Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
603952 | 2nb6 RC | 25963 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -8.958 -0.036 -0.523
2 HA2 GLY 1 HA2 GLY 1 -8.255 -2.394 -0.131
3 HA3 GLY 1 HA1 GLY 1 -7.847 -2.439 -1.839
4 H CYS 2 H CYS 2 -6.408 -2.506 0.969
5 HA CYS 2 HA CYS 2 -4.216 -0.708 0.163
6 HB2 CYS 2 HB2 CYS 2 -4.940 -1.618 2.957
7 HB3 CYS 2 HB1 CYS 2 -3.608 -0.547 2.534
8 H TYR 3 H TYR 3 -2.215 -1.544 -0.066
9 HA TYR 3 HA TYR 3 -1.690 -4.259 0.896
10 HB2 TYR 3 HB2 TYR 3 -0.548 -4.684 -1.368
11 HB3 TYR 3 HB1 TYR 3 -2.306 -4.765 -1.313
12 HD1 TYR 3 HD1 TYR 3 0.573 -2.746 -2.412
13 HD2 TYR 3 HD2 TYR 3 -3.657 -3.192 -2.511
14 HE1 TYR 3 HE1 TYR 3 0.446 -1.080 -4.217
15 HE2 TYR 3 HE2 TYR 3 -3.796 -1.527 -4.317
16 HH TYR 3 HH TYR 3 -0.944 -0.285 -5.894
17 HA PRO 4 HA PRO 4 2.274 -2.722 1.979
18 HB2 PRO 4 HB2 PRO 4 3.834 -4.913 1.606
19 HB3 PRO 4 HB1 PRO 4 2.684 -4.769 2.939
20 HG2 PRO 4 HG2 PRO 4 2.386 -6.200 0.327
21 HG3 PRO 4 HG1 PRO 4 1.918 -6.731 1.953
22 HD2 PRO 4 HD2 PRO 4 0.137 -5.721 0.181
23 HD3 PRO 4 HD1 PRO 4 -0.026 -5.493 1.934
24 H VAL 5 H VAL 5 4.180 -1.895 1.137
25 HA VAL 5 HA VAL 5 4.799 -2.483 -1.671
26 HB VAL 5 HB VAL 5 5.208 -0.024 -2.040
27 HG11 VAL 5 HG11 VAL 5 2.315 -0.500 -1.429
28 HG12 VAL 5 HG12 VAL 5 3.043 0.355 -2.791
29 HG13 VAL 5 HG13 VAL 5 3.128 -1.405 -2.705
30 HG21 VAL 5 HG21 VAL 5 3.576 0.233 0.484
31 HG22 VAL 5 HG22 VAL 5 5.277 0.658 0.306
32 HG23 VAL 5 HG23 VAL 5 4.048 1.557 -0.581
33 HA PRO 6 HA PRO 6 8.997 -2.484 -0.385
34 HB2 PRO 6 HB2 PRO 6 10.240 -1.577 -2.622
35 HB3 PRO 6 HB1 PRO 6 9.525 -3.190 -2.508
36 HG2 PRO 6 HG2 PRO 6 8.409 -0.706 -3.753
37 HG3 PRO 6 HG1 PRO 6 8.385 -2.371 -4.362
38 HD2 PRO 6 HD2 PRO 6 6.247 -1.230 -3.154
39 HD3 PRO 6 HD1 PRO 6 6.600 -2.966 -3.031
40 H TYR 7 H TYR 7 8.183 0.469 -2.219
41 HA TYR 7 HA TYR 7 10.139 2.012 -0.752
42 HB2 TYR 7 HB2 TYR 7 9.407 3.880 -2.158
43 HB3 TYR 7 HB1 TYR 7 9.751 2.457 -3.136
44 HD1 TYR 7 HD2 TYR 7 7.073 4.597 -1.787
45 HD2 TYR 7 HD1 TYR 7 8.025 1.373 -4.394
46 HE1 TYR 7 HE2 TYR 7 4.833 4.755 -2.791
47 HE2 TYR 7 HE1 TYR 7 5.788 1.522 -5.406
48 HH TYR 7 HH TYR 7 4.003 3.528 -5.634
49 HA PRO 8 HA PRO 8 7.469 3.344 2.487
50 HB2 PRO 8 HB2 PRO 8 8.785 5.606 3.208
51 HB3 PRO 8 HB1 PRO 8 9.380 3.986 3.588
52 HG2 PRO 8 HG2 PRO 8 10.192 5.831 1.376
53 HG3 PRO 8 HG1 PRO 8 11.209 4.827 2.426
54 HD2 PRO 8 HD2 PRO 8 10.557 4.098 -0.100
55 HD3 PRO 8 HD1 PRO 8 10.805 2.916 1.201
56 HA PRO 9 HA PRO 9 6.280 4.405 3.930
57 HB2 PRO 9 HB2 PRO 9 3.570 4.276 4.014
58 HB3 PRO 9 HB1 PRO 9 4.478 5.721 4.477
59 HG2 PRO 9 HG2 PRO 9 3.081 5.105 1.901
60 HG3 PRO 9 HG1 PRO 9 3.102 6.616 2.828
61 HD2 PRO 9 HD2 PRO 9 4.649 6.228 0.640
62 HD3 PRO 9 HD1 PRO 9 5.164 7.238 2.007
63 H PHE 10 H PHE 10 5.718 2.290 4.537
64 HA PHE 10 HA PHE 10 5.645 0.409 2.372
65 HB2 PHE 10 HB2 PHE 10 5.511 -0.040 5.361
66 HB3 PHE 10 HB1 PHE 10 5.744 -1.297 4.152
67 HD1 PHE 10 HD2 PHE 10 7.629 0.206 2.344
68 HD2 PHE 10 HD1 PHE 10 7.509 -0.244 6.574
69 HE1 PHE 10 HE2 PHE 10 10.061 0.559 2.447
70 HE2 PHE 10 HE1 PHE 10 9.941 0.109 6.685
71 HZ PHE 10 HZ PHE 10 11.221 0.510 4.619
72 H PHE 11 H PHE 11 3.283 2.160 3.860
73 HA PHE 11 HA PHE 11 1.255 0.059 3.477
74 HB2 PHE 11 HB2 PHE 11 -0.191 1.650 4.882
75 HB3 PHE 11 HB1 PHE 11 1.090 0.774 5.713
76 HD1 PHE 11 HD1 PHE 11 3.135 1.936 6.414
77 HD2 PHE 11 HD2 PHE 11 -0.141 4.022 4.671
78 HE1 PHE 11 HE1 PHE 11 4.050 4.064 7.246
79 HE2 PHE 11 HE2 PHE 11 0.770 6.152 5.500
80 HZ PHE 11 HZ PHE 11 2.869 6.175 6.788
81 H THR 12 H THR 12 0.184 0.219 1.634
82 HA THR 12 HA THR 12 -0.274 2.898 0.492
83 HB THR 12 HB THR 12 -0.063 0.246 -0.947
84 HG1 THR 12 HG1 THR 12 1.869 1.613 -0.126
85 HG21 THR 12 HG21 THR 12 -0.061 1.847 -2.974
86 HG22 THR 12 HG22 THR 12 -0.816 3.000 -1.872
87 HG23 THR 12 HG23 THR 12 -1.604 1.460 -2.213
88 H CYS 13 H CYS 13 -2.304 3.436 -0.263
89 HA CYS 13 HA CYS 13 -4.455 1.474 0.039
90 HB2 CYS 13 HB2 CYS 13 -4.274 4.127 1.451
91 HB3 CYS 13 HB1 CYS 13 -5.827 3.360 1.132
92 H ASP 14 H ASP 14 -6.042 1.656 -1.454
93 HA ASP 14 HA ASP 14 -5.602 3.394 -3.684
94 HB2 ASP 14 HB2 ASP 14 -7.529 1.222 -3.010
95 HB3 ASP 14 HB1 ASP 14 -7.971 2.348 -4.291
96 HA PRO 15 HA PRO 15 -8.213 6.793 -2.757
