -4.456 2.295 -0.440
64 HA CYS 10 HA CYS 10 -2.571 0.058 -0.340
65 1HB CYS 10 1HB CYS 10 -3.620 1.554 -2.759
66 2HB CYS 10 2HB CYS 10 -2.650 0.085 -2.777
67 H HIS 11 H HIS 11 -0.427 0.329 -0.642
68 HA HIS 11 HA HIS 11 0.568 2.964 -1.436
69 1HB HIS 11 1HB HIS 11 2.264 2.921 0.381
70 2HB HIS 11 2HB HIS 11 0.620 3.065 0.983
71 HD1 HIS 11 HD1 HIS 11 3.174 0.270 0.440
72 HD2 HIS 11 HD2 HIS 11 0.096 1.371 3.014
73 HE1 HIS 11 HE1 HIS 11 3.160 -1.464 2.260
74 H CYS 13 H CYS 13 4.816 -0.897 -3.738
75 HA CYS 13 HA CYS 13 6.730 -0.473 -1.538
76 1HB CYS 13 1HB CYS 13 5.581 -3.120 -2.463
77 2HB CYS 13 2HB CYS 13 6.697 -2.876 -1.126
78 H ALA 14 H ALA 14 8.807 -0.518 -2.179
79 HA ALA 14 HA ALA 14 9.514 -0.715 -4.891
80 1HB ALA 14 1HB ALA 14 10.735 0.188 -2.586
81 2HB ALA 14 2HB ALA 14 11.446 0.154 -4.200
82 3HB ALA 14 3HB ALA 14 11.734 -1.178 -3.081
83 H GLY 15 H GLY 15 9.786 -2.426 -6.124
84 1HA GLY 15 1HA GLY 15 11.145 -4.779 -5.208
85 2HA GLY 15 2HA GLY 15 10.501 -4.507 -6.817
No H/Q in entry = 85
Start of MODEL 5
1 H ASN 1 H ASN 1 7.984 -1.408 -5.888
2 HA ASN 1 HA ASN 1 8.130 -2.311 -8.628
3 1HB ASN 1 1HB ASN 1 8.595 -4.505 -7.692
4 2HB ASN 1 2HB ASN 1 9.591 -3.301 -6.881
5 1HD2 ASN 1 1HD2 ASN 1 7.914 -5.984 -6.336
6 2HD2 ASN 1 2HD2 ASN 1 7.406 -5.723 -4.705
7 H GLY 2 H GLY 2 5.824 -2.105 -6.062
8 1HA GLY 2 1HA GLY 2 4.013 -4.081 -6.676
9 2HA GLY 2 2HA GLY 2 3.668 -2.766 -7.794
10 H VAL 3 H VAL 3 1.602 -2.627 -6.742
11 HA VAL 3 HA VAL 3 1.689 -0.782 -4.500
12 HB VAL 3 HB VAL 3 -0.805 -1.781 -5.861
13 1HG1 VAL 3 1HG1 VAL 3 -0.354 -0.052 -3.725
14 2HG1 VAL 3 2HG1 VAL 3 -0.754 0.993 -5.089
15 3HG1 VAL 3 3HG1 VAL 3 -1.864 -0.289 -4.607
16 1HG2 VAL 3 1HG2 VAL 3 0.711 -0.992 -7.613
17 2HG2 VAL 3 2HG2 VAL 3 -0.661 0.097 -7.414
18 3HG2 VAL 3 3HG2 VAL 3 0.913 0.534 -6.752
19 H CYS 4 H CYS 4 1.119 -1.284 -2.473
20 HA CYS 4 HA CYS 4 0.055 -3.983 -1.973
21 1HB CYS 4 1HB CYS 4 1.941 -2.415 -0.199
22 2HB CYS 4 2HB CYS 4 1.404 -4.074 0.043
23 H CYS 5 H CYS 5 -1.834 -4.017 -0.905
24 HA CYS 5 HA CYS 5 -2.770 -1.532 0.324
25 1HB CYS 5 1HB CYS 5 -4.412 -3.964 -0.410
26 2HB CYS 5 2HB CYS 5 -5.006 -2.359 0.004
27 H GLY 6 H GLY 6 -3.022 -1.425 2.463
28 1HA GLY 6 1HA GLY 6 -1.931 -2.901 4.349
29 2HA GLY 6 2HA GLY 6 -3.302 -3.927 3.977
30 H TYR 7 H TYR 7 -2.461 -0.656 5.035
31 HA TYR 7 HA TYR 7 -4.411 -0.762 7.113
32 1HB TYR 7 1HB TYR 7 -3.662 1.703 7.412
33 2HB TYR 7 2HB TYR 7 -2.526 0.408 7.757
34 HD1 TYR 7 HD1 TYR 7 -0.383 0.964 7.177
35 HD2 TYR 7 HD2 TYR 7 -3.549 2.256 4.646
36 HE1 TYR 7 HE1 TYR 7 1.256 1.996 5.664
37 HE2 TYR 7 HE2 TYR 7 -1.916 3.287 3.124
38 HH TYR 7 HH TYR 7 0.848 4.190 3.744
39 H LYS 8 H LYS 8 -5.946 -1.150 5.039
40 HA LYS 8 HA LYS 8 -7.870 -0.512 4.011
41 1HB LYS 8 1HB LYS 8 -8.285 0.423 6.346
42 2HB LYS 8 2HB LYS 8 -7.801 1.986 5.706
43 1HG LYS 8 1HG LYS 8 -9.629 1.791 4.027
44 2HG LYS 8 2HG LYS 8 -10.156 0.322 4.849
45 1HD LYS 8 1HD LYS 8 -9.956 3.065 6.091
46 2HD LYS 8 2HD LYS 8 -11.447 2.275 5.573
47 1HE LYS 8 1HE LYS 8 -11.086 0.499 7.198
48 2HE LYS 8 2HE LYS 8 -9.566 1.242 7.695
49 1HZ LYS 8 1HZ LYS 8 -10.829 3.198 8.403
50 2HZ LYS 8 2HZ LYS 8 -12.273 2.427 7.987
51 3HZ LYS 8 3HZ LYS 8 -11.311 1.807 9.235
52 H LEU 9 H LEU 9 -5.107 0.616 3.316
53 HA LEU 9 HA LEU 9 -6.023 2.239 1.107
54 1HB LEU 9 1HB LEU 9 -5.576 3.880 2.901
55 2HB LEU 9 2HB LEU 9 -3.948 3.250 3.060
56 HG LEU 9 HG LEU 9 -3.490 3.971 0.719
57 1HD1 LEU 9 1HD1 LEU 9 -6.300 4.326 0.679
58 2HD1 LEU 9 2HD1 LEU 9 -5.547 5.903 0.443
59 3HD1 LEU 9 3HD1 LEU 9 -5.143 4.563 -0.630
60 1HD2 LEU 9 1HD2 LEU 9 -2.994 5.345 2.778
61 2HD2 LEU 9 2HD2 LEU 9 -3.119 6.240 1.264
62 3HD2 LEU 9 3HD2 LEU 9 -4.457 6.260 2.411
63 H CYS 10 H CYS 10 -4.662 2.088 -0.650
64 HA CYS 10 HA CYS 10 -2.643 0.006 -0.428
65 1HB CYS 10 1HB CYS 10 -3.726 1.372 -2.903
66 2HB CYS 10 2HB CYS 10 -2.710 -0.064 -2.864
67 H HIS 11 H HIS 11 -0.528 0.298 -0.761
68 HA HIS 11 HA HIS 11 0.511 2.853 -1.710
69 1HB HIS 11 1HB HIS 11 0.324 3.201 0.697
70 2HB HIS 11 2HB HIS 11 1.124 1.668 1.013
71 HD1 HIS 11 HD1 HIS 11 1.979 4.946 -0.745
72 HD2 HIS 11 HD2 HIS 11 3.742 1.979 1.571
73 HE1 HIS 11 HE1 HIS 11 4.354 5.692 -0.390
74 H CYS 13 H CYS 13 4.555 -1.503 -2.813
75 HA CYS 13 HA CYS 13 5.636 -1.124 -0.231
76 1HB CYS 13 1HB CYS 13 5.895 -3.274 -2.300
77 2HB CYS 13 2HB CYS 13 6.923 -3.304 -0.872
78 H ALA 14 H ALA 14 7.158 -1.189 -3.430
79 HA ALA 14 HA ALA 14 9.226 0.580 -2.511
80 1HB ALA 14 1HB ALA 14 11.070 -0.790 -2.574
81 2HB ALA 14 2HB ALA 14 9.863 -1.905 -1.935
82 3HB ALA 14 3HB ALA 14 10.299 -1.960 -3.643
83 H GLY 15 H GLY 15 7.213 0.739 -4.449
84 1HA GLY 15 1HA GLY 15 8.745 1.612 -6.696
85 2HA GLY 15 2HA GLY 15 6.997 1.678 -6.543
No H/Q in entry = 85
Start of MODEL 6
1 H ASN 1 H ASN 1 8.144 -3.598 -5.770
2 HA ASN 1 HA ASN 1 7.597 -6.437 -5.628
3 1HB ASN 1 1HB ASN 1 7.821 -5.828 -3.258
4 2HB ASN 1 2HB ASN 1 6.617 -4.559 -3.466
5 1HD2 ASN 1 1HD2 ASN 1 4.690 -5.097 -2.732
6 2HD2 ASN 1 2HD2 ASN 1 4.011 -6.683 -2.725
7 H GLY 2 H GLY 2 6.018 -3.260 -5.250
8 1HA GLY 2 1HA GLY 2 3.834 -4.243 -6.958
9 2HA GLY 2 2HA GLY 2 4.650 -2.746 -7.379
10 H VAL 3 H VAL 3 1.860 -3.276 -6.615
11 HA VAL 3 HA VAL 3 1.679 -1.176 -4.613
12 HB VAL 3 HB VAL 3 0.268 -0.862 -6.518
13 1HG1 VAL 3 1HG1 VAL 3 -0.374 -3.696 -6.117
14 2HG1 VAL 3 2HG1 VAL 3 -1.744 -2.676 -6.554
15 3HG1 VAL 3 3HG1 VAL 3 -0.325 -2.741 -7.599
16 1HG2 VAL 3 1HG2 VAL 3 -0.678 -0.905 -3.883
17 2HG2 VAL 3 2HG2 VAL 3 -1.299 0.038 -5.239
18 3HG2 VAL 3 3HG2 VAL 3 -1.979 -1.550 -4.884
19 H CYS 4 H CYS 4 0.948 -1.418 -2.605
20 HA CYS 4 HA CYS 4 0.106 -4.117 -1.763
21 1HB CYS 4 1HB CYS 4 1.714 -2.161 -0.110
22 2HB CYS 4 2HB CYS 4 1.301 -3.816 0.319
23 H CYS 5 H CYS 5 -1.897 -4.122 -0.941
24 HA CYS 5 HA CYS 5 -2.951 -1.601 0.135
25 1HB CYS 5 1HB CYS 5 -4.472 -3.939 -1.038
26 2HB CYS 5 2HB CYS 5 -5.187 -2.451 -0.426
27 H GLY 6 H GLY 6 -3.281 -1.520 2.228
28 1HA GLY 6 1HA GLY 6 -2.842 -2.497 4.382
29 2HA GLY 6 2HA GLY 6 -3.345 -4.050 3.737
30 H TYR 7 H TYR 7 -4.200 -1.667 5.755
31 HA TYR 7 HA TYR 7 -6.851 -2.618 6.108
32 1HB TYR 7 1HB TYR 7 -6.895 -0.629 7.792
33 2HB TYR 7 2HB TYR 7 -5.862 -2.015 8.111
34 HD1 TYR 7 HD1 TYR 7 -5.495 1.136 6.094
35 HD2 TYR 7 HD2 TYR 7 -3.877 -1.419 9.086
36 HE1 TYR 7 HE1 TYR 7 -3.549 2.621 6.301
37 HE2 TYR 7 HE2 TYR 7 -1.926 0.062 9.302
38 HH TYR 7 HH TYR 7 -1.752 3.009 8.489
39 H LYS 8 H LYS 8 -7.120 -1.951 3.686
40 HA LYS 8 HA LYS 8 -8.447 -0.846 2.209
41 1HB LYS 8 1HB LYS 8 -9.340 0.760 4.612
42 2HB LYS 8 2HB LYS 8 -10.079 0.837 3.019
43 1HG LYS 8 1HG LYS 8 -9.966 -1.597 4.790
44 2HG LYS 8 2HG LYS 8 -11.371 -0.556 4.544
45 1HD LYS 8 1HD LYS 8 -11.381 -1.137 2.165
46 2HD LYS 8 2HD LYS 8 -9.974 -2.172 2.410
47 1HE LYS 8 1HE LYS 8 -12.678 -2.531 3.698
48 2HE LYS 8 2HE LYS 8 -12.048 -3.470 2.345
49 1HZ LYS 8 1HZ LYS 8 -10.674 -3.338 4.965
50 2HZ LYS 8 2HZ LYS 8 -11.845 -4.506 4.615
51 3HZ LYS 8 3HZ LYS 8 -10.419 -4.442 3.711
52 H LEU 9 H LEU 9 -5.777 -0.153 2.623
53 HA LEU 9 HA LEU 9 -5.755 2.455 1.369
54 1HB LEU 9 1HB LEU 9 -5.491 2.960 3.771
55 2HB LEU 9 2HB LEU 9 -4.125 1.865 3.848
56 HG LEU 9 HG LEU 9 -2.902 3.329 2.260
57 1HD1 LEU 9 1HD1 LEU 9 -5.423 4.932 2.473
58 2HD1 LEU 9 2HD1 LEU 9 -3.880 5.700 2.099
59 3HD1 LEU 9 3HD1 LEU 9 -4.527 4.453 1.032
60 1HD2 LEU 9 1HD2 LEU 9 -2.855 3.515 4.815
61 2HD2 LEU 9 2HD2 LEU 9 -2.229 4.871 3.876
62 3HD2 LEU 9 3HD2 LEU 9 -3.837 4.963 4.593
63 H CYS 10 H CYS 10 -4.439 2.312 -0.335
64 HA CYS 10 HA CYS 10 -2.550 0.079 -0.401
65 1HB CYS 10 1HB CYS 10 -3.589 1.748 -2.697
66 2HB CYS 10 2HB CYS 10 -2.597 0.302 -2.826
67 H HIS 11 H HIS 11 -0.445 0.331 -0.621
68 HA HIS 11 HA HIS 11 0.660 3.005 -1.134
69 1HB HIS 11 1HB HIS 11 0.717 2.701 1.287
70 2HB HIS 11 2HB HIS 11 1.459 1.116 1.101
71 HD1 HIS 11 HD1 HIS 11 2.320 4.712 0.141
72 HD2 HIS 11 HD2 HIS 11 4.132 1.204 1.443
73 HE1 HIS 11 HE1 HIS 11 4.755 5.273 0.413