97 HB2 PRO 15 HB2 PRO 15 -9.388 7.303 -5.150
98 HB3 PRO 15 HB1 PRO 15 -7.685 7.644 -4.825
99 HG2 PRO 15 HG2 PRO 15 -8.913 5.311 -6.243
100 HG3 PRO 15 HG1 PRO 15 -7.474 6.252 -6.676
101 HD2 PRO 15 HD2 PRO 15 -7.324 3.839 -5.456
102 HD3 PRO 15 HD1 PRO 15 -6.132 5.125 -5.178
103 H ASN 16 H ASN 16 -9.664 3.953 -4.171
104 HA ASN 16 HA ASN 16 -12.377 4.788 -3.743
105 HB2 ASN 16 HB2 ASN 16 -12.904 2.394 -4.278
106 HB3 ASN 16 HB1 ASN 16 -11.954 3.216 -5.513
107 HD21 ASN 16 HD21 ASN 16 -10.486 1.940 -6.349
108 HD22 ASN 16 HD22 ASN 16 -9.558 0.754 -5.503
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -9.435 -1.675 -0.865
2 HA2 GLY 1 HA2 GLY 1 -7.868 -3.343 -0.666
3 HA3 GLY 1 HA1 GLY 1 -7.467 -3.054 -2.353
4 H CYS 2 H CYS 2 -6.171 -3.165 0.622
5 HA CYS 2 HA CYS 2 -4.064 -1.234 -0.089
6 HB2 CYS 2 HB2 CYS 2 -5.596 -0.583 1.876
7 HB3 CYS 2 HB1 CYS 2 -4.793 -1.877 2.760
8 H TYR 3 H TYR 3 -2.046 -2.014 -0.113
9 HA TYR 3 HA TYR 3 -1.451 -4.499 1.318
10 HB2 TYR 3 HB2 TYR 3 -0.141 -5.217 -0.777
11 HB3 TYR 3 HB1 TYR 3 -1.892 -5.395 -0.808
12 HD1 TYR 3 HD2 TYR 3 -3.268 -3.898 -2.180
13 HD2 TYR 3 HD1 TYR 3 0.979 -3.635 -2.207
14 HE1 TYR 3 HE2 TYR 3 -3.370 -2.561 -4.242
15 HE2 TYR 3 HE1 TYR 3 0.889 -2.296 -4.269
16 HH TYR 3 HH TYR 3 -1.440 -2.179 -6.285
17 HA PRO 4 HA PRO 4 2.352 -2.571 2.356
18 HB2 PRO 4 HB2 PRO 4 4.039 -4.695 2.443
19 HB3 PRO 4 HB1 PRO 4 2.796 -4.406 3.665
20 HG2 PRO 4 HG2 PRO 4 2.745 -6.259 1.316
21 HG3 PRO 4 HG1 PRO 4 2.196 -6.544 2.978
22 HD2 PRO 4 HD2 PRO 4 0.490 -5.946 0.963
23 HD3 PRO 4 HD1 PRO 4 0.199 -5.444 2.641
24 H VAL 5 H VAL 5 4.283 -1.798 1.506
25 HA VAL 5 HA VAL 5 5.095 -2.784 -1.136
26 HB VAL 5 HB VAL 5 5.431 -0.405 -1.871
27 HG11 VAL 5 HG11 VAL 5 2.523 -0.751 -1.346
28 HG12 VAL 5 HG12 VAL 5 3.360 -0.320 -2.839
29 HG13 VAL 5 HG13 VAL 5 3.364 -1.992 -2.277
30 HG21 VAL 5 HG21 VAL 5 5.393 0.703 0.269
31 HG22 VAL 5 HG22 VAL 5 4.070 1.319 -0.721
32 HG23 VAL 5 HG23 VAL 5 3.744 0.156 0.564
33 HA PRO 6 HA PRO 6 9.204 -2.401 0.363
34 HB2 PRO 6 HB2 PRO 6 10.549 -1.792 -1.916
35 HB3 PRO 6 HB1 PRO 6 9.886 -3.398 -1.592
36 HG2 PRO 6 HG2 PRO 6 8.760 -1.186 -3.266
37 HG3 PRO 6 HG1 PRO 6 8.833 -2.923 -3.611
38 HD2 PRO 6 HD2 PRO 6 6.585 -1.709 -2.713
39 HD3 PRO 6 HD1 PRO 6 6.992 -3.388 -2.302
40 H TYR 7 H TYR 7 8.395 0.199 -1.945
41 HA TYR 7 HA TYR 7 10.208 2.033 -0.648
42 HB2 TYR 7 HB2 TYR 7 9.563 3.607 -2.361
43 HB3 TYR 7 HB1 TYR 7 9.835 2.039 -3.112
44 HD1 TYR 7 HD2 TYR 7 7.284 4.498 -2.132
45 HD2 TYR 7 HD1 TYR 7 8.034 0.826 -4.144
46 HE1 TYR 7 HE2 TYR 7 5.041 4.598 -3.138
47 HE2 TYR 7 HE1 TYR 7 5.795 0.916 -5.157
48 HH TYR 7 HH TYR 7 3.953 3.610 -5.310
49 HA PRO 8 HA PRO 8 7.333 3.680 2.257
50 HB2 PRO 8 HB2 PRO 8 8.559 6.054 2.738
51 HB3 PRO 8 HB1 PRO 8 9.167 4.516 3.361
52 HG2 PRO 8 HG2 PRO 8 10.060 6.075 0.967
53 HG3 PRO 8 HG1 PRO 8 11.039 5.248 2.192
54 HD2 PRO 8 HD2 PRO 8 10.541 4.174 -0.244
55 HD3 PRO 8 HD1 PRO 8 10.744 3.182 1.214
56 HA PRO 9 HA PRO 9 6.016 4.848 3.465
57 HB2 PRO 9 HB2 PRO 9 3.311 4.628 3.387
58 HB3 PRO 9 HB1 PRO 9 4.142 6.151 3.729
59 HG2 PRO 9 HG2 PRO 9 2.945 5.181 1.161
60 HG3 PRO 9 HG1 PRO 9 2.858 6.791 1.899
61 HD2 PRO 9 HD2 PRO 9 4.563 6.203 -0.120
62 HD3 PRO 9 HD1 PRO 9 4.952 7.388 1.143
63 H PHE 10 H PHE 10 5.454 2.802 4.290
64 HA PHE 10 HA PHE 10 5.597 0.673 2.369
65 HB2 PHE 10 HB2 PHE 10 5.248 0.574 5.373
66 HB3 PHE 10 HB1 PHE 10 5.618 -0.804 4.342
67 HD1 PHE 10 HD1 PHE 10 7.583 0.588 2.513
68 HD2 PHE 10 HD2 PHE 10 7.155 0.567 6.748
69 HE1 PHE 10 HE1 PHE 10 9.987 1.053 2.754
70 HE2 PHE 10 HE2 PHE 10 9.559 1.034 6.996
71 HZ PHE 10 HZ PHE 10 10.977 1.278 4.998
72 H PHE 11 H PHE 11 3.085 2.508 3.436
73 HA PHE 11 HA PHE 11 1.148 0.302 3.206
74 HB2 PHE 11 HB2 PHE 11 -0.444 2.027 4.251
75 HB3 PHE 11 HB1 PHE 11 0.789 1.326 5.294
76 HD1 PHE 11 HD2 PHE 11 2.737 2.651 5.975
77 HD2 PHE 11 HD1 PHE 11 -0.430 4.343 3.689
78 HE1 PHE 11 HE2 PHE 11 3.531 4.906 6.553
79 HE2 PHE 11 HE1 PHE 11 0.361 6.603 4.262
80 HZ PHE 11 HZ PHE 11 2.342 6.887 5.696
81 H THR 12 H THR 12 0.211 0.157 1.289
82 HA THR 12 HA THR 12 -0.342 2.640 -0.202
83 HB THR 12 HB THR 12 0.382 -0.055 -1.370
84 HG1 THR 12 HG1 THR 12 2.179 1.385 -2.182
85 HG21 THR 12 HG21 THR 12 0.568 1.874 -3.347