74 H CYS 13 H CYS 13 4.491 -0.940 -3.548
75 HA CYS 13 HA CYS 13 6.537 -0.429 -1.501
76 1HB CYS 13 1HB CYS 13 5.483 -3.053 -2.591
77 2HB CYS 13 2HB CYS 13 6.694 -2.887 -1.325
78 H ALA 14 H ALA 14 8.568 -0.184 -2.165
79 HA ALA 14 HA ALA 14 9.296 -0.268 -4.883
80 1HB ALA 14 1HB ALA 14 11.470 -0.442 -2.902
81 2HB ALA 14 2HB ALA 14 10.348 0.903 -2.696
82 3HB ALA 14 3HB ALA 14 11.217 0.704 -4.219
83 H GLY 15 H GLY 15 9.974 -1.870 -6.128
84 1HA GLY 15 1HA GLY 15 11.536 -4.051 -5.183
85 2HA GLY 15 2HA GLY 15 10.898 -3.863 -6.804
No H/Q in entry = 85
Start of MODEL 7
1 H ASN 1 H ASN 1 7.996 -2.321 -5.447
2 HA ASN 1 HA ASN 1 8.381 -3.656 -7.987
3 1HB ASN 1 1HB ASN 1 7.796 -5.702 -6.770
4 2HB ASN 1 2HB ASN 1 9.030 -4.799 -5.895
5 1HD2 ASN 1 1HD2 ASN 1 6.369 -6.569 -5.460
6 2HD2 ASN 1 2HD2 ASN 1 5.753 -5.866 -4.006
7 H GLY 2 H GLY 2 5.828 -2.427 -5.985
8 1HA GLY 2 1HA GLY 2 3.654 -3.751 -7.204
9 2HA GLY 2 2HA GLY 2 3.949 -2.215 -8.013
10 H VAL 3 H VAL 3 1.594 -2.815 -6.605
11 HA VAL 3 HA VAL 3 1.802 -0.877 -4.403
12 HB VAL 3 HB VAL 3 -0.708 -1.605 -5.911
13 1HG1 VAL 3 1HG1 VAL 3 -0.738 -0.546 -3.562
14 2HG1 VAL 3 2HG1 VAL 3 -0.214 0.922 -4.387
15 3HG1 VAL 3 3HG1 VAL 3 -1.745 0.163 -4.823
16 1HG2 VAL 3 1HG2 VAL 3 1.382 -0.342 -7.085
17 2HG2 VAL 3 2HG2 VAL 3 -0.307 -0.078 -7.518
18 3HG2 VAL 3 3HG2 VAL 3 0.502 1.028 -6.409
19 H CYS 4 H CYS 4 1.072 -1.406 -2.423
20 HA CYS 4 HA CYS 4 -0.147 -4.061 -2.071
21 1HB CYS 4 1HB CYS 4 1.999 -2.726 -0.416
22 2HB CYS 4 2HB CYS 4 1.064 -4.093 0.168
23 H CYS 5 H CYS 5 -1.947 -4.101 -0.832
24 HA CYS 5 HA CYS 5 -2.813 -1.545 0.307
25 1HB CYS 5 1HB CYS 5 -4.500 -3.969 -0.344
26 2HB CYS 5 2HB CYS 5 -5.082 -2.369 0.103
27 H GLY 6 H GLY 6 -2.693 -1.321 2.403
28 1HA GLY 6 1HA GLY 6 -1.970 -2.087 4.538
29 2HA GLY 6 2HA GLY 6 -2.478 -3.710 4.096
30 H TYR 7 H TYR 7 -3.195 -1.099 5.938
31 HA TYR 7 HA TYR 7 -5.674 -2.153 6.836
32 1HB TYR 7 1HB TYR 7 -5.633 0.073 8.204
33 2HB TYR 7 2HB TYR 7 -4.464 -1.191 8.557
34 HD1 TYR 7 HD1 TYR 7 -4.637 1.630 6.076
35 HD2 TYR 7 HD2 TYR 7 -2.404 -0.350 9.109
36 HE1 TYR 7 HE1 TYR 7 -2.798 3.229 5.758
37 HE2 TYR 7 HE2 TYR 7 -0.560 1.245 8.800
38 HH TYR 7 HH TYR 7 -0.652 3.972 7.677
39 H LYS 8 H LYS 8 -6.373 -1.892 4.432
40 HA LYS 8 HA LYS 8 -7.980 -1.097 3.036
41 1HB LYS 8 1HB LYS 8 -8.630 0.742 5.345
42 2HB LYS 8 2HB LYS 8 -9.586 0.624 3.874
43 1HG LYS 8 1HG LYS 8 -10.121 -1.679 4.358
44 2HG LYS 8 2HG LYS 8 -9.071 -1.652 5.777
45 1HD LYS 8 1HD LYS 8 -11.428 -1.394 6.397
46 2HD LYS 8 2HD LYS 8 -10.488 0.042 6.810
47 1HE LYS 8 1HE LYS 8 -11.279 1.109 4.722
48 2HE LYS 8 2HE LYS 8 -12.282 -0.306 4.411
49 1HZ LYS 8 1HZ LYS 8 -13.260 0.186 6.705
50 2HZ LYS 8 2HZ LYS 8 -12.562 1.719 6.538
51 3HZ LYS 8 3HZ LYS 8 -13.716 1.188 5.422
52 H LEU 9 H LEU 9 -5.317 -0.113 2.999
53 HA LEU 9 HA LEU 9 -5.743 2.246 1.376
54 1HB LEU 9 1HB LEU 9 -5.299 3.163 3.621
55 2HB LEU 9 2HB LEU 9 -3.808 2.245 3.700
56 HG LEU 9 HG LEU 9 -2.942 3.547 1.770
57 1HD1 LEU 9 1HD1 LEU 9 -5.550 5.013 2.100
58 2HD1 LEU 9 2HD1 LEU 9 -4.156 5.685 1.254
59 3HD1 LEU 9 3HD1 LEU 9 -4.924 4.216 0.655
60 1HD2 LEU 9 1HD2 LEU 9 -2.589 4.155 4.204
61 2HD2 LEU 9 2HD2 LEU 9 -2.354 5.451 3.031
62 3HD2 LEU 9 3HD2 LEU 9 -3.839 5.379 3.979
63 H CYS 10 H CYS 10 -4.599 1.996 -0.430
64 HA CYS 10 HA CYS 10 -2.524 -0.052 -0.464
65 1HB CYS 10 1HB CYS 10 -3.744 1.383 -2.822
66 2HB CYS 10 2HB CYS 10 -2.783 -0.088 -2.851
67 H HIS 11 H HIS 11 -0.453 0.323 -0.882
68 HA HIS 11 HA HIS 11 0.468 2.922 -1.820
69 1HB HIS 11 1HB HIS 11 0.282 3.158 0.653
70 2HB HIS 11 2HB HIS 11 1.327 1.758 0.851
71 HD1 HIS 11 HD1 HIS 11 1.514 5.209 -0.760
72 HD2 HIS 11 HD2 HIS 11 3.927 2.425 1.168
73 HE1 HIS 11 HE1 HIS 11 3.770 6.299 -0.554
74 H CYS 13 H CYS 13 4.340 -1.401 -3.030
75 HA CYS 13 HA CYS 13 5.095 -1.552 -0.318
76 1HB CYS 13 1HB CYS 13 6.165 -3.611 -2.137
77 2HB CYS 13 2HB CYS 13 5.181 -3.785 -0.686
78 H ALA 14 H ALA 14 7.110 -1.796 -3.244
79 HA ALA 14 HA ALA 14 9.219 -0.268 -2.066
80 1HB ALA 14 1HB ALA 14 10.240 -2.958 -2.709
81 2HB ALA 14 2HB ALA 14 9.274 -2.838 -1.239
82 3HB ALA 14 3HB ALA 14 10.713 -1.839 -1.431
83 H GLY 15 H GLY 15 7.771 0.054 -4.381
84 1HA GLY 15 1HA GLY 15 9.881 0.179 -6.326
85 2HA GLY 15 2HA GLY 15 8.235 0.756 -6.535
No H/Q in entry = 85
Start of MODEL 8
1 H ASN 1 H ASN 1 8.456 -1.496 -7.002
2 HA ASN 1 HA ASN 1 6.803 -0.082 -8.978
3 1HB ASN 1 1HB ASN 1 9.093 -1.075 -9.612
4 2HB ASN 1 2HB ASN 1 8.295 -2.635 -9.507
5 1HD2 ASN 1 1HD2 ASN 1 6.109 -0.310 -10.518
6 2HD2 ASN 1 2HD2 ASN 1 6.205 -0.592 -12.216
7 H GLY 2 H GLY 2 5.736 -1.160 -6.625
8 1HA GLY 2 1HA GLY 2 4.663 -3.661 -6.585
9 2HA GLY 2 2HA GLY 2 3.679 -2.817 -7.764
10 H VAL 3 H VAL 3 1.840 -2.630 -6.726
11 HA VAL 3 HA VAL 3 1.796 -0.885 -4.387
12 HB VAL 3 HB VAL 3 0.429 -0.187 -6.268
13 1HG1 VAL 3 1HG1 VAL 3 -0.881 -2.869 -5.947
14 2HG1 VAL 3 2HG1 VAL 3 -1.656 -1.529 -6.791
15 3HG1 VAL 3 3HG1 VAL 3 -0.129 -2.179 -7.386
16 1HG2 VAL 3 1HG2 VAL 3 -0.299 -0.015 -3.748
17 2HG2 VAL 3 2HG2 VAL 3 -1.363 0.527 -5.046
18 3HG2 VAL 3 3HG2 VAL 3 -1.619 -1.049 -4.294
19 H CYS 4 H CYS 4 0.792 -1.378 -2.509
20 HA CYS 4 HA CYS 4 -0.283 -4.082 -2.148
21 1HB CYS 4 1HB CYS 4 1.011 -4.282 -0.023
22 2HB CYS 4 2HB CYS 4 2.039 -4.244 -1.453
23 H CYS 5 H CYS 5 -2.025 -4.135 -0.801
24 HA CYS 5 HA CYS 5 -2.837 -1.585 0.391
25 1HB CYS 5 1HB CYS 5 -4.533 -4.017 -0.221
26 2HB CYS 5 2HB CYS 5 -5.114 -2.446 0.322
27 H GLY 6 H GLY 6 -2.672 -1.394 2.509
28 1HA GLY 6 1HA GLY 6 -1.619 -2.458 4.475
29 2HA GLY 6 2HA GLY 6 -2.591 -3.875 4.116
30 H TYR 7 H TYR 7 -2.429 -0.894 5.719
31 HA TYR 7 HA TYR 7 -4.698 -1.440 7.322
32 1HB TYR 7 1HB TYR 7 -4.154 0.984 8.146
33 2HB TYR 7 2HB TYR 7 -3.043 -0.335 8.489
34 HD1 TYR 7 HD1 TYR 7 -0.840 0.296 8.354
35 HD2 TYR 7 HD2 TYR 7 -3.595 1.990 5.589
36 HE1 TYR 7 HE1 TYR 7 0.994 1.550 7.300
37 HE2 TYR 7 HE2 TYR 7 -1.768 3.245 4.529
38 HH TYR 7 HH TYR 7 0.979 3.929 5.803
39 H LYS 8 H LYS 8 -5.864 -1.486 5.016
40 HA LYS 8 HA LYS 8 -7.667 -0.800 3.847
41 1HB LYS 8 1HB LYS 8 -9.299 0.337 4.941
42 2HB LYS 8 2HB LYS 8 -8.242 0.084 6.316
43 1HG LYS 8 1HG LYS 8 -7.265 2.370 5.804
44 2HG LYS 8 2HG LYS 8 -8.621 2.588 4.699
45 1HD LYS 8 1HD LYS 8 -9.232 3.581 6.775
46 2HD LYS 8 2HD LYS 8 -10.148 2.080 6.626
47 1HE LYS 8 1HE LYS 8 -9.219 2.385 8.884
48 2HE LYS 8 2HE LYS 8 -8.585 0.945 8.088
49 1HZ LYS 8 1HZ LYS 8 -7.187 3.558 8.275
50 2HZ LYS 8 2HZ LYS 8 -6.840 2.193 9.210
51 3HZ LYS 8 3HZ LYS 8 -6.576 2.160 7.536
52 H LEU 9 H LEU 9 -4.883 0.438 3.633
53 HA LEU 9 HA LEU 9 -5.644 2.378 1.586
54 1HB LEU 9 1HB LEU 9 -5.015 3.665 3.585
55 2HB LEU 9 2HB LEU 9 -3.478 2.825 3.646
56 HG LEU 9 HG LEU 9 -2.890 3.822 1.444
57 1HD1 LEU 9 1HD1 LEU 9 -5.435 5.386 1.858
58 2HD1 LEU 9 2HD1 LEU 9 -4.217 5.714 0.624
59 3HD1 LEU 9 3HD1 LEU 9 -5.129 4.205 0.585
60 1HD2 LEU 9 1HD2 LEU 9 -3.104 5.133 3.992
61 2HD2 LEU 9 2HD2 LEU 9 -1.835 5.254 2.773
62 3HD2 LEU 9 3HD2 LEU 9 -3.248 6.306 2.683
63 H CYS 10 H CYS 10 -4.595 2.071 -0.259
64 HA CYS 10 HA CYS 10 -2.551 -0.002 -0.343
65 1HB CYS 10 1HB CYS 10 -3.932 1.394 -2.645
66 2HB CYS 10 2HB CYS 10 -2.975 -0.083 -2.725
67 H HIS 11 H HIS 11 -0.471 0.364 -0.878
68 HA HIS 11 HA HIS 11 0.350 2.897 -2.038
69 1HB HIS 11 1HB HIS 11 1.955 3.424 -0.266
70 2HB HIS 11 2HB HIS 11 0.324 3.385 0.387
71 HD1 HIS 11 HD1 HIS 11 3.385 1.100 0.204
72 HD2 HIS 11 HD2 HIS 11 0.072 1.856 2.609
73 HE1 HIS 11 HE1 HIS 11 3.673 -0.356 2.230
74 H CYS 13 H CYS 13 4.725 -1.301 -3.236
75 HA CYS 13 HA CYS 13 5.853 -1.190 -0.515
76 1HB CYS 13 1HB CYS 13 4.385 -3.286 -1.971
77 2HB CYS 13 2HB CYS 13 5.804 -3.854 -1.099
78 H ALA 14 H ALA 14 6.425 -2.788 -3.653
79 HA ALA 14 HA ALA 14 9.277 -2.831 -2.998
80 1HB ALA 14 1HB ALA 14 9.153 -4.280 -5.259
81 2HB ALA 14 2HB ALA 14 7.523 -4.540 -4.639
82 3HB ALA 14 3HB ALA 14 8.920 -4.966 -3.651
83 H GLY 15 H GLY 15 7.883 -0.468 -3.831