86 HG22 THR 12 HG22 THR 12 -0.915 2.293 -2.491
87 HG23 THR 12 HG23 THR 12 -0.717 0.680 -3.175
88 H CYS 13 H CYS 13 -2.460 3.004 -0.121
89 HA CYS 13 HA CYS 13 -4.286 0.712 -0.436
90 HB2 CYS 13 HB2 CYS 13 -5.015 3.321 0.889
91 HB3 CYS 13 HB1 CYS 13 -5.879 1.787 0.956
92 H ASP 14 H ASP 14 -6.484 1.436 -1.317
93 HA ASP 14 HA ASP 14 -6.045 3.349 -3.515
94 HB2 ASP 14 HB2 ASP 14 -6.355 0.790 -3.993
95 HB3 ASP 14 HB1 ASP 14 -8.057 1.137 -3.705
96 HA PRO 15 HA PRO 15 -9.446 5.056 -0.911
97 HB2 PRO 15 HB2 PRO 15 -8.683 7.642 -1.233
98 HB3 PRO 15 HB1 PRO 15 -8.001 6.587 0.010
99 HG2 PRO 15 HG2 PRO 15 -6.880 7.335 -2.663
100 HG3 PRO 15 HG1 PRO 15 -6.056 7.218 -1.097
101 HD2 PRO 15 HD2 PRO 15 -5.908 5.268 -2.969
102 HD3 PRO 15 HD1 PRO 15 -5.861 4.926 -1.228
103 H ASN 16 H ASN 16 -11.362 5.293 -1.862
104 HA ASN 16 HA ASN 16 -11.805 5.558 -4.580
105 HB2 ASN 16 HB2 ASN 16 -13.504 6.009 -2.157
106 HB3 ASN 16 HB1 ASN 16 -14.129 6.469 -3.739
107 HD21 ASN 16 HD21 ASN 16 -14.132 4.089 -1.538
108 HD22 ASN 16 HD22 ASN 16 -14.419 2.724 -2.559
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -9.067 -0.494 -1.608
2 HA2 GLY 1 HA2 GLY 1 -8.304 -2.527 0.375
3 HA3 GLY 1 HA1 GLY 1 -8.092 -2.664 -1.363
4 H CYS 2 H CYS 2 -6.414 -2.424 1.373
5 HA CYS 2 HA CYS 2 -4.316 -0.714 0.216
6 HB2 CYS 2 HB2 CYS 2 -4.526 -1.603 3.094
7 HB3 CYS 2 HB1 CYS 2 -3.494 -0.340 2.431
8 H TYR 3 H TYR 3 -2.249 -1.476 -0.032
9 HA TYR 3 HA TYR 3 -1.681 -4.232 0.781
10 HB2 TYR 3 HB2 TYR 3 -0.601 -4.534 -1.534
11 HB3 TYR 3 HB1 TYR 3 -2.355 -4.633 -1.432
12 HD1 TYR 3 HD2 TYR 3 -3.750 -2.782 -2.277
13 HD2 TYR 3 HD1 TYR 3 0.478 -2.769 -2.745
14 HE1 TYR 3 HE2 TYR 3 -3.952 -1.031 -3.993
15 HE2 TYR 3 HE1 TYR 3 0.289 -1.017 -4.461
16 HH TYR 3 HH TYR 3 -1.760 0.917 -4.897
17 HA PRO 4 HA PRO 4 2.304 -2.722 1.829
18 HB2 PRO 4 HB2 PRO 4 3.865 -4.880 1.303
19 HB3 PRO 4 HB1 PRO 4 2.751 -4.812 2.675
20 HG2 PRO 4 HG2 PRO 4 2.388 -6.113 0.004
21 HG3 PRO 4 HG1 PRO 4 1.969 -6.727 1.614
22 HD2 PRO 4 HD2 PRO 4 0.133 -5.643 -0.056
23 HD3 PRO 4 HD1 PRO 4 0.019 -5.503 1.710
24 H VAL 5 H VAL 5 4.186 -1.848 0.976
25 HA VAL 5 HA VAL 5 4.723 -2.286 -1.875
26 HB VAL 5 HB VAL 5 5.118 0.188 -2.127
27 HG11 VAL 5 HG11 VAL 5 2.957 0.571 -2.836
28 HG12 VAL 5 HG12 VAL 5 2.993 -1.191 -2.752
29 HG13 VAL 5 HG13 VAL 5 2.243 -0.261 -1.455
30 HG21 VAL 5 HG21 VAL 5 3.544 0.325 0.443
31 HG22 VAL 5 HG22 VAL 5 5.252 0.726 0.264
32 HG23 VAL 5 HG23 VAL 5 4.028 1.696 -0.556
33 HA PRO 6 HA PRO 6 8.956 -2.346 -0.714
34 HB2 PRO 6 HB2 PRO 6 10.133 -1.325 -2.937
35 HB3 PRO 6 HB1 PRO 6 9.421 -2.942 -2.883
36 HG2 PRO 6 HG2 PRO 6 8.269 -0.401 -3.968
37 HG3 PRO 6 HG1 PRO 6 8.227 -2.034 -4.659
38 HD2 PRO 6 HD2 PRO 6 6.125 -0.960 -3.333
39 HD3 PRO 6 HD1 PRO 6 6.482 -2.699 -3.308
40 H TYR 7 H TYR 7 8.092 0.694 -2.375
41 HA TYR 7 HA TYR 7 10.086 2.164 -0.885
42 HB2 TYR 7 HB2 TYR 7 9.458 4.052 -2.222
43 HB3 TYR 7 HB1 TYR 7 9.516 2.649 -3.283
44 HD1 TYR 7 HD2 TYR 7 7.322 5.088 -1.636
45 HD2 TYR 7 HD1 TYR 7 7.506 1.774 -4.299
46 HE1 TYR 7 HE2 TYR 7 5.023 5.557 -2.371
47 HE2 TYR 7 HE1 TYR 7 5.207 2.235 -5.041
48 HH TYR 7 HH TYR 7 3.114 3.469 -3.890
49 HA PRO 8 HA PRO 8 7.500 3.332 2.483
50 HB2 PRO 8 HB2 PRO 8 8.837 5.555 3.282
51 HB3 PRO 8 HB1 PRO 8 9.440 3.918 3.566
52 HG2 PRO 8 HG2 PRO 8 10.198 5.871 1.428
53 HG3 PRO 8 HG1 PRO 8 11.241 4.816 2.401
54 HD2 PRO 8 HD2 PRO 8 10.524 4.214 -0.140
55 HD3 PRO 8 HD1 PRO 8 10.803 2.969 1.094
56 HA PRO 9 HA PRO 9 6.354 4.324 4.009
57 HB2 PRO 9 HB2 PRO 9 3.647 4.192 4.159
58 HB3 PRO 9 HB1 PRO 9 4.568 5.612 4.667
59 HG2 PRO 9 HG2 PRO 9 3.103 5.122 2.103
60 HG3 PRO 9 HG1 PRO 9 3.151 6.586 3.102
61 HD2 PRO 9 HD2 PRO 9 4.639 6.305 0.857
62 HD3 PRO 9 HD1 PRO 9 5.191 7.247 2.256
63 H PHE 10 H PHE 10 5.806 2.181 4.527
64 HA PHE 10 HA PHE 10 5.676 0.407 2.277
65 HB2 PHE 10 HB2 PHE 10 5.608 -0.184 5.243
66 HB3 PHE 10 HB1 PHE 10 5.808 -1.384 3.971
67 HD1 PHE 10 HD2 PHE 10 7.657 0.202 2.193
68 HD2 PHE 10 HD1 PHE 10 7.632 -0.453 6.398
69 HE1 PHE 10 HE2 PHE 10 10.092 0.544 2.258
70 HE2 PHE 10 HE1 PHE 10 10.068 -0.111 6.470
71 HZ PHE 10 HZ PHE 10 11.301 0.387 4.397
72 H PHE 11 H PHE 11 3.352 2.088 3.897
73 HA PHE 11 HA PHE 11 1.312 0.008 3.479