84 1HA GLY 15 1HA GLY 15 9.741 0.485 -5.779
85 2HA GLY 15 2HA GLY 15 8.448 1.404 -5.036
No H/Q in entry = 85
Start of MODEL 9
1 H ASN 1 H ASN 1 7.458 -1.066 -5.669
2 HA ASN 1 HA ASN 1 8.591 -2.160 -8.090
3 1HB ASN 1 1HB ASN 1 8.004 -4.536 -7.098
4 2HB ASN 1 2HB ASN 1 9.577 -3.801 -6.814
5 1HD2 ASN 1 1HD2 ASN 1 10.200 -4.306 -4.851
6 2HD2 ASN 1 2HD2 ASN 1 9.235 -4.235 -3.422
7 H GLY 2 H GLY 2 5.948 -2.400 -5.732
8 1HA GLY 2 1HA GLY 2 3.974 -3.659 -7.012
9 2HA GLY 2 2HA GLY 2 4.038 -2.144 -7.905
10 H VAL 3 H VAL 3 1.730 -2.730 -6.668
11 HA VAL 3 HA VAL 3 1.713 -0.837 -4.420
12 HB VAL 3 HB VAL 3 -0.661 -1.669 -6.079
13 1HG1 VAL 3 1HG1 VAL 3 -0.186 0.354 -3.943
14 2HG1 VAL 3 2HG1 VAL 3 -1.402 0.667 -5.181
15 3HG1 VAL 3 3HG1 VAL 3 -1.534 -0.763 -4.158
16 1HG2 VAL 3 1HG2 VAL 3 1.502 -0.119 -6.948
17 2HG2 VAL 3 2HG2 VAL 3 -0.073 -0.291 -7.723
18 3HG2 VAL 3 3HG2 VAL 3 0.209 1.024 -6.581
19 H CYS 4 H CYS 4 0.959 -1.423 -2.498
20 HA CYS 4 HA CYS 4 -0.317 -4.054 -2.195
21 1HB CYS 4 1HB CYS 4 1.970 -2.912 -0.579
22 2HB CYS 4 2HB CYS 4 0.978 -4.248 -0.010
23 H CYS 5 H CYS 5 -2.003 -4.097 -0.765
24 HA CYS 5 HA CYS 5 -2.747 -1.523 0.419
25 1HB CYS 5 1HB CYS 5 -4.502 -3.951 -0.011
26 2HB CYS 5 2HB CYS 5 -5.022 -2.319 0.399
27 H GLY 6 H GLY 6 -2.523 -1.286 2.520
28 1HA GLY 6 1HA GLY 6 -1.427 -2.253 4.496
29 2HA GLY 6 2HA GLY 6 -2.333 -3.722 4.184
30 H TYR 7 H TYR 7 -2.301 -0.686 5.705
31 HA TYR 7 HA TYR 7 -4.518 -1.304 7.356
32 1HB TYR 7 1HB TYR 7 -4.089 1.158 8.119
33 2HB TYR 7 2HB TYR 7 -2.902 -0.089 8.474
34 HD1 TYR 7 HD1 TYR 7 -0.746 0.677 8.314
35 HD2 TYR 7 HD2 TYR 7 -3.609 2.126 5.521
36 HE1 TYR 7 HE1 TYR 7 1.005 2.013 7.220
37 HE2 TYR 7 HE2 TYR 7 -1.865 3.463 4.420
38 HH TYR 7 HH TYR 7 0.765 4.399 5.612
39 H LYS 8 H LYS 8 -5.727 -1.482 5.093
40 HA LYS 8 HA LYS 8 -7.562 -0.862 3.908
41 1HB LYS 8 1HB LYS 8 -8.331 -0.201 6.254
42 2HB LYS 8 2HB LYS 8 -7.902 1.447 5.824
43 1HG LYS 8 1HG LYS 8 -9.487 1.288 3.908
44 2HG LYS 8 2HG LYS 8 -9.992 -0.287 4.526
45 1HD LYS 8 1HD LYS 8 -10.170 2.338 6.008
46 2HD LYS 8 2HD LYS 8 -11.517 1.488 5.247
47 1HE LYS 8 1HE LYS 8 -11.204 -0.394 6.757
48 2HE LYS 8 2HE LYS 8 -9.813 0.406 7.490
49 1HZ LYS 8 1HZ LYS 8 -11.621 2.286 7.831
50 2HZ LYS 8 2HZ LYS 8 -12.659 0.950 7.821
51 3HZ LYS 8 3HZ LYS 8 -11.401 1.038 8.951
52 H LEU 9 H LEU 9 -4.903 0.225 3.391
53 HA LEU 9 HA LEU 9 -5.691 2.244 1.476
54 1HB LEU 9 1HB LEU 9 -5.106 3.554 3.479
55 2HB LEU 9 2HB LEU 9 -3.536 2.775 3.528
56 HG LEU 9 HG LEU 9 -3.002 3.796 1.326
57 1HD1 LEU 9 1HD1 LEU 9 -5.777 4.809 1.640
58 2HD1 LEU 9 2HD1 LEU 9 -4.582 5.859 0.880
59 3HD1 LEU 9 3HD1 LEU 9 -4.924 4.272 0.194
60 1HD2 LEU 9 1HD2 LEU 9 -2.440 4.829 3.561
61 2HD2 LEU 9 2HD2 LEU 9 -2.475 5.932 2.186
62 3HD2 LEU 9 3HD2 LEU 9 -3.827 5.891 3.318
63 H CYS 10 H CYS 10 -4.633 1.941 -0.373
64 HA CYS 10 HA CYS 10 -2.523 -0.062 -0.417
65 1HB CYS 10 1HB CYS 10 -3.877 1.266 -2.770
66 2HB CYS 10 2HB CYS 10 -2.928 -0.214 -2.780
67 H HIS 11 H HIS 11 -0.460 0.349 -0.903
68 HA HIS 11 HA HIS 11 0.342 2.869 -2.094
69 1HB HIS 11 1HB HIS 11 1.913 3.438 -0.274
70 2HB HIS 11 2HB HIS 11 0.246 3.479 0.275
71 HD1 HIS 11 HD1 HIS 11 1.843 3.339 2.590
72 HD2 HIS 11 HD2 HIS 11 1.217 -0.139 0.401
73 HE1 HIS 11 HE1 HIS 11 2.359 1.452 4.161
74 H CYS 13 H CYS 13 4.414 -1.378 -3.189
75 HA CYS 13 HA CYS 13 4.622 -2.056 -0.459
76 1HB CYS 13 1HB CYS 13 5.975 -3.633 -2.624
77 2HB CYS 13 2HB CYS 13 5.153 -4.217 -1.181
78 H ALA 14 H ALA 14 7.131 -1.657 -2.934
79 HA ALA 14 HA ALA 14 8.957 -0.425 -1.144
80 1HB ALA 14 1HB ALA 14 10.691 -2.197 -1.163
81 2HB ALA 14 2HB ALA 14 9.246 -2.659 -0.264
82 3HB ALA 14 3HB ALA 14 9.519 -3.297 -1.886
83 H GLY 15 H GLY 15 7.967 0.351 -3.566
84 1HA GLY 15 1HA GLY 15 10.343 0.822 -5.050
85 2HA GLY 15 2HA GLY 15 8.725 1.313 -5.516
No H/Q in entry = 85
Start of MODEL 10
1 H ASN 1 H ASN 1 6.863 0.033 -5.788
2 HA ASN 1 HA ASN 1 7.125 0.101 -8.660
3 1HB ASN 1 1HB ASN 1 9.193 -1.024 -7.964
4 2HB ASN 1 2HB ASN 1 8.256 -2.195 -7.043
5 1HD2 ASN 1 1HD2 ASN 1 9.706 -1.520 -9.973
6 2HD2 ASN 1 2HD2 ASN 1 8.996 -2.783 -10.913
7 H GLY 2 H GLY 2 6.277 -2.225 -6.077
8 1HA GLY 2 1HA GLY 2 4.515 -3.828 -6.316
9 2HA GLY 2 2HA GLY 2 3.824 -2.819 -7.573
10 H VAL 3 H VAL 3 1.841 -2.609 -6.706
11 HA VAL 3 HA VAL 3 1.632 -0.778 -4.458
12 HB VAL 3 HB VAL 3 -0.646 -1.897 -6.079
13 1HG1 VAL 3 1HG1 VAL 3 -0.405 0.005 -3.908
14 2HG1 VAL 3 2HG1 VAL 3 -1.227 0.693 -5.309
15 3HG1 VAL 3 3HG1 VAL 3 -1.838 -0.785 -4.566
16 1HG2 VAL 3 1HG2 VAL 3 1.420 -0.055 -6.905
17 2HG2 VAL 3 2HG2 VAL 3 0.126 -0.790 -7.851
18 3HG2 VAL 3 3HG2 VAL 3 -0.173 0.701 -6.957
19 H CYS 4 H CYS 4 0.929 -1.317 -2.501
20 HA CYS 4 HA CYS 4 -0.136 -4.025 -2.078
21 1HB CYS 4 1HB CYS 4 1.823 -2.598 -0.264
22 2HB CYS 4 2HB CYS 4 1.203 -4.231 -0.061
23 H CYS 5 H CYS 5 -1.934 -4.094 -0.834
24 HA CYS 5 HA CYS 5 -2.823 -1.577 0.370
25 1HB CYS 5 1HB CYS 5 -4.463 -4.037 -0.282
26 2HB CYS 5 2HB CYS 5 -5.076 -2.466 0.223
27 H GLY 6 H GLY 6 -2.799 -1.396 2.490
28 1HA GLY 6 1HA GLY 6 -1.747 -2.465 4.483
29 2HA GLY 6 2HA GLY 6 -2.712 -3.881 4.098
30 H TYR 7 H TYR 7 -2.602 -0.880 5.687
31 HA TYR 7 HA TYR 7 -4.946 -1.408 7.191
32 1HB TYR 7 1HB TYR 7 -4.417 1.013 8.042
33 2HB TYR 7 2HB TYR 7 -3.360 -0.324 8.465
34 HD1 TYR 7 HD1 TYR 7 -3.630 1.948 5.481
35 HD2 TYR 7 HD2 TYR 7 -1.162 0.327 8.544
36 HE1 TYR 7 HE1 TYR 7 -1.705 3.175 4.570
37 HE2 TYR 7 HE2 TYR 7 0.769 1.551 7.641
38 HH TYR 7 HH TYR 7 0.950 3.851 6.135
39 H LYS 8 H LYS 8 -6.126 -1.530 5.053
40 HA LYS 8 HA LYS 8 -7.693 -0.823 3.594
41 1HB LYS 8 1HB LYS 8 -9.445 0.570 4.407
42 2HB LYS 8 2HB LYS 8 -8.866 -0.376 5.767
43 1HG LYS 8 1HG LYS 8 -7.745 1.501 6.696
44 2HG LYS 8 2HG LYS 8 -8.011 2.456 5.238
45 1HD LYS 8 1HD LYS 8 -10.465 2.276 5.663
46 2HD LYS 8 2HD LYS 8 -10.085 1.510 7.209
47 1HE LYS 8 1HE LYS 8 -10.521 3.935 7.414
48 2HE LYS 8 2HE LYS 8 -8.901 3.477 7.944
49 1HZ LYS 8 1HZ LYS 8 -8.424 4.044 5.398
50 2HZ LYS 8 2HZ LYS 8 -9.720 5.097 5.670
51 3HZ LYS 8 3HZ LYS 8 -8.329 5.199 6.629
52 H LEU 9 H LEU 9 -5.110 0.201 3.257
53 HA LEU 9 HA LEU 9 -5.706 2.382 1.459
54 1HB LEU 9 1HB LEU 9 -5.126 3.528 3.567
55 2HB LEU 9 2HB LEU 9 -3.608 2.653 3.621
56 HG LEU 9 HG LEU 9 -2.925 3.773 1.513
57 1HD1 LEU 9 1HD1 LEU 9 -5.657 4.476 1.415
58 2HD1 LEU 9 2HD1 LEU 9 -4.737 5.971 1.590
59 3HD1 LEU 9 3HD1 LEU 9 -4.385 4.870 0.259
60 1HD2 LEU 9 1HD2 LEU 9 -2.319 4.636 3.764
61 2HD2 LEU 9 2HD2 LEU 9 -2.389 5.882 2.518
62 3HD2 LEU 9 3HD2 LEU 9 -3.709 5.718 3.676
63 H CYS 10 H CYS 10 -4.608 2.076 -0.374
64 HA CYS 10 HA CYS 10 -2.575 -0.015 -0.392
65 1HB CYS 10 1HB CYS 10 -3.900 1.362 -2.739
66 2HB CYS 10 2HB CYS 10 -2.913 -0.096 -2.792
67 H HIS 11 H HIS 11 -0.494 0.338 -0.825
68 HA HIS 11 HA HIS 11 0.402 2.823 -2.015
69 1HB HIS 11 1HB HIS 11 1.975 3.353 -0.181
70 2HB HIS 11 2HB HIS 11 0.300 3.480 0.330
71 HD1 HIS 11 HD1 HIS 11 2.028 3.310 2.620
72 HD2 HIS 11 HD2 HIS 11 0.921 -0.158 0.618
73 HE1 HIS 11 HE1 HIS 11 2.365 1.446 4.267
74 H CYS 13 H CYS 13 4.643 -1.430 -2.964
75 HA CYS 13 HA CYS 13 5.471 -1.363 -0.233
76 1HB CYS 13 1HB CYS 13 5.598 -3.343 -2.449
77 2HB CYS 13 2HB CYS 13 6.722 -3.558 -1.112
78 H ALA 14 H ALA 14 7.136 -1.004 -3.307
79 HA ALA 14 HA ALA 14 9.382 0.197 -1.930
80 1HB ALA 14 1HB ALA 14 10.860 -1.353 -3.532
81 2HB ALA 14 2HB ALA 14 10.449 -1.807 -1.879
82 3HB ALA 14 3HB ALA 14 9.521 -2.459 -3.231
83 H GLY 15 H GLY 15 7.453 1.318 -3.557
84 1HA GLY 15 1HA GLY 15 9.016 2.746 -5.399
85 2HA GLY 15 2HA GLY 15 7.267 2.807 -5.290
No H/Q in entry = 85
Start of MODEL 11
1 H ASN 1 H ASN 1 7.725 -2.636 -5.180
2 HA ASN 1 HA ASN 1 8.211 -5.003 -6.780
3 1HB ASN 1 1HB ASN 1 7.968 -5.969 -4.558
4 2HB ASN 1 2HB ASN 1 6.475 -5.072 -4.302
5 1HD2 ASN 1 1HD2 ASN 1 4.726 -6.263 -4.511
6 2HD2 ASN 1 2HD2 ASN 1 4.532 -7.616 -5.566
7 H GLY 2 H GLY 2 5.636 -3.102 -5.241