74 HB2 PHE 11 HB2 PHE 11 -0.102 1.562 4.958
75 HB3 PHE 11 HB1 PHE 11 1.189 0.655 5.737
76 HD1 PHE 11 HD1 PHE 11 3.246 1.784 6.445
77 HD2 PHE 11 HD2 PHE 11 -0.038 3.942 4.808
78 HE1 PHE 11 HE1 PHE 11 4.188 3.880 7.325
79 HE2 PHE 11 HE2 PHE 11 0.900 6.040 5.683
80 HZ PHE 11 HZ PHE 11 3.016 6.011 6.944
81 H THR 12 H THR 12 0.203 0.223 1.663
82 HA THR 12 HA THR 12 -0.366 2.943 0.674
83 HB THR 12 HB THR 12 0.099 0.447 -0.969
84 HG1 THR 12 HG1 THR 12 1.605 2.819 -1.163
85 HG21 THR 12 HG21 THR 12 0.061 2.266 -2.834
86 HG22 THR 12 HG22 THR 12 -0.888 3.185 -1.666
87 HG23 THR 12 HG23 THR 12 -1.459 1.613 -2.226
88 H CYS 13 H CYS 13 -2.441 3.451 0.312
89 HA CYS 13 HA CYS 13 -4.426 1.274 0.403
90 HB2 CYS 13 HB2 CYS 13 -4.454 4.006 1.656
91 HB3 CYS 13 HB1 CYS 13 -5.959 3.163 1.305
92 H ASP 14 H ASP 14 -6.259 1.461 -0.918
93 HA ASP 14 HA ASP 14 -5.982 3.416 -3.106
94 HB2 ASP 14 HB2 ASP 14 -5.674 0.885 -3.574
95 HB3 ASP 14 HB1 ASP 14 -7.424 0.793 -3.391
96 HA PRO 15 HA PRO 15 -9.944 4.406 -0.957
97 HB2 PRO 15 HB2 PRO 15 -9.682 7.093 -1.252
98 HB3 PRO 15 HB1 PRO 15 -8.959 6.198 0.091
99 HG2 PRO 15 HG2 PRO 15 -7.693 7.155 -2.447
100 HG3 PRO 15 HG1 PRO 15 -7.060 7.208 -0.793
101 HD2 PRO 15 HD2 PRO 15 -6.297 5.327 -2.584
102 HD3 PRO 15 HD1 PRO 15 -6.394 5.002 -0.841
103 H ASN 16 H ASN 16 -8.537 5.375 -4.014
104 HA ASN 16 HA ASN 16 -10.796 6.574 -5.177
105 HB2 ASN 16 HB2 ASN 16 -8.695 5.002 -6.672
106 HB3 ASN 16 HB1 ASN 16 -9.665 6.345 -7.271
107 HD21 ASN 16 HD21 ASN 16 -6.696 5.801 -6.880
108 HD22 ASN 16 HD22 ASN 16 -6.119 7.227 -6.093
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -8.528 -2.947 1.472
2 HA2 GLY 1 HA2 GLY 1 -8.010 -3.047 -0.826
3 HA3 GLY 1 HA1 GLY 1 -8.553 -1.385 -0.998
4 H CYS 2 H CYS 2 -6.329 -2.415 1.500
5 HA CYS 2 HA CYS 2 -4.253 -0.766 0.229
6 HB2 CYS 2 HB2 CYS 2 -4.383 -1.630 3.121
7 HB3 CYS 2 HB1 CYS 2 -3.331 -0.406 2.417
8 H TYR 3 H TYR 3 -2.160 -1.522 0.003
9 HA TYR 3 HA TYR 3 -1.625 -4.306 0.743
10 HB2 TYR 3 HB2 TYR 3 -0.535 -4.544 -1.582
11 HB3 TYR 3 HB1 TYR 3 -2.289 -4.653 -1.478
12 HD1 TYR 3 HD2 TYR 3 -3.694 -2.777 -2.257
13 HD2 TYR 3 HD1 TYR 3 0.531 -2.751 -2.757
14 HE1 TYR 3 HE2 TYR 3 -3.908 -0.982 -3.925
15 HE2 TYR 3 HE1 TYR 3 0.329 -0.955 -4.425
16 HH TYR 3 HH TYR 3 -1.376 -0.062 -5.972
17 HA PRO 4 HA PRO 4 2.376 -2.874 1.837
18 HB2 PRO 4 HB2 PRO 4 3.913 -5.032 1.249
19 HB3 PRO 4 HB1 PRO 4 2.798 -4.991 2.621
20 HG2 PRO 4 HG2 PRO 4 2.425 -6.210 -0.089
21 HG3 PRO 4 HG1 PRO 4 1.998 -6.866 1.502
22 HD2 PRO 4 HD2 PRO 4 0.176 -5.713 -0.137
23 HD3 PRO 4 HD1 PRO 4 0.060 -5.625 1.633
24 H VAL 5 H VAL 5 4.224 -1.943 1.005
25 HA VAL 5 HA VAL 5 4.802 -2.338 -1.844
26 HB VAL 5 HB VAL 5 5.158 0.147 -2.061
27 HG11 VAL 5 HG11 VAL 5 2.371 -0.878 -1.537
28 HG12 VAL 5 HG12 VAL 5 2.742 0.643 -2.351
29 HG13 VAL 5 HG13 VAL 5 3.238 -0.888 -3.072
30 HG21 VAL 5 HG21 VAL 5 3.504 0.261 0.457
31 HG22 VAL 5 HG22 VAL 5 5.232 0.606 0.374
32 HG23 VAL 5 HG23 VAL 5 4.086 1.630 -0.491
33 HA PRO 6 HA PRO 6 9.022 -2.338 -0.633
34 HB2 PRO 6 HB2 PRO 6 10.208 -1.267 -2.828
35 HB3 PRO 6 HB1 PRO 6 9.524 -2.897 -2.804
36 HG2 PRO 6 HG2 PRO 6 8.340 -0.362 -3.869
37 HG3 PRO 6 HG1 PRO 6 8.335 -1.984 -4.583
38 HD2 PRO 6 HD2 PRO 6 6.198 -0.966 -3.269
39 HD3 PRO 6 HD1 PRO 6 6.586 -2.698 -3.262
40 H TYR 7 H TYR 7 8.122 0.709 -2.261
41 HA TYR 7 HA TYR 7 10.065 2.189 -0.708
42 HB2 TYR 7 HB2 TYR 7 9.395 4.103 -2.031
43 HB3 TYR 7 HB1 TYR 7 9.621 2.721 -3.097
44 HD1 TYR 7 HD2 TYR 7 7.179 5.024 -1.632
45 HD2 TYR 7 HD1 TYR 7 7.731 1.696 -4.224
46 HE1 TYR 7 HE2 TYR 7 4.912 5.352 -2.527
47 HE2 TYR 7 HE1 TYR 7 5.466 2.016 -5.128
48 HH TYR 7 HH TYR 7 3.238 3.131 -4.157
49 HA PRO 8 HA PRO 8 7.357 3.291 2.585
50 HB2 PRO 8 HB2 PRO 8 8.647 5.516 3.454
51 HB3 PRO 8 HB1 PRO 8 9.254 3.880 3.740
52 HG2 PRO 8 HG2 PRO 8 10.067 5.864 1.651
53 HG3 PRO 8 HG1 PRO 8 11.085 4.807 2.646
54 HD2 PRO 8 HD2 PRO 8 10.459 4.229 0.076
55 HD3 PRO 8 HD1 PRO 8 10.707 2.971 1.304
56 HA PRO 9 HA PRO 9 6.170 4.279 4.097
57 HB2 PRO 9 HB2 PRO 9 3.460 4.133 4.179
58 HB3 PRO 9 HB1 PRO 9 4.363 5.556 4.715
59 HG2 PRO 9 HG2 PRO 9 2.963 5.069 2.114
60 HG3 PRO 9 HG1 PRO 9 2.981 6.530 3.119
61 HD2 PRO 9 HD2 PRO 9 4.524 6.263 0.910
62 HD3 PRO 9 HD1 PRO 9 5.037 7.203 2.326