8 1HA GLY 2 1HA GLY 2 3.700 -3.590 -7.234
9 2HA GLY 2 2HA GLY 2 4.521 -2.078 -7.574
10 H VAL 3 H VAL 3 1.768 -2.800 -6.669
11 HA VAL 3 HA VAL 3 1.638 -0.840 -4.492
12 HB VAL 3 HB VAL 3 -0.684 -1.910 -6.086
13 1HG1 VAL 3 1HG1 VAL 3 -0.778 -0.585 -3.774
14 2HG1 VAL 3 2HG1 VAL 3 -0.686 0.787 -4.879
15 3HG1 VAL 3 3HG1 VAL 3 -1.991 -0.387 -5.038
16 1HG2 VAL 3 1HG2 VAL 3 1.380 -0.391 -7.131
17 2HG2 VAL 3 2HG2 VAL 3 -0.238 -0.567 -7.811
18 3HG2 VAL 3 3HG2 VAL 3 0.130 0.793 -6.750
19 H CYS 4 H CYS 4 0.934 -1.375 -2.517
20 HA CYS 4 HA CYS 4 -0.191 -4.059 -2.089
21 1HB CYS 4 1HB CYS 4 1.992 -2.697 -0.507
22 2HB CYS 4 2HB CYS 4 1.073 -4.054 0.122
23 H CYS 5 H CYS 5 -1.952 -4.100 -0.812
24 HA CYS 5 HA CYS 5 -2.814 -1.555 0.353
25 1HB CYS 5 1HB CYS 5 -4.478 -4.007 -0.257
26 2HB CYS 5 2HB CYS 5 -5.076 -2.425 0.231
27 H GLY 6 H GLY 6 -2.664 -1.331 2.449
28 1HA GLY 6 1HA GLY 6 -1.824 -2.131 4.548
29 2HA GLY 6 2HA GLY 6 -2.401 -3.736 4.127
30 H TYR 7 H TYR 7 -2.967 -1.080 5.970
31 HA TYR 7 HA TYR 7 -5.424 -2.054 7.005
32 1HB TYR 7 1HB TYR 7 -5.264 0.222 8.297
33 2HB TYR 7 2HB TYR 7 -4.127 -1.073 8.646
34 HD1 TYR 7 HD1 TYR 7 -1.997 -0.322 9.049
35 HD2 TYR 7 HD2 TYR 7 -4.323 1.695 6.112
36 HE1 TYR 7 HE1 TYR 7 -0.112 1.192 8.601
37 HE2 TYR 7 HE2 TYR 7 -2.445 3.210 5.656
38 HH TYR 7 HH TYR 7 0.010 3.736 7.585
39 H LYS 8 H LYS 8 -6.218 -1.830 4.620
40 HA LYS 8 HA LYS 8 -7.836 -1.021 3.249
41 1HB LYS 8 1HB LYS 8 -9.040 -0.666 5.452
42 2HB LYS 8 2HB LYS 8 -8.482 0.999 5.404
43 1HG LYS 8 1HG LYS 8 -9.665 1.280 3.241
44 2HG LYS 8 2HG LYS 8 -10.312 -0.352 3.431
45 1HD LYS 8 1HD LYS 8 -11.424 0.301 5.487
46 2HD LYS 8 2HD LYS 8 -10.721 1.917 5.378
47 1HE LYS 8 1HE LYS 8 -11.917 2.267 3.255
48 2HE LYS 8 2HE LYS 8 -12.650 0.672 3.421
49 1HZ LYS 8 1HZ LYS 8 -12.957 2.798 5.460
50 2HZ LYS 8 2HZ LYS 8 -14.039 2.599 4.175
51 3HZ LYS 8 3HZ LYS 8 -13.844 1.365 5.313
52 H LEU 9 H LEU 9 -5.179 -0.080 3.132
53 HA LEU 9 HA LEU 9 -5.607 2.304 1.544
54 1HB LEU 9 1HB LEU 9 -5.069 3.192 3.780
55 2HB LEU 9 2HB LEU 9 -3.594 2.244 3.801
56 HG LEU 9 HG LEU 9 -2.768 3.546 1.855
57 1HD1 LEU 9 1HD1 LEU 9 -5.457 4.767 2.118
58 2HD1 LEU 9 2HD1 LEU 9 -4.113 5.824 1.688
59 3HD1 LEU 9 3HD1 LEU 9 -4.498 4.432 0.677
60 1HD2 LEU 9 1HD2 LEU 9 -2.963 4.322 4.546
61 2HD2 LEU 9 2HD2 LEU 9 -1.773 4.843 3.353
62 3HD2 LEU 9 3HD2 LEU 9 -3.252 5.773 3.589
63 H CYS 10 H CYS 10 -4.596 1.982 -0.309
64 HA CYS 10 HA CYS 10 -2.516 -0.056 -0.441
65 1HB CYS 10 1HB CYS 10 -3.874 1.373 -2.730
66 2HB CYS 10 2HB CYS 10 -2.906 -0.093 -2.815
67 H HIS 11 H HIS 11 -0.453 0.355 -0.883
68 HA HIS 11 HA HIS 11 0.381 2.897 -2.006
69 1HB HIS 11 1HB HIS 11 1.914 3.448 -0.184
70 2HB HIS 11 2HB HIS 11 0.265 3.377 0.423
71 HD1 HIS 11 HD1 HIS 11 3.347 1.114 0.290
72 HD2 HIS 11 HD2 HIS 11 0.006 1.874 2.657
73 HE1 HIS 11 HE1 HIS 11 3.609 -0.341 2.322
74 H CYS 13 H CYS 13 4.683 -1.278 -3.297
75 HA CYS 13 HA CYS 13 5.189 -1.727 -0.485
76 1HB CYS 13 1HB CYS 13 6.110 -3.671 -2.544
77 2HB CYS 13 2HB CYS 13 5.287 -3.962 -1.016
78 H ALA 14 H ALA 14 7.448 -3.350 -0.560
79 HA ALA 14 HA ALA 14 9.530 -1.374 -0.616
80 1HB ALA 14 1HB ALA 14 10.656 -3.917 -0.190
81 2HB ALA 14 2HB ALA 14 9.092 -3.913 0.624
82 3HB ALA 14 3HB ALA 14 10.289 -2.678 1.011
83 H GLY 15 H GLY 15 8.860 -1.328 -3.136
84 1HA GLY 15 1HA GLY 15 11.170 -2.367 -4.490
85 2HA GLY 15 2HA GLY 15 9.916 -1.373 -5.198
No H/Q in entry = 85
Start of MODEL 12
1 H ASN 1 H ASN 1 7.980 -4.394 -4.499
2 HA ASN 1 HA ASN 1 6.634 -6.886 -5.098
3 1HB ASN 1 1HB ASN 1 6.134 -4.820 -2.953
4 2HB ASN 1 2HB ASN 1 5.194 -6.295 -3.134
5 1HD2 ASN 1 1HD2 ASN 1 5.804 -7.910 -1.906
6 2HD2 ASN 1 2HD2 ASN 1 7.386 -8.165 -1.264
7 H GLY 2 H GLY 2 6.097 -3.462 -5.545
8 1HA GLY 2 1HA GLY 2 3.657 -4.145 -7.046
9 2HA GLY 2 2HA GLY 2 4.620 -2.700 -7.294
10 H VAL 3 H VAL 3 1.737 -3.208 -6.610
11 HA VAL 3 HA VAL 3 1.603 -1.140 -4.576
12 HB VAL 3 HB VAL 3 0.198 -0.734 -6.439
13 1HG1 VAL 3 1HG1 VAL 3 0.007 -3.071 -7.223
14 2HG1 VAL 3 2HG1 VAL 3 -1.165 -3.374 -5.942
15 3HG1 VAL 3 3HG1 VAL 3 -1.536 -2.219 -7.221
16 1HG2 VAL 3 1HG2 VAL 3 -0.974 -1.229 -3.821
17 2HG2 VAL 3 2HG2 VAL 3 -1.102 0.178 -4.875
18 3HG2 VAL 3 3HG2 VAL 3 -2.155 -1.214 -5.131
19 H CYS 4 H CYS 4 1.057 -1.438 -2.553
20 HA CYS 4 HA CYS 4 0.102 -4.112 -1.748
21 1HB CYS 4 1HB CYS 4 1.731 -2.211 -0.065
22 2HB CYS 4 2HB CYS 4 1.308 -3.871 0.323
23 H CYS 5 H CYS 5 -1.906 -4.084 -1.016
24 HA CYS 5 HA CYS 5 -2.973 -1.628 0.173
25 1HB CYS 5 1HB CYS 5 -4.470 -4.008 -0.954
26 2HB CYS 5 2HB CYS 5 -5.188 -2.512 -0.368
27 H GLY 6 H GLY 6 -3.531 -1.638 2.276
28 1HA GLY 6 1HA GLY 6 -2.627 -3.199 4.199
29 2HA GLY 6 2HA GLY 6 -3.918 -4.228 3.609
30 H TYR 7 H TYR 7 -3.179 -1.194 5.182
31 HA TYR 7 HA TYR 7 -5.487 -1.368 6.834
32 1HB TYR 7 1HB TYR 7 -4.625 0.994 7.549
33 2HB TYR 7 2HB TYR 7 -3.697 -0.441 7.962
34 HD1 TYR 7 HD1 TYR 7 -3.922 1.769 4.930
35 HD2 TYR 7 HD2 TYR 7 -1.435 -0.075 7.847
36 HE1 TYR 7 HE1 TYR 7 -1.941 2.728 3.839
37 HE2 TYR 7 HE2 TYR 7 0.553 0.880 6.762
38 HH TYR 7 HH TYR 7 0.736 3.251 5.014
39 H LYS 8 H LYS 8 -6.706 -1.408 4.626
40 HA LYS 8 HA LYS 8 -8.243 -0.541 3.223
41 1HB LYS 8 1HB LYS 8 -9.850 0.936 4.101
42 2HB LYS 8 2HB LYS 8 -9.245 0.044 5.484
43 1HG LYS 8 1HG LYS 8 -7.861 1.949 6.120
44 2HG LYS 8 2HG LYS 8 -8.440 2.843 4.713
45 1HD LYS 8 1HD LYS 8 -9.659 3.550 6.673
46 2HD LYS 8 2HD LYS 8 -10.744 2.668 5.597
47 1HE LYS 8 1HE LYS 8 -10.475 0.662 6.964
48 2HE LYS 8 2HE LYS 8 -9.373 1.531 8.031
49 1HZ LYS 8 1HZ LYS 8 -11.875 2.879 7.683
50 2HZ LYS 8 2HZ LYS 8 -12.065 1.334 8.344
51 3HZ LYS 8 3HZ LYS 8 -11.064 2.464 9.108
52 H LEU 9 H LEU 9 -5.472 0.405 3.089
53 HA LEU 9 HA LEU 9 -5.902 2.474 1.121
54 1HB LEU 9 1HB LEU 9 -5.515 3.737 3.204
55 2HB LEU 9 2HB LEU 9 -4.013 2.870 3.449
56 HG LEU 9 HG LEU 9 -3.141 3.870 1.342
57 1HD1 LEU 9 1HD1 LEU 9 -5.623 4.341 0.601
58 2HD1 LEU 9 2HD1 LEU 9 -5.332 5.879 1.412
59 3HD1 LEU 9 3HD1 LEU 9 -4.297 5.377 0.074
60 1HD2 LEU 9 1HD2 LEU 9 -3.169 4.904 3.828
61 2HD2 LEU 9 2HD2 LEU 9 -2.335 5.649 2.465
62 3HD2 LEU 9 3HD2 LEU 9 -3.938 6.217 2.936
63 H CYS 10 H CYS 10 -4.487 2.275 -0.530
64 HA CYS 10 HA CYS 10 -2.595 0.062 -0.339
65 1HB CYS 10 1HB CYS 10 -3.536 1.586 -2.783
66 2HB CYS 10 2HB CYS 10 -2.577 0.109 -2.780
67 H HIS 11 H HIS 11 -0.426 0.305 -0.640
68 HA HIS 11 HA HIS 11 0.596 2.979 -1.274
69 1HB HIS 11 1HB HIS 11 2.255 2.860 0.517
70 2HB HIS 11 2HB HIS 11 0.632 2.769 1.183
71 HD1 HIS 11 HD1 HIS 11 3.521 0.436 0.324
72 HD2 HIS 11 HD2 HIS 11 0.228 0.669 2.855
73 HE1 HIS 11 HE1 HIS 11 3.705 -1.548 1.856
74 H CYS 13 H CYS 13 4.738 -0.756 -3.933
75 HA CYS 13 HA CYS 13 6.741 -0.577 -1.781
76 1HB CYS 13 1HB CYS 13 5.377 -3.098 -2.771
77 2HB CYS 13 2HB CYS 13 6.597 -3.005 -1.508
78 H ALA 14 H ALA 14 8.788 -0.751 -2.528
79 HA ALA 14 HA ALA 14 9.303 -0.896 -5.302
80 1HB ALA 14 1HB ALA 14 11.475 -1.416 -3.334
81 2HB ALA 14 2HB ALA 14 10.677 0.156 -3.321
82 3HB ALA 14 3HB ALA 14 11.481 -0.414 -4.784
83 H GLY 15 H GLY 15 9.299 -2.640 -6.546
84 1HA GLY 15 1HA GLY 15 10.544 -5.097 -5.608
85 2HA GLY 15 2HA GLY 15 10.080 -4.724 -7.257
No H/Q in entry = 85
Start of MODEL 13
1 H ASN 1 H ASN 1 8.125 -2.156 -5.746
2 HA ASN 1 HA ASN 1 8.377 -3.232 -8.418
3 1HB ASN 1 1HB ASN 1 7.479 -5.344 -7.055
4 2HB ASN 1 2HB ASN 1 9.166 -4.846 -7.004
5 1HD2 ASN 1 1HD2 ASN 1 9.871 -5.199 -5.028
6 2HD2 ASN 1 2HD2 ASN 1 9.074 -4.738 -3.567
7 H GLY 2 H GLY 2 5.866 -2.592 -6.043
8 1HA GLY 2 1HA GLY 2 3.689 -3.791 -7.230
9 2HA GLY 2 2HA GLY 2 3.891 -2.253 -8.061
10 H VAL 3 H VAL 3 1.598 -2.754 -6.657
11 HA VAL 3 HA VAL 3 1.893 -0.915 -4.394
12 HB VAL 3 HB VAL 3 0.506 -0.049 -6.187
13 1HG1 VAL 3 1HG1 VAL 3 -0.274 -2.389 -6.897
14 2HG1 VAL 3 2HG1 VAL 3 -1.536 -2.175 -5.685
15 3HG1 VAL 3 3HG1 VAL 3 -1.414 -1.050 -7.036
16 1HG2 VAL 3 1HG2 VAL 3 -0.198 -0.197 -3.489
17 2HG2 VAL 3 2HG2 VAL 3 -0.705 1.012 -4.668
18 3HG2 VAL 3 3HG2 VAL 3 -1.696 -0.420 -4.394
19 H CYS 4 H CYS 4 1.100 -1.401 -2.451
20 HA CYS 4 HA CYS 4 -0.155 -4.040 -2.090
21 1HB CYS 4 1HB CYS 4 2.043 -2.760 -0.464
22 2HB CYS 4 2HB CYS 4 1.081 -4.099 0.138
23 H CYS 5 H CYS 5 -1.944 -4.043 -0.841
24 HA CYS 5 HA CYS 5 -2.741 -1.488 0.351
25 1HB CYS 5 1HB CYS 5 -4.518 -3.863 -0.235
26 2HB CYS 5 2HB CYS 5 -5.013 -2.211 0.119
27 H GLY 6 H GLY 6 -2.713 -1.315 2.485
28 1HA GLY 6 1HA GLY 6 -1.699 -2.486 4.452
29 2HA GLY 6 2HA GLY 6 -2.765 -3.822 4.061
30 H TYR 7 H TYR 7 -2.553 -0.624 5.412
31 HA TYR 7 HA TYR 7 -4.735 -1.115 7.170
32 1HB TYR 7 1HB TYR 7 -4.286 1.380 7.765
33 2HB TYR 7 2HB TYR 7 -3.088 0.160 8.170
34 HD1 TYR 7 HD1 TYR 7 -3.853 2.148 5.076
35 HD2 TYR 7 HD2 TYR 7 -0.950 0.965 7.951
36 HE1 TYR 7 HE1 TYR 7 -2.140 3.427 3.862
37 HE2 TYR 7 HE2 TYR 7 0.771 2.240 6.746
38 HH TYR 7 HH TYR 7 0.539 4.457 5.010
39 H LYS 8 H LYS 8 -5.964 -1.440 4.919
40 HA LYS 8 HA LYS 8 -7.795 -0.888 3.696
41 1HB LYS 8 1HB LYS 8 -8.087 1.331 5.730
42 2HB LYS 8 2HB LYS 8 -9.318 0.859 4.567
43 1HG LYS 8 1HG LYS 8 -9.443 -1.354 5.592
44 2HG LYS 8 2HG LYS 8 -8.205 -0.882 6.757
45 1HD LYS 8 1HD LYS 8 -9.681 0.898 7.585
46 2HD LYS 8 2HD LYS 8 -10.922 0.391 6.438
47 1HE LYS 8 1HE LYS 8 -9.776 -1.293 8.662
48 2HE LYS 8 2HE LYS 8 -11.349 -0.497 8.677
49 1HZ LYS 8 1HZ LYS 8 -10.508 -2.602 6.758
50 2HZ LYS 8 2HZ LYS 8 -11.522 -2.841 8.091
51 3HZ LYS 8 3HZ LYS 8 -12.027 -1.859 6.810
52 H LEU 9 H LEU 9 -5.141 0.320 3.226
53 HA LEU 9 HA LEU 9 -5.965 2.174 1.168
54 1HB LEU 9 1HB LEU 9 -5.549 3.623 3.126
55 2HB LEU 9 2HB LEU 9 -3.938 2.948 3.275
56 HG LEU 9 HG LEU 9 -3.376 3.889 1.043
57 1HD1 LEU 9 1HD1 LEU 9 -6.224 4.657 1.168
58 2HD1 LEU 9 2HD1 LEU 9 -5.109 5.861 0.520
59 3HD1 LEU 9 3HD1 LEU 9 -5.211 4.264 -0.221
60 1HD2 LEU 9 1HD2 LEU 9 -2.939 5.055 3.227
61 2HD2 LEU 9 2HD2 LEU 9 -3.032 6.106 1.815
62 3HD2 LEU 9 3HD2 LEU 9 -4.396 6.002 2.928
63 H CYS 10 H CYS 10 -4.667 2.006 -0.593
64 HA CYS 10 HA CYS 10 -2.595 -0.026 -0.445
65 1HB CYS 10 1HB CYS 10 -3.694 1.361 -2.896
66 2HB CYS 10 2HB CYS 10 -2.722 -0.105 -2.855
67 H HIS 11 H HIS 11 -0.498 0.308 -0.794
68 HA HIS 11 HA HIS 11 0.487 2.920 -1.664
69 1HB HIS 11 1HB HIS 11 0.291 3.054 0.804
70 2HB HIS 11 2HB HIS 11 1.258 1.596 0.958
71 HD1 HIS 11 HD1 HIS 11 3.825 1.899 -0.079
72 HD2 HIS 11 HD2 HIS 11 1.719 5.328 0.989
73 HE1 HIS 11 HE1 HIS 11 5.555 3.702 0.187
74 H CYS 13 H CYS 13 4.316 -1.424 -3.273
75 HA CYS 13 HA CYS 13 5.052 -1.793 -0.570
76 1HB CYS 13 1HB CYS 13 6.086 -3.636 -2.666
77 2HB CYS 13 2HB CYS 13 5.322 -4.003 -1.121
78 H ALA 14 H ALA 14 7.073 -1.740 -3.506
79 HA ALA 14 HA ALA 14 9.145 -0.269 -2.218
80 1HB ALA 14 1HB ALA 14 10.880 -2.116 -2.463
81 2HB ALA 14 2HB ALA 14 9.755 -2.254 -1.110
82 3HB ALA 14 3HB ALA 14 9.519 -3.233 -2.558
83 H GLY 15 H GLY 15 7.769 0.203 -4.533
84 1HA GLY 15 1HA GLY 15 9.924 0.392 -6.428
85 2HA GLY 15 2HA GLY 15 8.303 1.043 -6.623
No H/Q in entry = 85
Start of MODEL 14
1 H ASN 1 H ASN 1 8.351 -1.095 -6.382
2 HA ASN 1 HA ASN 1 7.610 -1.434 -9.140
3 1HB ASN 1 1HB ASN 1 8.990 -3.197 -7.142
4 2HB ASN 1 2HB ASN 1 8.478 -3.808 -8.709
5 1HD2 ASN 1 1HD2 ASN 1 11.017 -2.569 -7.070
6 2HD2 ASN 1 2HD2 ASN 1 11.934 -1.931 -8.384
7 H GLY 2 H GLY 2 5.866 -1.584 -6.367
8 1HA GLY 2 1HA GLY 2 4.454 -3.959 -6.424
9 2HA GLY 2 2HA GLY 2 3.723 -2.942 -7.648
10 H VAL 3 H VAL 3 1.824 -2.644 -6.685
11 HA VAL 3 HA VAL 3 1.775 -0.790 -4.440
12 HB VAL 3 HB VAL 3 -0.589 -1.821 -6.009
13 1HG1 VAL 3 1HG1 VAL 3 -1.109 -0.759 -3.867
14 2HG1 VAL 3 2HG1 VAL 3 -0.230 0.685 -4.373
15 3HG1 VAL 3 3HG1 VAL 3 -1.694 0.198 -5.229
16 1HG2 VAL 3 1HG2 VAL 3 1.057 -0.791 -7.527
17 2HG2 VAL 3 2HG2 VAL 3 -0.432 0.145 -7.415
18 3HG2 VAL 3 3HG2 VAL 3 1.011 0.676 -6.552
19 H CYS 4 H CYS 4 0.934 -1.266 -2.455
20 HA CYS 4 HA CYS 4 -0.095 -3.990 -2.041
21 1HB CYS 4 1HB CYS 4 1.816 -2.528 -0.207
22 2HB CYS 4 2HB CYS 4 1.176 -4.149 0.033
23 H CYS 5 H CYS 5 -1.940 -4.071 -0.883
24 HA CYS 5 HA CYS 5 -2.888 -1.571 0.314
25 1HB CYS 5 1HB CYS 5 -4.463 -4.046 -0.436
26 2HB CYS 5 2HB CYS 5 -5.131 -2.517 0.125
27 H GLY 6 H GLY 6 -2.764 -1.396 2.417
28 1HA GLY 6 1HA GLY 6 -1.949 -2.270 4.506
29 2HA GLY 6 2HA GLY 6 -2.568 -3.846 4.039
30 H TYR 7 H TYR 7 -3.051 -1.299 6.006
31 HA TYR 7 HA TYR 7 -5.567 -2.198 6.949
32 1HB TYR 7 1HB TYR 7 -5.310 -0.002 8.361
33 2HB TYR 7 2HB TYR 7 -4.240 -1.370 8.652
34 HD1 TYR 7 HD1 TYR 7 -2.073 -0.754 9.092
35 HD2 TYR 7 HD2 TYR 7 -4.285 1.537 6.269
36 HE1 TYR 7 HE1 TYR 7 -0.111 0.681 8.724
37 HE2 TYR 7 HE2 TYR 7 -2.328 2.974 5.895
38 HH TYR 7 HH TYR 7 0.063 3.363 7.778
39 H LYS 8 H LYS 8 -6.295 -1.786 4.547
40 HA LYS 8 HA LYS 8 -7.894 -0.836 3.236
41 1HB LYS 8 1HB LYS 8 -8.358 1.046 5.558
42 2HB LYS 8 2HB LYS 8 -9.403 0.875 4.156
43 1HG LYS 8 1HG LYS 8 -9.987 -1.363 4.792
44 2HG LYS 8 2HG LYS 8 -8.806 -1.341 6.104
45 1HD LYS 8 1HD LYS 8 -11.238 0.435 5.881
46 2HD LYS 8 2HD LYS 8 -11.075 -0.965 6.943
47 1HE LYS 8 1HE LYS 8 -9.257 0.118 8.133
48 2HE LYS 8 2HE LYS 8 -9.332 1.495 7.036
49 1HZ LYS 8 1HZ LYS 8 -11.711 0.703 8.582
50 2HZ LYS 8 2HZ LYS 8 -10.502 1.636 9.307
51 3HZ LYS 8 3HZ LYS 8 -11.311 2.216 7.940
52 H LEU 9 H LEU 9 -5.168 -0.045 3.144
53 HA LEU 9 HA LEU 9 -5.483 2.413 1.645
54 1HB LEU 9 1HB LEU 9 -4.901 3.193 3.906
55 2HB LEU 9 2HB LEU 9 -3.474 2.174 3.891
56 HG LEU 9 HG LEU 9 -2.601 3.501 1.973
57 1HD1 LEU 9 1HD1 LEU 9 -5.063 5.143 2.511
58 2HD1 LEU 9 2HD1 LEU 9 -3.668 5.742 1.614
59 3HD1 LEU 9 3HD1 LEU 9 -4.585 4.367 1.001
60 1HD2 LEU 9 1HD2 LEU 9 -3.249 4.971 4.521
61 2HD2 LEU 9 2HD2 LEU 9 -1.810 4.013 4.177
62 3HD2 LEU 9 3HD2 LEU 9 -2.085 5.529 3.320
63 H CYS 10 H CYS 10 -4.591 1.999 -0.244
64 HA CYS 10 HA CYS 10 -2.536 -0.049 -0.443
65 1HB CYS 10 1HB CYS 10 -3.913 1.455 -2.674
66 2HB CYS 10 2HB CYS 10 -2.940 0.000 -2.826
67 H HIS 11 H HIS 11 -0.476 0.342 -0.817
68 HA HIS 11 HA HIS 11 0.423 2.846 -1.964
69 1HB HIS 11 1HB HIS 11 1.959 3.375 -0.126
70 2HB HIS 11 2HB HIS 11 0.295 3.392 0.444
71 HD1 HIS 11 HD1 HIS 11 -0.409 0.948 1.625
72 HD2 HIS 11 HD2 HIS 11 3.611 1.999 1.503
73 HE1 HIS 11 HE1 HIS 11 0.711 -0.466 3.376
74 H CYS 13 H CYS 13 4.595 -1.456 -3.007
75 HA CYS 13 HA CYS 13 5.591 -1.224 -0.328
76 1HB CYS 13 1HB CYS 13 5.575 -3.368 -2.407
77 2HB CYS 13 2HB CYS 13 6.719 -3.503 -1.077
78 H ALA 14 H ALA 14 6.996 -1.187 -3.547
79 HA ALA 14 HA ALA 14 9.304 0.207 -2.549
80 1HB ALA 14 1HB ALA 14 10.594 -1.733 -4.036
81 2HB ALA 14 2HB ALA 14 9.426 -2.647 -3.080
82 3HB ALA 14 3HB ALA 14 10.595 -1.600 -2.277
83 H GLY 15 H GLY 15 7.172 0.782 -4.310
84 1HA GLY 15 1HA GLY 15 8.653 1.838 -6.516
85 2HA GLY 15 2HA GLY 15 6.941 2.055 -6.207
No H/Q in entry = 85
Start of MODEL 15
1 H ASN 1 H ASN 1 8.121 -4.163 -4.501
2 HA ASN 1 HA ASN 1 7.034 -6.776 -5.113
3 1HB ASN 1 1HB ASN 1 6.277 -4.752 -3.002
4 2HB ASN 1 2HB ASN 1 5.496 -6.318 -3.190
5 1HD2 ASN 1 1HD2 ASN 1 6.231 -7.849 -1.923
6 2HD2 ASN 1 2HD2 ASN 1 7.813 -7.937 -1.240
7 H GLY 2 H GLY 2 6.031 -3.397 -5.333
8 1HA GLY 2 1HA GLY 2 3.703 -4.316 -6.905
9 2HA GLY 2 2HA GLY 2 4.599 -2.857 -7.282
10 H VAL 3 H VAL 3 1.752 -3.336 -6.566
11 HA VAL 3 HA VAL 3 1.582 -1.179 -4.616
12 HB VAL 3 HB VAL 3 -0.750 -2.526 -5.947
13 1HG1 VAL 3 1HG1 VAL 3 -0.323 0.004 -4.441
14 2HG1 VAL 3 2HG1 VAL 3 -1.588 -0.067 -5.668
15 3HG1 VAL 3 3HG1 VAL 3 -1.618 -1.184 -4.304
16 1HG2 VAL 3 1HG2 VAL 3 1.294 -1.183 -7.299
17 2HG2 VAL 3 2HG2 VAL 3 -0.302 -1.600 -7.925
18 3HG2 VAL 3 3HG2 VAL 3 -0.030 -0.024 -7.180
19 H CYS 4 H CYS 4 1.094 -1.477 -2.555
20 HA CYS 4 HA CYS 4 0.129 -4.133 -1.711
21 1HB CYS 4 1HB CYS 4 1.721 -2.153 -0.077
22 2HB CYS 4 2HB CYS 4 1.282 -3.787 0.394
23 H CYS 5 H CYS 5 -1.897 -4.116 -0.975
24 HA CYS 5 HA CYS 5 -2.971 -1.611 0.110
25 1HB CYS 5 1HB CYS 5 -4.477 -3.955 -1.074
26 2HB CYS 5 2HB CYS 5 -5.190 -2.448 -0.502
27 H GLY 6 H GLY 6 -3.467 -1.551 2.191
28 1HA GLY 6 1HA GLY 6 -2.850 -2.725 4.294