63 H PHE 10 H PHE 10 5.711 2.125 4.565
64 HA PHE 10 HA PHE 10 5.628 0.361 2.320
65 HB2 PHE 10 HB2 PHE 10 5.447 -0.241 5.281
66 HB3 PHE 10 HB1 PHE 10 5.707 -1.435 4.013
67 HD1 PHE 10 HD1 PHE 10 7.612 0.175 2.315
68 HD2 PHE 10 HD2 PHE 10 7.428 -0.507 6.513
69 HE1 PHE 10 HE1 PHE 10 10.041 0.532 2.477
70 HE2 PHE 10 HE2 PHE 10 9.856 -0.150 6.681
71 HZ PHE 10 HZ PHE 10 11.166 0.371 4.662
72 H PHE 11 H PHE 11 3.237 1.982 3.968
73 HA PHE 11 HA PHE 11 1.226 -0.081 3.363
74 HB2 PHE 11 HB2 PHE 11 -0.238 1.361 4.907
75 HB3 PHE 11 HB1 PHE 11 1.041 0.411 5.656
76 HD1 PHE 11 HD2 PHE 11 3.072 1.502 6.489
77 HD2 PHE 11 HD1 PHE 11 -0.188 3.744 4.923
78 HE1 PHE 11 HE2 PHE 11 3.977 3.538 7.533
79 HE2 PHE 11 HE1 PHE 11 0.711 5.785 5.963
80 HZ PHE 11 HZ PHE 11 2.795 5.683 7.271
81 H THR 12 H THR 12 0.162 0.251 1.537
82 HA THR 12 HA THR 12 -0.449 3.025 0.747
83 HB THR 12 HB THR 12 -0.445 2.097 -1.643
84 HG1 THR 12 HG1 THR 12 -0.133 -0.154 -0.566
85 HG21 THR 12 HG21 THR 12 2.192 2.217 -0.175
86 HG22 THR 12 HG22 THR 12 1.278 3.617 -0.734
87 HG23 THR 12 HG23 THR 12 1.939 2.473 -1.901
88 H CYS 13 H CYS 13 -2.481 3.445 -0.056
89 HA CYS 13 HA CYS 13 -4.381 1.197 -0.117
90 HB2 CYS 13 HB2 CYS 13 -4.867 3.919 1.113
91 HB3 CYS 13 HB1 CYS 13 -6.073 2.648 0.942
92 H ASP 14 H ASP 14 -6.345 1.641 -1.355
93 HA ASP 14 HA ASP 14 -5.710 2.980 -3.820
94 HB2 ASP 14 HB2 ASP 14 -7.919 1.243 -2.830
95 HB3 ASP 14 HB1 ASP 14 -8.254 2.286 -4.210
96 HA PRO 15 HA PRO 15 -7.682 6.851 -3.230
97 HB2 PRO 15 HB2 PRO 15 -8.878 7.276 -5.630
98 HB3 PRO 15 HB1 PRO 15 -7.127 7.360 -5.401
99 HG2 PRO 15 HG2 PRO 15 -8.789 5.121 -6.489
100 HG3 PRO 15 HG1 PRO 15 -7.239 5.751 -7.076
101 HD2 PRO 15 HD2 PRO 15 -7.425 3.503 -5.579
102 HD3 PRO 15 HD1 PRO 15 -6.026 4.593 -5.494
103 H ASN 16 H ASN 16 -9.820 4.500 -4.841
104 HA ASN 16 HA ASN 16 -12.257 5.706 -4.272
105 HB2 ASN 16 HB2 ASN 16 -11.824 2.718 -4.292
106 HB3 ASN 16 HB1 ASN 16 -13.276 3.603 -4.752
107 HD21 ASN 16 HD21 ASN 16 -10.873 1.867 -5.979
108 HD22 ASN 16 HD22 ASN 16 -10.710 2.594 -7.537
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -9.685 -1.794 0.637
2 HA2 GLY 1 HA2 GLY 1 -7.969 -3.375 -0.755
3 HA3 GLY 1 HA1 GLY 1 -8.498 -1.806 -1.345
4 H CYS 2 H CYS 2 -6.386 -2.602 1.394
5 HA CYS 2 HA CYS 2 -4.319 -0.909 0.162
6 HB2 CYS 2 HB2 CYS 2 -4.485 -1.742 3.060
7 HB3 CYS 2 HB1 CYS 2 -3.485 -0.472 2.362
8 H TYR 3 H TYR 3 -2.226 -1.625 -0.054
9 HA TYR 3 HA TYR 3 -1.608 -4.362 0.787
10 HB2 TYR 3 HB2 TYR 3 -0.510 -4.666 -1.519
11 HB3 TYR 3 HB1 TYR 3 -2.263 -4.794 -1.428
12 HD1 TYR 3 HD1 TYR 3 -3.688 -2.989 -2.311
13 HD2 TYR 3 HD2 TYR 3 0.545 -2.882 -2.728
14 HE1 TYR 3 HE1 TYR 3 -3.909 -1.257 -4.041
15 HE2 TYR 3 HE2 TYR 3 0.335 -1.148 -4.461
16 HH TYR 3 HH TYR 3 -1.327 0.598 -5.126
17 HA PRO 4 HA PRO 4 2.340 -2.765 1.843
18 HB2 PRO 4 HB2 PRO 4 3.945 -4.899 1.347
19 HB3 PRO 4 HB1 PRO 4 2.821 -4.838 2.711
20 HG2 PRO 4 HG2 PRO 4 2.500 -6.173 0.051
21 HG3 PRO 4 HG1 PRO 4 2.083 -6.779 1.664
22 HD2 PRO 4 HD2 PRO 4 0.237 -5.746 -0.026
23 HD3 PRO 4 HD1 PRO 4 0.109 -5.591 1.738
24 H VAL 5 H VAL 5 4.202 -1.856 0.991
25 HA VAL 5 HA VAL 5 4.772 -2.316 -1.850
26 HB VAL 5 HB VAL 5 5.110 0.164 -2.130
27 HG11 VAL 5 HG11 VAL 5 3.004 -1.296 -2.714
28 HG12 VAL 5 HG12 VAL 5 2.239 -0.294 -1.478
29 HG13 VAL 5 HG13 VAL 5 2.969 0.458 -2.897
30 HG21 VAL 5 HG21 VAL 5 3.481 0.320 0.405
31 HG22 VAL 5 HG22 VAL 5 5.199 0.698 0.281
32 HG23 VAL 5 HG23 VAL 5 4.017 1.674 -0.590
33 HA PRO 6 HA PRO 6 8.996 -2.261 -0.656
34 HB2 PRO 6 HB2 PRO 6 10.165 -1.241 -2.884
35 HB3 PRO 6 HB1 PRO 6 9.492 -2.874 -2.815
36 HG2 PRO 6 HG2 PRO 6 8.288 -0.375 -3.940
37 HG3 PRO 6 HG1 PRO 6 8.290 -2.016 -4.612
38 HD2 PRO 6 HD2 PRO 6 6.153 -0.976 -3.314
39 HD3 PRO 6 HD1 PRO 6 6.552 -2.705 -3.265
40 H TYR 7 H TYR 7 8.074 0.736 -2.363
41 HA TYR 7 HA TYR 7 10.020 2.272 -0.874
42 HB2 TYR 7 HB2 TYR 7 9.263 4.160 -2.213
43 HB3 TYR 7 HB1 TYR 7 9.554 2.768 -3.248
44 HD1 TYR 7 HD2 TYR 7 6.997 4.973 -1.821
45 HD2 TYR 7 HD1 TYR 7 7.726 1.654 -4.382
46 HE1 TYR 7 HE2 TYR 7 4.722 5.184 -2.733
47 HE2 TYR 7 HE1 TYR 7 5.454 1.856 -5.301
48 HH TYR 7 HH TYR 7 3.330 4.520 -4.380
49 HA PRO 8 HA PRO 8 7.371 3.425 2.450
50 HB2 PRO 8 HB2 PRO 8 8.648 5.689 3.232