29 2HA GLY 6 2HA GLY 6 -3.669 -4.127 3.628
30 H TYR 7 H TYR 7 -3.959 -1.385 5.528
31 HA TYR 7 HA TYR 7 -6.584 -2.017 6.369
32 1HB TYR 7 1HB TYR 7 -6.266 0.238 7.644
33 2HB TYR 7 2HB TYR 7 -5.294 -1.162 8.081
34 HD1 TYR 7 HD1 TYR 7 -3.146 -0.598 8.653
35 HD2 TYR 7 HD2 TYR 7 -5.019 1.554 5.495
36 HE1 TYR 7 HE1 TYR 7 -1.094 0.718 8.334
37 HE2 TYR 7 HE2 TYR 7 -2.971 2.871 5.169
38 HH TYR 7 HH TYR 7 -0.477 2.978 7.393
39 H LYS 8 H LYS 8 -7.130 -1.731 3.887
40 HA LYS 8 HA LYS 8 -8.528 -0.761 2.385
41 1HB LYS 8 1HB LYS 8 -9.219 1.079 4.684
42 2HB LYS 8 2HB LYS 8 -10.098 0.994 3.164
43 1HG LYS 8 1HG LYS 8 -10.705 -1.315 3.627
44 2HG LYS 8 2HG LYS 8 -9.790 -1.262 5.135
45 1HD LYS 8 1HD LYS 8 -11.263 0.513 5.960
46 2HD LYS 8 2HD LYS 8 -12.180 0.452 4.452
47 1HE LYS 8 1HE LYS 8 -11.870 -1.812 6.421
48 2HE LYS 8 2HE LYS 8 -13.294 -0.788 6.251
49 1HZ LYS 8 1HZ LYS 8 -12.809 -1.724 3.727
50 2HZ LYS 8 2HZ LYS 8 -12.509 -3.062 4.720
51 3HZ LYS 8 3HZ LYS 8 -14.005 -2.278 4.786
52 H LEU 9 H LEU 9 -5.780 0.108 2.724
53 HA LEU 9 HA LEU 9 -5.921 2.458 1.045
54 1HB LEU 9 1HB LEU 9 -5.774 3.322 3.384
55 2HB LEU 9 2HB LEU 9 -4.260 2.460 3.572
56 HG LEU 9 HG LEU 9 -3.230 3.848 1.842
57 1HD1 LEU 9 1HD1 LEU 9 -6.014 4.667 1.420
58 2HD1 LEU 9 2HD1 LEU 9 -4.850 5.992 1.434
59 3HD1 LEU 9 3HD1 LEU 9 -4.650 4.654 0.302
60 1HD2 LEU 9 1HD2 LEU 9 -4.641 5.434 3.985
61 2HD2 LEU 9 2HD2 LEU 9 -3.104 4.586 4.154
62 3HD2 LEU 9 3HD2 LEU 9 -3.232 5.972 3.070
63 H CYS 10 H CYS 10 -4.509 2.235 -0.552
64 HA CYS 10 HA CYS 10 -2.573 0.066 -0.370
65 1HB CYS 10 1HB CYS 10 -3.420 1.671 -2.788
66 2HB CYS 10 2HB CYS 10 -2.462 0.193 -2.792
67 H HIS 11 H HIS 11 -0.422 0.278 -0.720
68 HA HIS 11 HA HIS 11 0.699 2.981 -1.025
69 1HB HIS 11 1HB HIS 11 1.583 0.909 1.006
70 2HB HIS 11 2HB HIS 11 2.436 2.408 0.663
71 HD1 HIS 11 HD1 HIS 11 0.647 4.609 0.984
72 HD2 HIS 11 HD2 HIS 11 0.054 1.144 3.200
73 HE1 HIS 11 HE1 HIS 11 -0.758 5.299 2.949
74 H CYS 13 H CYS 13 4.414 -0.848 -3.638
75 HA CYS 13 HA CYS 13 6.615 -0.497 -1.716
76 1HB CYS 13 1HB CYS 13 5.329 -3.051 -2.720
77 2HB CYS 13 2HB CYS 13 6.601 -2.946 -1.511
78 H ALA 14 H ALA 14 8.607 -0.385 -2.556
79 HA ALA 14 HA ALA 14 9.084 -0.564 -5.329
80 1HB ALA 14 1HB ALA 14 10.677 -0.028 -2.921
81 2HB ALA 14 2HB ALA 14 11.576 -0.718 -4.273
82 3HB ALA 14 3HB ALA 14 10.673 0.782 -4.488
83 H GLY 15 H GLY 15 9.308 -2.312 -6.547
84 1HA GLY 15 1HA GLY 15 10.767 -4.620 -5.534
85 2HA GLY 15 2HA GLY 15 10.320 -4.318 -7.202
No H/Q in entry = 85
Start of MODEL 16
1 H ASN 1 H ASN 1 6.979 -0.076 -5.663
2 HA ASN 1 HA ASN 1 7.147 0.400 -8.504
3 1HB ASN 1 1HB ASN 1 9.209 -0.857 -8.083
4 2HB ASN 1 2HB ASN 1 8.282 -2.127 -7.287
5 1HD2 ASN 1 1HD2 ASN 1 8.085 -3.848 -8.521
6 2HD2 ASN 1 2HD2 ASN 1 7.873 -3.857 -10.233
7 H GLY 2 H GLY 2 6.298 -2.134 -6.147
8 1HA GLY 2 1HA GLY 2 4.520 -3.690 -6.410
9 2HA GLY 2 2HA GLY 2 3.860 -2.669 -7.679
10 H VAL 3 H VAL 3 1.817 -2.727 -6.645
11 HA VAL 3 HA VAL 3 1.637 -0.807 -4.441
12 HB VAL 3 HB VAL 3 -0.658 -1.871 -6.073
13 1HG1 VAL 3 1HG1 VAL 3 -0.577 -0.328 -3.769
14 2HG1 VAL 3 2HG1 VAL 3 -0.882 0.825 -5.069
15 3HG1 VAL 3 3HG1 VAL 3 -1.957 -0.554 -4.844
16 1HG2 VAL 3 1HG2 VAL 3 1.438 -0.293 -7.045
17 2HG2 VAL 3 2HG2 VAL 3 -0.123 -0.590 -7.812
18 3HG2 VAL 3 3HG2 VAL 3 0.095 0.816 -6.769
19 H CYS 4 H CYS 4 0.940 -1.368 -2.484
20 HA CYS 4 HA CYS 4 -0.205 -4.048 -2.100
21 1HB CYS 4 1HB CYS 4 1.980 -2.718 -0.499
22 2HB CYS 4 2HB CYS 4 1.042 -4.066 0.126
23 H CYS 5 H CYS 5 -1.953 -4.124 -0.813
24 HA CYS 5 HA CYS 5 -2.852 -1.605 0.376
25 1HB CYS 5 1HB CYS 5 -4.464 -4.084 -0.273
26 2HB CYS 5 2HB CYS 5 -5.102 -2.534 0.269
27 H GLY 6 H GLY 6 -2.825 -1.411 2.493
28 1HA GLY 6 1HA GLY 6 -1.753 -2.467 4.485
29 2HA GLY 6 2HA GLY 6 -2.723 -3.883 4.114
30 H TYR 7 H TYR 7 -2.555 -0.957 5.768
31 HA TYR 7 HA TYR 7 -4.905 -1.438 7.267
32 1HB TYR 7 1HB TYR 7 -4.302 0.963 8.136
33 2HB TYR 7 2HB TYR 7 -3.263 -0.405 8.519
34 HD1 TYR 7 HD1 TYR 7 -1.030 0.128 8.479
35 HD2 TYR 7 HD2 TYR 7 -3.591 1.956 5.615
36 HE1 TYR 7 HE1 TYR 7 0.900 1.300 7.507
37 HE2 TYR 7 HE2 TYR 7 -1.668 3.130 4.635
38 HH TYR 7 HH TYR 7 1.109 3.628 6.064
39 H LYS 8 H LYS 8 -6.024 -1.428 4.966
40 HA LYS 8 HA LYS 8 -7.717 -0.598 3.705
41 1HB LYS 8 1HB LYS 8 -7.888 1.324 6.020
42 2HB LYS 8 2HB LYS 8 -8.999 1.389 4.659
43 1HG LYS 8 1HG LYS 8 -8.598 -1.020 6.421
44 2HG LYS 8 2HG LYS 8 -9.889 0.168 6.617
45 1HD LYS 8 1HD LYS 8 -9.422 -1.518 4.155
46 2HD LYS 8 2HD LYS 8 -10.638 -1.835 5.393
47 1HE LYS 8 1HE LYS 8 -11.716 0.294 4.896
48 2HE LYS 8 2HE LYS 8 -10.481 0.652 3.689
49 1HZ LYS 8 1HZ LYS 8 -11.769 -1.883 3.280
50 2HZ LYS 8 2HZ LYS 8 -12.845 -0.580 3.206
51 3HZ LYS 8 3HZ LYS 8 -11.496 -0.621 2.187
52 H LEU 9 H LEU 9 -4.955 0.326 3.360
53 HA LEU 9 HA LEU 9 -5.546 2.477 1.512
54 1HB LEU 9 1HB LEU 9 -4.954 3.662 3.577
55 2HB LEU 9 2HB LEU 9 -3.453 2.760 3.674
56 HG LEU 9 HG LEU 9 -2.729 3.815 1.538
57 1HD1 LEU 9 1HD1 LEU 9 -5.464 4.817 1.633
58 2HD1 LEU 9 2HD1 LEU 9 -4.266 6.079 1.342
59 3HD1 LEU 9 3HD1 LEU 9 -4.349 4.680 0.272
60 1HD2 LEU 9 1HD2 LEU 9 -2.858 4.932 4.122
61 2HD2 LEU 9 2HD2 LEU 9 -1.694 5.276 2.843
62 3HD2 LEU 9 3HD2 LEU 9 -3.165 6.240 2.980
63 H CYS 10 H CYS 10 -4.616 1.981 -0.333
64 HA CYS 10 HA CYS 10 -2.515 -0.024 -0.380
65 1HB CYS 10 1HB CYS 10 -3.891 1.317 -2.717
66 2HB CYS 10 2HB CYS 10 -2.933 -0.157 -2.755
67 H HIS 11 H HIS 11 -0.446 0.376 -0.836
68 HA HIS 11 HA HIS 11 0.371 2.858 -2.091
69 1HB HIS 11 1HB HIS 11 1.953 3.455 -0.285
70 2HB HIS 11 2HB HIS 11 0.283 3.539 0.257
71 HD1 HIS 11 HD1 HIS 11 -0.509 1.276 1.642
72 HD2 HIS 11 HD2 HIS 11 3.567 2.051 1.370
73 HE1 HIS 11 HE1 HIS 11 0.559 -0.082 3.468
74 H CYS 13 H CYS 13 4.507 -1.380 -3.128
75 HA CYS 13 HA CYS 13 5.126 -1.653 -0.339
76 1HB CYS 13 1HB CYS 13 6.117 -3.716 -2.207
77 2HB CYS 13 2HB CYS 13 5.136 -3.889 -0.754
78 H ALA 14 H ALA 14 6.952 -1.287 -3.309
79 HA ALA 14 HA ALA 14 9.292 -0.521 -1.777
80 1HB ALA 14 1HB ALA 14 10.580 -2.055 -3.562
81 2HB ALA 14 2HB ALA 14 10.109 -2.629 -1.962
82 3HB ALA 14 3HB ALA 14 9.109 -3.008 -3.364
83 H GLY 15 H GLY 15 7.507 0.964 -3.303
84 1HA GLY 15 1HA GLY 15 9.266 2.430 -4.936
85 2HA GLY 15 2HA GLY 15 7.533 2.674 -4.830
No H/Q in entry = 85
Start of MODEL 17
1 H ASN 1 H ASN 1 7.981 -2.348 -5.535
2 HA ASN 1 HA ASN 1 8.318 -3.685 -8.080
3 1HB ASN 1 1HB ASN 1 7.760 -5.732 -6.851
4 2HB ASN 1 2HB ASN 1 9.006 -4.825 -5.998
5 1HD2 ASN 1 1HD2 ASN 1 6.357 -6.600 -5.514
6 2HD2 ASN 1 2HD2 ASN 1 5.766 -5.896 -4.051
7 H GLY 2 H GLY 2 5.806 -2.444 -6.042
8 1HA GLY 2 1HA GLY 2 3.605 -3.772 -7.206
9 2HA GLY 2 2HA GLY 2 3.888 -2.243 -8.032
10 H VAL 3 H VAL 3 1.554 -2.801 -6.585
11 HA VAL 3 HA VAL 3 1.831 -0.877 -4.377
12 HB VAL 3 HB VAL 3 -0.719 -1.533 -5.843
13 1HG1 VAL 3 1HG1 VAL 3 0.023 0.224 -3.631
14 2HG1 VAL 3 2HG1 VAL 3 -0.932 1.011 -4.887
15 3HG1 VAL 3 3HG1 VAL 3 -1.550 -0.433 -4.083
16 1HG2 VAL 3 1HG2 VAL 3 1.144 -0.534 -7.292
17 2HG2 VAL 3 2HG2 VAL 3 -0.422 0.278 -7.295
18 3HG2 VAL 3 3HG2 VAL 3 0.912 0.935 -6.345
19 H CYS 4 H CYS 4 1.159 -1.430 -2.389
20 HA CYS 4 HA CYS 4 -0.102 -4.069 -2.057
21 1HB CYS 4 1HB CYS 4 2.032 -2.735 -0.392
22 2HB CYS 4 2HB CYS 4 1.090 -4.097 0.193
23 H CYS 5 H CYS 5 -1.905 -4.132 -0.850
24 HA CYS 5 HA CYS 5 -2.812 -1.611 0.340
25 1HB CYS 5 1HB CYS 5 -4.471 -4.035 -0.389
26 2HB CYS 5 2HB CYS 5 -5.067 -2.444 0.077
27 H GLY 6 H GLY 6 -2.700 -1.465 2.462
28 1HA GLY 6 1HA GLY 6 -2.161 -2.197 4.625
29 2HA GLY 6 2HA GLY 6 -2.289 -3.856 4.068
30 H TYR 7 H TYR 7 -4.490 -1.083 4.248
31 HA TYR 7 HA TYR 7 -6.701 -2.761 4.959
32 1HB TYR 7 1HB TYR 7 -7.038 -1.199 7.092
33 2HB TYR 7 2HB TYR 7 -6.147 -2.711 7.182
34 HD1 TYR 7 HD1 TYR 7 -4.255 -2.620 8.466
35 HD2 TYR 7 HD2 TYR 7 -5.359 0.857 6.276
36 HE1 TYR 7 HE1 TYR 7 -2.308 -1.433 9.379
37 HE2 TYR 7 HE2 TYR 7 -3.411 2.051 7.181
38 HH TYR 7 HH TYR 7 -1.945 1.721 9.460
39 H LYS 8 H LYS 8 -7.800 -1.954 3.308
40 HA LYS 8 HA LYS 8 -8.952 -0.570 1.946
41 1HB LYS 8 1HB LYS 8 -10.513 0.902 2.943
42 2HB LYS 8 2HB LYS 8 -10.286 -0.405 4.091
43 1HG LYS 8 1HG LYS 8 -8.933 0.975 5.497
44 2HG LYS 8 2HG LYS 8 -8.904 2.259 4.288
45 1HD LYS 8 1HD LYS 8 -11.385 2.428 4.523
46 2HD LYS 8 2HD LYS 8 -11.279 1.288 5.869
47 1HE LYS 8 1HE LYS 8 -11.344 3.626 6.631
48 2HE LYS 8 2HE LYS 8 -9.846 2.814 7.088
49 1HZ LYS 8 1HZ LYS 8 -8.963 3.837 4.907
50 2HZ LYS 8 2HZ LYS 8 -10.272 4.899 5.051
51 3HZ LYS 8 3HZ LYS 8 -9.108 4.825 6.274
52 H LEU 9 H LEU 9 -6.134 -0.056 2.380
53 HA LEU 9 HA LEU 9 -5.967 2.484 1.021
54 1HB LEU 9 1HB LEU 9 -5.781 3.104 3.409
55 2HB LEU 9 2HB LEU 9 -4.457 1.971 3.593
56 HG LEU 9 HG LEU 9 -3.128 3.312 1.979
57 1HD1 LEU 9 1HD1 LEU 9 -5.312 4.321 0.995
58 2HD1 LEU 9 2HD1 LEU 9 -5.121 5.516 2.277
59 3HD1 LEU 9 3HD1 LEU 9 -3.851 5.304 1.071
60 1HD2 LEU 9 1HD2 LEU 9 -3.372 3.664 4.595
61 2HD2 LEU 9 2HD2 LEU 9 -2.357 4.709 3.602
62 3HD2 LEU 9 3HD2 LEU 9 -3.972 5.237 4.070
63 H CYS 10 H CYS 10 -4.440 2.330 -0.534
64 HA CYS 10 HA CYS 10 -2.584 0.056 -0.335
65 1HB CYS 10 1HB CYS 10 -3.646 1.297 -2.879
66 2HB CYS 10 2HB CYS 10 -2.685 -0.169 -2.733
67 H HIS 11 H HIS 11 -0.472 0.344 -0.858
68 HA HIS 11 HA HIS 11 0.483 2.928 -1.811
69 1HB HIS 11 1HB HIS 11 0.319 3.169 0.663
70 2HB HIS 11 2HB HIS 11 1.350 1.759 0.853
71 HD1 HIS 11 HD1 HIS 11 1.557 5.207 -0.757
72 HD2 HIS 11 HD2 HIS 11 3.965 2.393 1.133
73 HE1 HIS 11 HE1 HIS 11 3.828 6.273 -0.581
74 H CYS 13 H CYS 13 4.343 -1.425 -3.077
75 HA CYS 13 HA CYS 13 5.126 -1.574 -0.371
76 1HB CYS 13 1HB CYS 13 6.178 -3.620 -2.220
77 2HB CYS 13 2HB CYS 13 5.239 -3.809 -0.741
78 H ALA 14 H ALA 14 7.105 -1.814 -3.320
79 HA ALA 14 HA ALA 14 9.222 -0.271 -2.176
80 1HB ALA 14 1HB ALA 14 10.930 -2.004 -2.110
81 2HB ALA 14 2HB ALA 14 9.607 -2.401 -1.013
82 3HB ALA 14 3HB ALA 14 9.737 -3.219 -2.569
83 H GLY 15 H GLY 15 7.753 0.037 -4.478
84 1HA GLY 15 1HA GLY 15 9.846 0.147 -6.445
85 2HA GLY 15 2HA GLY 15 8.200 0.732 -6.640
No H/Q in entry = 85
Start of MODEL 18
1 H ASN 1 H ASN 1 8.151 -1.310 -5.990
2 HA ASN 1 HA ASN 1 8.074 -1.798 -8.834
3 1HB ASN 1 1HB ASN 1 8.690 -4.077 -8.293
4 2HB ASN 1 2HB ASN 1 9.702 -2.977 -7.366
5 1HD2 ASN 1 1HD2 ASN 1 8.184 -5.787 -7.148
6 2HD2 ASN 1 2HD2 ASN 1 7.779 -5.813 -5.469
7 H GLY 2 H GLY 2 5.950 -1.990 -6.129
8 1HA GLY 2 1HA GLY 2 4.157 -3.949 -6.779
9 2HA GLY 2 2HA GLY 2 3.729 -2.604 -7.825
10 H VAL 3 H VAL 3 1.728 -2.437 -6.783
11 HA VAL 3 HA VAL 3 1.848 -0.818 -4.381
12 HB VAL 3 HB VAL 3 0.480 0.036 -6.159
13 1HG1 VAL 3 1HG1 VAL 3 -0.489 -2.704 -6.301
14 2HG1 VAL 3 2HG1 VAL 3 -1.782 -1.506 -6.349
15 3HG1 VAL 3 3HG1 VAL 3 -0.476 -1.441 -7.533
16 1HG2 VAL 3 1HG2 VAL 3 -0.653 -0.658 -3.566
17 2HG2 VAL 3 2HG2 VAL 3 -0.608 0.890 -4.410
18 3HG2 VAL 3 3HG2 VAL 3 -1.862 -0.289 -4.797
19 H CYS 4 H CYS 4 1.061 -1.348 -2.457
20 HA CYS 4 HA CYS 4 -0.144 -4.015 -2.116
21 1HB CYS 4 1HB CYS 4 1.855 -2.735 -0.236
22 2HB CYS 4 2HB CYS 4 1.181 -4.355 -0.118
23 H CYS 5 H CYS 5 -1.957 -4.021 -0.844
24 HA CYS 5 HA CYS 5 -2.675 -1.473 0.401
25 1HB CYS 5 1HB CYS 5 -4.113 -3.024 -1.356
26 2HB CYS 5 2HB CYS 5 -4.774 -3.514 0.203
27 H GLY 6 H GLY 6 -2.968 -1.331 2.528
28 1HA GLY 6 1HA GLY 6 -1.876 -2.528 4.499
29 2HA GLY 6 2HA GLY 6 -2.966 -3.839 4.087
30 H TYR 7 H TYR 7 -2.678 -0.693 5.521
31 HA TYR 7 HA TYR 7 -4.933 -1.134 7.190
32 1HB TYR 7 1HB TYR 7 -4.399 1.298 7.910
33 2HB TYR 7 2HB TYR 7 -3.239 0.026 8.264
34 HD1 TYR 7 HD1 TYR 7 -3.878 2.119 5.210
35 HD2 TYR 7 HD2 TYR 7 -1.102 0.858 8.177
36 HE1 TYR 7 HE1 TYR 7 -2.112 3.419 4.102
37 HE2 TYR 7 HE2 TYR 7 0.672 2.156 7.075
38 HH TYR 7 HH TYR 7 0.384 4.491 5.261
39 H LYS 8 H LYS 8 -6.112 -1.331 4.900
40 HA LYS 8 HA LYS 8 -7.878 -0.650 3.650
41 1HB LYS 8 1HB LYS 8 -8.090 1.406 5.847
42 2HB LYS 8 2HB LYS 8 -9.257 1.280 4.539
43 1HG LYS 8 1HG LYS 8 -9.773 -1.012 5.221
44 2HG LYS 8 2HG LYS 8 -8.612 -0.872 6.543
45 1HD LYS 8 1HD LYS 8 -10.928 -0.505 7.292
46 2HD LYS 8 2HD LYS 8 -9.915 0.917 7.537
47 1HE LYS 8 1HE LYS 8 -12.122 1.514 6.652
48 2HE LYS 8 2HE LYS 8 -10.829 1.943 5.533
49 1HZ LYS 8 1HZ LYS 8 -11.809 -0.683 5.033
50 2HZ LYS 8 2HZ LYS 8 -13.061 0.452 4.966
51 3HZ LYS 8 3HZ LYS 8 -11.699 0.640 3.982
52 H LEU 9 H LEU 9 -5.161 0.448 3.271
53 HA LEU 9 HA LEU 9 -5.870 2.400 1.262
54 1HB LEU 9 1HB LEU 9 -5.405 3.776 3.260
55 2HB LEU 9 2HB LEU 9 -3.831 3.020 3.408
56 HG LEU 9 HG LEU 9 -3.199 3.981 1.205
57 1HD1 LEU 9 1HD1 LEU 9 -6.007 4.614 1.149
58 2HD1 LEU 9 2HD1 LEU 9 -5.030 6.067 0.933
59 3HD1 LEU 9 3HD1 LEU 9 -4.811 4.688 -0.145
60 1HD2 LEU 9 1HD2 LEU 9 -4.078 5.862 3.385
61 2HD2 LEU 9 2HD2 LEU 9 -2.483 5.147 3.150
62 3HD2 LEU 9 3HD2 LEU 9 -3.086 6.352 2.012
63 H CYS 10 H CYS 10 -4.723 2.010 -0.514
64 HA CYS 10 HA CYS 10 -2.656 -0.018 -0.371
65 1HB CYS 10 1HB CYS 10 -3.763 1.338 -2.835
66 2HB CYS 10 2HB CYS 10 -2.848 -0.158 -2.768
67 H HIS 11 H HIS 11 -0.541 0.292 -0.809
68 HA HIS 11 HA HIS 11 0.410 2.788 -1.923
69 1HB HIS 11 1HB HIS 11 1.969 3.252 -0.062
70 2HB HIS 11 2HB HIS 11 0.292 3.396 0.431
71 HD1 HIS 11 HD1 HIS 11 1.858 3.176 2.778
72 HD2 HIS 11 HD2 HIS 11 0.981 -0.269 0.629
73 HE1 HIS 11 HE1 HIS 11 2.208 1.277 4.381
74 H CYS 13 H CYS 13 4.516 -1.529 -2.957
75 HA CYS 13 HA CYS 13 5.485 -1.430 -0.291
76 1HB CYS 13 1HB CYS 13 5.586 -3.414 -2.511
77 2HB CYS 13 2HB CYS 13 6.725 -3.608 -1.185
78 H ALA 14 H ALA 14 7.082 -1.298 -3.444
79 HA ALA 14 HA ALA 14 9.245 0.223 -2.315
80 1HB ALA 14 1HB ALA 14 10.449 -1.968 -3.775
81 2HB ALA 14 2HB ALA 14 9.563 -2.539 -2.361
82 3HB ALA 14 3HB ALA 14 10.839 -1.335 -2.176
83 H GLY 15 H GLY 15 7.234 0.670 -4.245
84 1HA GLY 15 1HA GLY 15 8.841 1.738 -6.357
85 2HA GLY 15 2HA GLY 15 7.099 1.887 -6.199
No H/Q in entry = 85
Start of MODEL 19
1 H ASN 1 H ASN 1 8.269 -1.078 -5.943
2 HA ASN 1 HA ASN 1 7.864 -1.109 -8.791
3 1HB ASN 1 1HB ASN 1 8.288 -3.638 -8.439
4 2HB ASN 1 2HB ASN 1 9.617 -2.514 -8.210
5 1HD2 ASN 1 1HD2 ASN 1 10.841 -3.214 -6.630
6 2HD2 ASN 1 2HD2 ASN 1 10.296 -3.829 -5.112
7 H GLY 2 H GLY 2 6.173 -2.274 -5.919
8 1HA GLY 2 1HA GLY 2 4.340 -3.983 -6.539
9 2HA GLY 2 2HA GLY 2 3.848 -2.725 -7.657
10 H VAL 3 H VAL 3 1.878 -2.461 -6.740
11 HA VAL 3 HA VAL 3 1.846 -0.814 -4.345
12 HB VAL 3 HB VAL 3 -0.518 -1.578 -6.058
13 1HG1 VAL 3 1HG1 VAL 3 -0.080 0.209 -3.782
14 2HG1 VAL 3 2HG1 VAL 3 -0.970 0.934 -5.121
15 3HG1 VAL 3 3HG1 VAL 3 -1.563 -0.546 -4.368
16 1HG2 VAL 3 1HG2 VAL 3 1.721 0.000 -6.815
17 2HG2 VAL 3 2HG2 VAL 3 0.239 -0.316 -7.718
18 3HG2 VAL 3 3HG2 VAL 3 0.328 1.065 -6.627
19 H CYS 4 H CYS 4 0.940 -1.404 -2.440
20 HA CYS 4 HA CYS 4 -0.402 -4.001 -2.278
21 1HB CYS 4 1HB CYS 4 0.900 -4.457 -0.166
22 2HB CYS 4 2HB CYS 4 1.853 -4.512 -1.641
23 H CYS 5 H CYS 5 -2.079 -4.053 -0.818
24 HA CYS 5 HA CYS 5 -2.727 -1.474 0.406
25 1HB CYS 5 1HB CYS 5 -4.587 -3.814 -0.030
26 2HB CYS 5 2HB CYS 5 -5.024 -2.147 0.334
27 H GLY 6 H GLY 6 -2.333 -1.269 2.464
28 1HA GLY 6 1HA GLY 6 -1.476 -2.071 4.528
29 2HA GLY 6 2HA GLY 6 -2.118 -3.661 4.149
30 H TYR 7 H TYR 7 -2.550 -0.875 5.907
31 HA TYR 7 HA TYR 7 -4.891 -1.821 7.197
32 1HB TYR 7 1HB TYR 7 -4.700 0.530 8.322
33 2HB TYR 7 2HB TYR 7 -3.484 -0.700 8.648
34 HD1 TYR 7 HD1 TYR 7 -3.996 1.872 5.953
35 HD2 TYR 7 HD2 TYR 7 -1.374 0.175 8.842
36 HE1 TYR 7 HE1 TYR 7 -2.223 3.420 5.247
37 HE2 TYR 7 HE2 TYR 7 0.405 1.721 8.144
38 HH TYR 7 HH TYR 7 0.286 4.229 6.908
39 H LYS 8 H LYS 8 -5.868 -1.773 4.853
40 HA LYS 8 HA LYS 8 -7.632 -1.095 3.588
41 1HB LYS 8 1HB LYS 8 -8.054 0.793 5.902
42 2HB LYS 8 2HB LYS 8 -9.133 0.723 4.518
43 1HG LYS 8 1HG LYS 8 -9.678 -1.579 5.020
44 2HG LYS 8 2HG LYS 8 -8.528 -1.581 6.358
45 1HD LYS 8 1HD LYS 8 -10.783 -1.288 7.203
46 2HD LYS 8 2HD LYS 8 -9.844 0.179 7.470
47 1HE LYS 8 1HE LYS 8 -11.629 -0.160 5.073
48 2HE LYS 8 2HE LYS 8 -12.244 0.435 6.614