51 HB3 PRO 8 HB1 PRO 8 9.284 4.071 3.546
52 HG2 PRO 8 HG2 PRO 8 10.022 6.011 1.389
53 HG3 PRO 8 HG1 PRO 8 11.076 4.994 2.387
54 HD2 PRO 8 HD2 PRO 8 10.401 4.341 -0.153
55 HD3 PRO 8 HD1 PRO 8 10.696 3.119 1.100
56 HA PRO 9 HA PRO 9 6.189 4.416 3.951
57 HB2 PRO 9 HB2 PRO 9 3.484 4.225 4.079
58 HB3 PRO 9 HB1 PRO 9 4.369 5.673 4.573
59 HG2 PRO 9 HG2 PRO 9 2.938 5.113 2.004
60 HG3 PRO 9 HG1 PRO 9 2.945 6.592 2.981
61 HD2 PRO 9 HD2 PRO 9 4.460 6.309 0.754
62 HD3 PRO 9 HD1 PRO 9 4.977 7.285 2.143
63 H PHE 10 H PHE 10 5.696 2.269 4.494
64 HA PHE 10 HA PHE 10 5.624 0.458 2.272
65 HB2 PHE 10 HB2 PHE 10 5.535 -0.088 5.247
66 HB3 PHE 10 HB1 PHE 10 5.777 -1.303 3.996
67 HD1 PHE 10 HD2 PHE 10 7.609 0.294 2.213
68 HD2 PHE 10 HD1 PHE 10 7.553 -0.293 6.428
69 HE1 PHE 10 HE2 PHE 10 10.036 0.690 2.296
70 HE2 PHE 10 HE1 PHE 10 9.980 0.102 6.519
71 HZ PHE 10 HZ PHE 10 11.225 0.593 4.452
72 H PHE 11 H PHE 11 3.245 2.107 3.855
73 HA PHE 11 HA PHE 11 1.257 -0.022 3.433
74 HB2 PHE 11 HB2 PHE 11 -0.206 1.511 4.887
75 HB3 PHE 11 HB1 PHE 11 1.098 0.638 5.686
76 HD1 PHE 11 HD2 PHE 11 3.123 1.818 6.404
77 HD2 PHE 11 HD1 PHE 11 -0.193 3.889 4.721
78 HE1 PHE 11 HE2 PHE 11 4.009 3.940 7.278
79 HE2 PHE 11 HE1 PHE 11 0.690 6.015 5.591
80 HZ PHE 11 HZ PHE 11 2.792 6.042 6.872
81 H THR 12 H THR 12 0.160 0.157 1.605
82 HA THR 12 HA THR 12 -0.466 2.855 0.595
83 HB THR 12 HB THR 12 0.084 0.366 -1.033
84 HG1 THR 12 HG1 THR 12 1.523 2.820 -0.809
85 HG21 THR 12 HG21 THR 12 -0.939 3.087 -1.758
86 HG22 THR 12 HG22 THR 12 -1.497 1.504 -2.300
87 HG23 THR 12 HG23 THR 12 0.021 2.161 -2.910
88 H CYS 13 H CYS 13 -2.549 3.307 0.211
89 HA CYS 13 HA CYS 13 -4.476 1.078 0.307
90 HB2 CYS 13 HB2 CYS 13 -4.611 3.847 1.476
91 HB3 CYS 13 HB1 CYS 13 -6.075 2.927 1.150
92 H ASP 14 H ASP 14 -6.612 1.660 -0.738
93 HA ASP 14 HA ASP 14 -6.114 3.192 -3.207
94 HB2 ASP 14 HB2 ASP 14 -6.299 0.849 -3.744
95 HB3 ASP 14 HB1 ASP 14 -7.773 0.699 -2.793
96 HA PRO 15 HA PRO 15 -9.540 5.320 -0.964
97 HB2 PRO 15 HB2 PRO 15 -8.727 7.818 -1.651
98 HB3 PRO 15 HB1 PRO 15 -8.092 6.952 -0.245
99 HG2 PRO 15 HG2 PRO 15 -6.897 7.275 -2.972
100 HG3 PRO 15 HG1 PRO 15 -6.112 7.385 -1.386
101 HD2 PRO 15 HD2 PRO 15 -5.953 5.173 -2.940
102 HD3 PRO 15 HD1 PRO 15 -5.951 5.096 -1.166
103 H ASN 16 H ASN 16 -8.327 5.347 -4.212
104 HA ASN 16 HA ASN 16 -10.440 6.907 -5.345
105 HB2 ASN 16 HB2 ASN 16 -8.765 4.936 -6.883
106 HB3 ASN 16 HB1 ASN 16 -9.459 6.458 -7.435
107 HD21 ASN 16 HD21 ASN 16 -8.693 8.212 -5.534
108 HD22 ASN 16 HD22 ASN 16 -6.971 8.339 -5.489
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -9.738 -1.399 -0.830
2 HA2 GLY 1 HA2 GLY 1 -7.940 -3.292 -0.332
3 HA3 GLY 1 HA1 GLY 1 -7.940 -2.455 -1.877
4 H CYS 2 H CYS 2 -6.310 -2.926 1.118
5 HA CYS 2 HA CYS 2 -4.205 -1.049 0.261
6 HB2 CYS 2 HB2 CYS 2 -4.846 -1.962 3.074
7 HB3 CYS 2 HB1 CYS 2 -3.576 -0.831 2.620
8 H TYR 3 H TYR 3 -2.176 -1.802 0.006
9 HA TYR 3 HA TYR 3 -1.517 -4.480 0.994
10 HB2 TYR 3 HB2 TYR 3 -0.393 -4.880 -1.287
11 HB3 TYR 3 HB1 TYR 3 -2.143 -5.042 -1.198
12 HD1 TYR 3 HD1 TYR 3 0.629 -2.989 -2.448
13 HD2 TYR 3 HD2 TYR 3 -3.597 -3.465 -2.315
14 HE1 TYR 3 HE1 TYR 3 0.394 -1.354 -4.270
15 HE2 TYR 3 HE2 TYR 3 -3.843 -1.832 -4.138
16 HH TYR 3 HH TYR 3 -1.260 -0.795 -6.039
17 HA PRO 4 HA PRO 4 2.393 -2.759 1.992
18 HB2 PRO 4 HB2 PRO 4 4.042 -4.883 1.616
19 HB3 PRO 4 HB1 PRO 4 2.908 -4.775 2.968
20 HG2 PRO 4 HG2 PRO 4 2.631 -6.248 0.376
21 HG3 PRO 4 HG1 PRO 4 2.212 -6.779 2.016
22 HD2 PRO 4 HD2 PRO 4 0.360 -5.869 0.263
23 HD3 PRO 4 HD1 PRO 4 0.216 -5.628 2.016
24 H VAL 5 H VAL 5 4.251 -1.864 1.109
25 HA VAL 5 HA VAL 5 4.846 -2.454 -1.703
26 HB VAL 5 HB VAL 5 5.145 0.015 -2.103
27 HG11 VAL 5 HG11 VAL 5 2.941 0.309 -2.801
28 HG12 VAL 5 HG12 VAL 5 3.122 -1.445 -2.740
29 HG13 VAL 5 HG13 VAL 5 2.288 -0.598 -1.437
30 HG21 VAL 5 HG21 VAL 5 3.543 0.233 0.444
31 HG22 VAL 5 HG22 VAL 5 5.225 0.722 0.238
32 HG23 VAL 5 HG23 VAL 5 3.948 1.563 -0.641
33 HA PRO 6 HA PRO 6 9.061 -2.267 -0.490
34 HB2 PRO 6 HB2 PRO 6 10.228 -1.333 -2.757
35 HB3 PRO 6 HB1 PRO 6 9.582 -2.973 -2.613
36 HG2 PRO 6 HG2 PRO 6 8.343 -0.552 -3.864
37 HG3 PRO 6 HG1 PRO 6 8.378 -2.223 -4.456
38 HD2 PRO 6 HD2 PRO 6 6.215 -1.159 -3.223
39 HD3 PRO 6 HD1 PRO 6 6.642 -2.877 -3.088