49 1HZ LYS 8 1HZ LYS 8 -10.265 2.095 6.375
50 2HZ LYS 8 2HZ LYS 8 -10.392 1.722 4.729
51 3HZ LYS 8 3HZ LYS 8 -11.716 2.379 5.551
52 H LEU 9 H LEU 9 -4.998 -0.003 3.253
53 HA LEU 9 HA LEU 9 -5.688 2.204 1.514
54 1HB LEU 9 1HB LEU 9 -5.119 3.308 3.646
55 2HB LEU 9 2HB LEU 9 -3.575 2.479 3.660
56 HG LEU 9 HG LEU 9 -2.949 3.679 1.578
57 1HD1 LEU 9 1HD1 LEU 9 -5.674 4.843 1.962
58 2HD1 LEU 9 2HD1 LEU 9 -4.403 5.793 1.191
59 3HD1 LEU 9 3HD1 LEU 9 -4.903 4.253 0.490
60 1HD2 LEU 9 1HD2 LEU 9 -3.226 4.743 4.223
61 2HD2 LEU 9 2HD2 LEU 9 -1.953 5.023 3.034
62 3HD2 LEU 9 3HD2 LEU 9 -3.396 6.037 3.035
63 H CYS 10 H CYS 10 -4.639 1.943 -0.351
64 HA CYS 10 HA CYS 10 -2.550 -0.075 -0.466
65 1HB CYS 10 1HB CYS 10 -3.850 1.389 -2.765
66 2HB CYS 10 2HB CYS 10 -2.903 -0.091 -2.844
67 H HIS 11 H HIS 11 -0.488 0.304 -0.873
68 HA HIS 11 HA HIS 11 0.430 2.884 -1.871
69 1HB HIS 11 1HB HIS 11 0.259 3.171 0.593
70 2HB HIS 11 2HB HIS 11 1.282 1.758 0.818
71 HD1 HIS 11 HD1 HIS 11 1.522 5.184 -0.833
72 HD2 HIS 11 HD2 HIS 11 3.894 2.383 1.119
73 HE1 HIS 11 HE1 HIS 11 3.795 6.243 -0.641
74 H CYS 13 H CYS 13 4.391 -1.478 -2.874
75 HA CYS 13 HA CYS 13 5.288 -1.297 -0.170
76 1HB CYS 13 1HB CYS 13 4.947 -3.425 -2.167
77 2HB CYS 13 2HB CYS 13 6.276 -3.694 -1.044
78 H ALA 14 H ALA 14 6.888 -1.288 -3.289
79 HA ALA 14 HA ALA 14 9.257 -0.228 -2.039
80 1HB ALA 14 1HB ALA 14 9.852 -2.531 -3.808
81 2HB ALA 14 2HB ALA 14 9.288 -2.889 -2.176
82 3HB ALA 14 3HB ALA 14 10.741 -1.916 -2.414
83 H GLY 15 H GLY 15 7.292 0.717 -3.847
84 1HA GLY 15 1HA GLY 15 9.003 1.858 -5.835
85 2HA GLY 15 2HA GLY 15 7.294 2.185 -5.617
No H/Q in entry = 85
Start of MODEL 20
1 H ASN 1 H ASN 1 8.146 -1.373 -6.129
2 HA ASN 1 HA ASN 1 7.988 -2.076 -8.919
3 1HB ASN 1 1HB ASN 1 9.683 -3.122 -7.445
4 2HB ASN 1 2HB ASN 1 8.388 -3.855 -6.506
5 1HD2 ASN 1 1HD2 ASN 1 7.985 -5.886 -6.995
6 2HD2 ASN 1 2HD2 ASN 1 8.238 -6.635 -8.529
7 H GLY 2 H GLY 2 5.932 -2.102 -6.146
8 1HA GLY 2 1HA GLY 2 4.159 -4.123 -6.598
9 2HA GLY 2 2HA GLY 2 3.700 -2.890 -7.761
10 H VAL 3 H VAL 3 1.709 -2.668 -6.732
11 HA VAL 3 HA VAL 3 1.767 -0.814 -4.494
12 HB VAL 3 HB VAL 3 -0.685 -1.806 -5.944
13 1HG1 VAL 3 1HG1 VAL 3 -0.234 0.002 -3.790
14 2HG1 VAL 3 2HG1 VAL 3 -0.883 0.897 -5.164
15 3HG1 VAL 3 3HG1 VAL 3 -1.760 -0.492 -4.524
16 1HG2 VAL 3 1HG2 VAL 3 1.438 -0.331 -7.082
17 2HG2 VAL 3 2HG2 VAL 3 -0.142 -0.685 -7.784
18 3HG2 VAL 3 3HG2 VAL 3 0.095 0.788 -6.844
19 H CYS 4 H CYS 4 1.035 -1.285 -2.479
20 HA CYS 4 HA CYS 4 -0.028 -3.992 -2.025
21 1HB CYS 4 1HB CYS 4 1.897 -2.493 -0.229
22 2HB CYS 4 2HB CYS 4 1.285 -4.124 0.024
23 H CYS 5 H CYS 5 -1.888 -4.043 -0.884
24 HA CYS 5 HA CYS 5 -2.801 -1.524 0.299
25 1HB CYS 5 1HB CYS 5 -4.447 -3.963 -0.406
26 2HB CYS 5 2HB CYS 5 -5.053 -2.374 0.050
27 H GLY 6 H GLY 6 -2.725 -1.341 2.404
28 1HA GLY 6 1HA GLY 6 -1.913 -2.235 4.493
29 2HA GLY 6 2HA GLY 6 -2.575 -3.794 4.032
30 H TYR 7 H TYR 7 -3.039 -1.037 5.827
31 HA TYR 7 HA TYR 7 -5.483 -1.944 6.939
32 1HB TYR 7 1HB TYR 7 -5.303 0.369 8.138
33 2HB TYR 7 2HB TYR 7 -4.144 -0.901 8.505
34 HD1 TYR 7 HD1 TYR 7 -4.416 1.753 5.855
35 HD2 TYR 7 HD2 TYR 7 -2.028 -0.090 8.857
36 HE1 TYR 7 HE1 TYR 7 -2.564 3.271 5.306
37 HE2 TYR 7 HE2 TYR 7 -0.170 1.426 8.315
38 HH TYR 7 HH TYR 7 -0.100 3.925 7.180
39 H LYS 8 H LYS 8 -6.298 -1.804 4.530
40 HA LYS 8 HA LYS 8 -7.946 -1.052 3.166
41 1HB LYS 8 1HB LYS 8 -8.539 0.673 5.564
42 2HB LYS 8 2HB LYS 8 -9.457 0.827 4.074
43 1HG LYS 8 1HG LYS 8 -10.705 -0.572 5.508
44 2HG LYS 8 2HG LYS 8 -10.003 -1.616 4.272
45 1HD LYS 8 1HD LYS 8 -8.260 -2.310 5.817
46 2HD LYS 8 2HD LYS 8 -8.889 -1.213 7.048
47 1HE LYS 8 1HE LYS 8 -10.374 -3.552 5.853
48 2HE LYS 8 2HE LYS 8 -9.591 -3.534 7.434
49 1HZ LYS 8 1HZ LYS 8 -11.242 -1.331 7.396
50 2HZ LYS 8 2HZ LYS 8 -12.156 -2.570 6.694
51 3HZ LYS 8 3HZ LYS 8 -11.498 -2.775 8.239
52 H LEU 9 H LEU 9 -5.294 -0.019 3.051
53 HA LEU 9 HA LEU 9 -5.803 2.263 1.348
54 1HB LEU 9 1HB LEU 9 -5.338 3.274 3.553
55 2HB LEU 9 2HB LEU 9 -3.822 2.398 3.629
56 HG LEU 9 HG LEU 9 -3.034 3.652 1.636
57 1HD1 LEU 9 1HD1 LEU 9 -5.800 4.578 1.681
58 2HD1 LEU 9 2HD1 LEU 9 -4.619 5.880 1.528
59 3HD1 LEU 9 3HD1 LEU 9 -4.629 4.557 0.361
60 1HD2 LEU 9 1HD2 LEU 9 -2.567 4.371 3.977
61 2HD2 LEU 9 2HD2 LEU 9 -2.549 5.684 2.800
62 3HD2 LEU 9 3HD2 LEU 9 -3.942 5.468 3.861
63 H CYS 10 H CYS 10 -4.618 2.053 -0.447
64 HA CYS 10 HA CYS 10 -2.576 -0.026 -0.468
65 1HB CYS 10 1HB CYS 10 -3.796 1.439 -2.814
66 2HB CYS 10 2HB CYS 10 -2.796 -0.005 -2.878
67 H HIS 11 H HIS 11 -0.502 0.330 -0.767
68 HA HIS 11 HA HIS 11 0.490 2.887 -1.748
69 1HB HIS 11 1HB HIS 11 0.246 3.154 0.724
70 2HB HIS 11 2HB HIS 11 1.285 1.755 0.955
71 HD1 HIS 11 HD1 HIS 11 3.820 2.129 -0.167
72 HD2 HIS 11 HD2 HIS 11 1.567 5.496 0.790
73 HE1 HIS 11 HE1 HIS 11 5.461 4.027 -0.033
74 H CYS 13 H CYS 13 4.532 -1.488 -2.944
75 HA CYS 13 HA CYS 13 5.590 -1.204 -0.320
76 1HB CYS 13 1HB CYS 13 5.700 -3.331 -2.416
77 2HB CYS 13 2HB CYS 13 6.816 -3.419 -1.058
78 H ALA 14 H ALA 14 7.047 -1.162 -3.540
79 HA ALA 14 HA ALA 14 9.208 0.455 -2.584
80 1HB ALA 14 1HB ALA 14 10.921 -1.268 -3.557
81 2HB ALA 14 2HB ALA 14 10.342 -1.432 -1.898
82 3HB ALA 14 3HB ALA 14 9.656 -2.437 -3.174
83 H GLY 15 H GLY 15 7.184 0.747 -4.512
84 1HA GLY 15 1HA GLY 15 8.758 1.630 -6.729
85 2HA GLY 15 2HA GLY 15 7.019 1.790 -6.558
No H/Q in entry = 85
Start of MODEL 21
1 H ASN 1 H ASN 1 7.930 -2.224 -5.651
2 HA ASN 1 HA ASN 1 7.686 -3.489 -7.498
3 1HB ASN 1 1HB ASN 1 8.001 -4.329 -6.127
4 2HB ASN 1 2HB ASN 1 7.912 -4.222 -5.864
5 1HD2 ASN 1 1HD2 ASN 1 7.317 -5.296 -5.541
6 2HD2 ASN 1 2HD2 ASN 1 7.182 -5.551 -5.192
7 H GLY 2 H GLY 2 5.955 -2.553 -5.825
8 1HA GLY 2 1HA GLY 2 3.975 -3.929 -6.873
9 2HA GLY 2 2HA GLY 2 4.106 -2.577 -7.662
10 H VAL 3 H VAL 3 1.741 -2.837 -6.665
11 HA VAL 3 HA VAL 3 1.717 -0.922 -4.478
12 H CYS 4 H CYS 4 0.999 -1.383 -2.498
13 HA CYS 4 HA CYS 4 -0.099 -4.058 -2.007
14 1HB CYS 4 1HB CYS 4 1.753 -2.786 -0.239
15 2HB CYS 4 2HB CYS 4 1.305 -4.104 -0.101
16 H CYS 5 H CYS 5 -1.943 -4.084 -0.880
17 HA CYS 5 HA CYS 5 -2.837 -1.561 0.303
18 1HB CYS 5 1HB CYS 5 -4.468 -3.926 -0.518
19 2HB CYS 5 2HB CYS 5 -5.082 -2.461 0.034
20 H GLY 6 H GLY 6 -2.900 -1.416 2.411
21 1HA GLY 6 1HA GLY 6 -2.036 -2.472 4.448
22 2HA GLY 6 2HA GLY 6 -2.867 -3.901 3.980
23 H TYR 7 H TYR 7 -3.057 -1.046 5.590
24 HA TYR 7 HA TYR 7 -5.434 -1.733 6.851
25 1HB TYR 7 1HB TYR 7 -5.070 0.563 7.921
26 2HB TYR 7 2HB TYR 7 -4.003 -0.777 8.288
27 HH TYR 7 HH TYR 7 0.151 3.602 6.612
28 H LYS 8 H LYS 8 -6.400 -1.631 4.578
29 HA LYS 8 HA LYS 8 -7.990 -0.807 3.226
30 H LEU 9 H LEU 9 -5.299 0.155 3.093
31 HA LEU 9 HA LEU 9 -5.764 2.368 1.347
32 1HB LEU 9 1HB LEU 9 -5.316 3.426 3.501
33 2HB LEU 9 2HB LEU 9 -3.819 2.535 3.606
34 HG LEU 9 HG LEU 9 -3.000 3.699 1.603
35 1HD1 LEU 9 1HD1 LEU 9 -5.119 4.996 1.209
36 2HD1 LEU 9 2HD1 LEU 9 -4.848 5.225 1.210
37 3HD1 LEU 9 3HD1 LEU 9 -4.876 4.976 0.954
38 1HD2 LEU 9 1HD2 LEU 9 -2.949 5.113 3.571
39 2HD2 LEU 9 2HD2 LEU 9 -2.860 5.303 3.314
40 3HD2 LEU 9 3HD2 LEU 9 -3.147 5.363 3.480
41 H CYS 10 H CYS 10 -4.581 2.095 -0.424
42 HA CYS 10 HA CYS 10 -2.566 -0.002 -0.405
43 1HB CYS 10 1HB CYS 10 -3.746 1.446 -2.773
44 2HB CYS 10 2HB CYS 10 -2.778 -0.020 -2.807
45 H HIS 11 H HIS 11 -0.470 0.327 -0.789
46 HA HIS 11 HA HIS 11 0.479 2.905 -1.710
47 H CYS 13 H CYS 13 4.529 -1.259 -3.250
48 HA CYS 13 HA CYS 13 5.684 -1.218 -0.715
49 1HB CYS 13 1HB CYS 13 5.615 -3.379 -2.424
50 2HB CYS 13 2HB CYS 13 6.086 -3.539 -1.111
51 H ALA 14 H ALA 14 7.526 -1.330 -2.882
52 HA ALA 14 HA ALA 14 9.271 -0.441 -2.926
53 1HB ALA 14 1HB ALA 14 10.431 -1.721 -2.731
54 2HB ALA 14 2HB ALA 14 10.368 -1.930 -2.648
55 3HB ALA 14 3HB ALA 14 10.193 -1.785 -2.546
56 H GLY 15 H GLY 15 8.259 -0.456 -4.681
57 1HA GLY 15 1HA GLY 15 9.989 -0.713 -5.737
58 2HA GLY 15 2HA GLY 15 8.679 -0.323 -6.229
No H/Q in entry = 58