40 H TYR 7 H TYR 7 8.094 0.629 -2.339
41 HA TYR 7 HA TYR 7 10.007 2.268 -0.922
42 HB2 TYR 7 HB2 TYR 7 9.223 4.076 -2.348
43 HB3 TYR 7 HB1 TYR 7 9.523 2.641 -3.320
44 HD1 TYR 7 HD1 TYR 7 6.902 4.788 -1.867
45 HD2 TYR 7 HD2 TYR 7 7.748 1.552 -4.495
46 HE1 TYR 7 HE1 TYR 7 4.620 4.935 -2.771
47 HE2 TYR 7 HE2 TYR 7 5.468 1.689 -5.407
48 HH TYR 7 HH TYR 7 3.615 3.035 -5.540
49 HA PRO 8 HA PRO 8 7.338 3.524 2.349
50 HB2 PRO 8 HB2 PRO 8 8.571 5.848 3.021
51 HB3 PRO 8 HB1 PRO 8 9.239 4.259 3.409
52 HG2 PRO 8 HG2 PRO 8 9.936 6.111 1.163
53 HG3 PRO 8 HG1 PRO 8 11.012 5.162 2.205
54 HD2 PRO 8 HD2 PRO 8 10.347 4.379 -0.300
55 HD3 PRO 8 HD1 PRO 8 10.668 3.223 1.009
56 HA PRO 9 HA PRO 9 6.132 4.552 3.800
57 HB2 PRO 9 HB2 PRO 9 3.431 4.309 3.932
58 HB3 PRO 9 HB1 PRO 9 4.283 5.796 4.364
59 HG2 PRO 9 HG2 PRO 9 2.871 5.092 1.820
60 HG3 PRO 9 HG1 PRO 9 2.844 6.613 2.730
61 HD2 PRO 9 HD2 PRO 9 4.369 6.266 0.520
62 HD3 PRO 9 HD1 PRO 9 4.863 7.313 1.865
63 H PHE 10 H PHE 10 5.672 2.421 4.439
64 HA PHE 10 HA PHE 10 5.641 0.514 2.294
65 HB2 PHE 10 HB2 PHE 10 5.577 0.094 5.290
66 HB3 PHE 10 HB1 PHE 10 5.845 -1.166 4.090
67 HD1 PHE 10 HD1 PHE 10 7.632 0.394 2.234
68 HD2 PHE 10 HD2 PHE 10 7.602 -0.009 6.471
69 HE1 PHE 10 HE1 PHE 10 10.049 0.852 2.291
70 HE2 PHE 10 HE2 PHE 10 10.018 0.450 6.535
71 HZ PHE 10 HZ PHE 10 11.244 0.883 4.444
72 H PHE 11 H PHE 11 3.233 2.179 3.808
73 HA PHE 11 HA PHE 11 1.290 -0.010 3.486
74 HB2 PHE 11 HB2 PHE 11 -0.198 1.540 4.894
75 HB3 PHE 11 HB1 PHE 11 1.132 0.727 5.715
76 HD1 PHE 11 HD1 PHE 11 3.136 1.979 6.370
77 HD2 PHE 11 HD2 PHE 11 -0.245 3.909 4.650
78 HE1 PHE 11 HE1 PHE 11 3.978 4.152 7.161
79 HE2 PHE 11 HE2 PHE 11 0.591 6.085 5.437
80 HZ PHE 11 HZ PHE 11 2.706 6.208 6.693
81 H THR 12 H THR 12 0.180 0.080 1.660
82 HA THR 12 HA THR 12 -0.418 2.721 0.498
83 HB THR 12 HB THR 12 -0.096 0.072 -0.925
84 HG1 THR 12 HG1 THR 12 1.788 1.494 -0.138
85 HG21 THR 12 HG21 THR 12 -1.676 1.164 -2.223
86 HG22 THR 12 HG22 THR 12 -0.166 1.718 -2.948
87 HG23 THR 12 HG23 THR 12 -1.044 2.762 -1.830
88 H CYS 13 H CYS 13 -2.482 3.148 -0.240
89 HA CYS 13 HA CYS 13 -4.527 1.082 0.126
90 HB2 CYS 13 HB2 CYS 13 -4.459 3.774 1.471
91 HB3 CYS 13 HB1 CYS 13 -5.979 2.935 1.181
92 H ASP 14 H ASP 14 -6.494 1.488 -1.015
93 HA ASP 14 HA ASP 14 -6.146 3.377 -3.248
94 HB2 ASP 14 HB2 ASP 14 -6.225 0.910 -3.790
95 HB3 ASP 14 HB1 ASP 14 -7.897 0.915 -3.232
96 HA PRO 15 HA PRO 15 -9.686 5.023 -0.789
97 HB2 PRO 15 HB2 PRO 15 -9.034 7.628 -1.190
98 HB3 PRO 15 HB1 PRO 15 -8.339 6.653 0.110
99 HG2 PRO 15 HG2 PRO 15 -7.180 7.351 -2.561
100 HG3 PRO 15 HG1 PRO 15 -6.395 7.334 -0.971
101 HD2 PRO 15 HD2 PRO 15 -6.106 5.323 -2.762
102 HD3 PRO 15 HD1 PRO 15 -6.092 5.048 -1.008
103 H ASN 16 H ASN 16 -8.429 5.728 -3.984
104 HA ASN 16 HA ASN 16 -10.794 7.082 -4.889
105 HB2 ASN 16 HB2 ASN 16 -8.583 7.561 -5.865
106 HB3 ASN 16 HB1 ASN 16 -8.499 5.910 -6.477
107 HD21 ASN 16 HD21 ASN 16 -10.668 8.717 -6.534
108 HD22 ASN 16 HD22 ASN 16 -11.110 8.555 -8.197
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -9.417 -3.095 -0.290
2 HA2 GLY 1 HA2 GLY 1 -7.582 -3.220 -1.760
3 HA3 GLY 1 HA1 GLY 1 -8.204 -1.607 -2.076
4 H CYS 2 H CYS 2 -6.235 -3.099 0.500
5 HA CYS 2 HA CYS 2 -4.169 -1.078 -0.031
6 HB2 CYS 2 HB2 CYS 2 -5.669 -0.556 1.989
7 HB3 CYS 2 HB1 CYS 2 -4.888 -1.929 2.768
8 H TYR 3 H TYR 3 -2.167 -1.877 -0.167
9 HA TYR 3 HA TYR 3 -1.557 -4.449 1.094
10 HB2 TYR 3 HB2 TYR 3 -0.304 -5.045 -1.073
11 HB3 TYR 3 HB1 TYR 3 -2.057 -5.210 -1.070
12 HD1 TYR 3 HD2 TYR 3 0.769 -3.200 -2.297
13 HD2 TYR 3 HD1 TYR 3 -3.439 -3.812 -2.451
14 HE1 TYR 3 HE2 TYR 3 0.634 -1.736 -4.269
15 HE2 TYR 3 HE1 TYR 3 -3.585 -2.351 -4.425
16 HH TYR 3 HH TYR 3 -1.432 -1.661 -6.364
17 HA PRO 4 HA PRO 4 2.286 -2.613 2.151
18 HB2 PRO 4 HB2 PRO 4 3.959 -4.750 2.063
19 HB3 PRO 4 HB1 PRO 4 2.750 -4.529 3.333
20 HG2 PRO 4 HG2 PRO 4 2.624 -6.233 0.875
21 HG3 PRO 4 HG1 PRO 4 2.116 -6.617 2.529
22 HD2 PRO 4 HD2 PRO 4 0.364 -5.884 0.600
23 HD3 PRO 4 HD1 PRO 4 0.119 -5.486 2.313
24 H VAL 5 H VAL 5 4.208 -1.809 1.305
25 HA VAL 5 HA VAL 5 4.945 -2.631 -1.413
26 HB VAL 5 HB VAL 5 5.288 -0.206 -1.997
27 HG11 VAL 5 HG11 VAL 5 2.387 -0.613 -1.455
28 HG12 VAL 5 HG12 VAL 5 3.192 -0.037 -2.916
29 HG13 VAL 5 HG13 VAL 5 3.227 -1.752 -2.506
30 HG21 VAL 5 HG21 VAL 5 4.023 1.461 -0.730
31 HG22 VAL 5 HG22 VAL 5 3.568 0.228 0.444
32 HG23 VAL 5 HG23 VAL 5 5.258 0.698 0.271
33 HA PRO 6 HA PRO 6 9.092 -2.371 0.003
34 HB2 PRO 6 HB2 PRO 6 10.385 -1.635 -2.268
35 HB3 PRO 6 HB1 PRO 6 9.715 -3.253 -2.025
36 HG2 PRO 6 HG2 PRO 6 8.569 -0.937 -3.534
37 HG3 PRO 6 HG1 PRO 6 8.617 -2.651 -3.984
38 HD2 PRO 6 HD2 PRO 6 6.404 -1.476 -2.959
39 HD3 PRO 6 HD1 PRO 6 6.806 -3.179 -2.660
40 H TYR 7 H TYR 7 8.256 0.368 -2.128
41 HA TYR 7 HA TYR 7 10.113 2.108 -0.766
42 HB2 TYR 7 HB2 TYR 7 9.414 3.795 -2.363
43 HB3 TYR 7 HB1 TYR 7 9.712 2.280 -3.208
44 HD1 TYR 7 HD2 TYR 7 7.865 1.005 -4.166
45 HD2 TYR 7 HD1 TYR 7 7.182 4.713 -2.197
46 HE1 TYR 7 HE2 TYR 7 5.617 1.109 -5.156
47 HE2 TYR 7 HE1 TYR 7 4.930 4.828 -3.181
48 HH TYR 7 HH TYR 7 3.940 2.910 -5.731
49 HA PRO 8 HA PRO 8 7.321 3.614 2.292
50 HB2 PRO 8 HB2 PRO 8 8.566 5.960 2.860
51 HB3 PRO 8 HB1 PRO 8 9.186 4.390 3.386
52 HG2 PRO 8 HG2 PRO 8 10.019 6.071 1.053
53 HG3 PRO 8 HG1 PRO 8 11.029 5.180 2.207
54 HD2 PRO 8 HD2 PRO 8 10.463 4.235 -0.266
55 HD3 PRO 8 HD1 PRO 8 10.702 3.168 1.132
56 HA PRO 9 HA PRO 9 6.052 4.735 3.600
57 HB2 PRO 9 HB2 PRO 9 3.344 4.531 3.599
58 HB3 PRO 9 HB1 PRO 9 4.194 6.031 3.985
59 HG2 PRO 9 HG2 PRO 9 2.911 5.189 1.415
60 HG3 PRO 9 HG1 PRO 9 2.857 6.763 2.230
61 HD2 PRO 9 HD2 PRO 9 4.494 6.263 0.131
62 HD3 PRO 9 HD1 PRO 9 4.929 7.386 1.436
63 H PHE 10 H PHE 10 5.509 2.654 4.345
64 HA PHE 10 HA PHE 10 5.583 0.617 2.327
65 HB2 PHE 10 HB2 PHE 10 5.314 0.386 5.331
66 HB3 PHE 10 HB1 PHE 10 5.638 -0.950 4.232
67 HD1 PHE 10 HD2 PHE 10 7.570 0.478 2.407
68 HD2 PHE 10 HD1 PHE 10 7.256 0.321 6.649
69 HE1 PHE 10 HE2 PHE 10 9.985 0.908 2.599
70 HE2 PHE 10 HE1 PHE 10 9.671 0.751 6.847
71 HZ PHE 10 HZ PHE 10 11.039 1.044 4.821
72 H PHE 11 H PHE 11 3.110 2.408 3.565
73 HA PHE 11 HA PHE 11 1.155 0.228 3.259
74 HB2 PHE 11 HB2 PHE 11 -0.396 1.893 4.452
75 HB3 PHE 11 HB1 PHE 11 0.859 1.122 5.416
76 HD1 PHE 11 HD2 PHE 11 2.837 2.390 6.119
77 HD2 PHE 11 HD1 PHE 11 -0.382 4.240 4.038
78 HE1 PHE 11 HE2 PHE 11 3.664 4.603 6.813
79 HE2 PHE 11 HE1 PHE 11 0.440 6.454 4.726
80 HZ PHE 11 HZ PHE 11 2.464 6.638 6.117
81 H THR 12 H THR 12 0.172 0.202 1.360
82 HA THR 12 HA THR 12 -0.408 2.775 0.038
83 HB THR 12 HB THR 12 0.248 0.146 -1.308
84 HG1 THR 12 HG1 THR 12 1.709 2.595 -1.245
85 HG21 THR 12 HG21 THR 12 -1.010 2.606 -2.252
86 HG22 THR 12 HG22 THR 12 -0.933 1.013 -3.006
87 HG23 THR 12 HG23 THR 12 0.407 2.143 -3.192
88 H CYS 13 H CYS 13 -2.518 3.152 0.209
89 HA CYS 13 HA CYS 13 -4.377 0.900 -0.191
90 HB2 CYS 13 HB2 CYS 13 -5.000 3.426 1.339
91 HB3 CYS 13 HB1 CYS 13 -5.930 1.930 1.299
92 H ASP 14 H ASP 14 -6.427 1.436 -1.213
93 HA ASP 14 HA ASP 14 -6.159 3.686 -3.099
94 HB2 ASP 14 HB2 ASP 14 -6.125 1.173 -3.899
95 HB3 ASP 14 HB1 ASP 14 -7.871 1.314 -3.719
96 HA PRO 15 HA PRO 15 -9.873 4.564 -0.503
97 HB2 PRO 15 HB2 PRO 15 -9.436 7.241 -0.402
98 HB3 PRO 15 HB1 PRO 15 -8.685 6.102 0.722
99 HG2 PRO 15 HG2 PRO 15 -7.540 7.371 -1.735
100 HG3 PRO 15 HG1 PRO 15 -6.786 7.123 -0.150
101 HD2 PRO 15 HD2 PRO 15 -6.294 5.506 -2.265
102 HD3 PRO 15 HD1 PRO 15 -6.289 4.916 -0.591
103 H ASN 16 H ASN 16 -8.608 6.047 -3.434
104 HA ASN 16 HA ASN 16 -11.255 7.031 -4.169
105 HB2 ASN 16 HB2 ASN 16 -9.070 8.352 -4.488
106 HB3 ASN 16 HB1 ASN 16 -8.760 7.269 -5.841
107 HD21 ASN 16 HD21 ASN 16 -9.101 8.399 -7.616
108 HD22 ASN 16 HD22 ASN 16 -10.499 9.358 -7.951
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -9.184 -1.616 -0.298
2 HA2 GLY 1 HA2 GLY 1 -7.484 -3.351 -1.889
3 HA3 GLY 1 HA1 GLY 1 -8.000 -1.724 -2.306
4 H CYS 2 H CYS 2 -6.430 -2.713 0.693
5 HA CYS 2 HA CYS 2 -4.175 -0.957 -0.014
6 HB2 CYS 2 HB2 CYS 2 -5.666 -0.415 2.007
7 HB3 CYS 2 HB1 CYS 2 -4.905 -1.799 2.784
8 H TYR 3 H TYR 3 -2.185 -1.785 -0.152
9 HA TYR 3 HA TYR 3 -1.613 -4.368 1.107
10 HB2 TYR 3 HB2 TYR 3 -0.370 -4.980 -1.061
11 HB3 TYR 3 HB1 TYR 3 -2.125 -5.120 -1.059
12 HD1 TYR 3 HD2 TYR 3 0.738 -3.204 -2.323
13 HD2 TYR 3 HD1 TYR 3 -3.493 -3.645 -2.397
14 HE1 TYR 3 HE2 TYR 3 0.626 -1.737 -4.293
15 HE2 TYR 3 HE1 TYR 3 -3.617 -2.180 -4.370
16 HH TYR 3 HH TYR 3 -1.223 -0.183 -5.329
17 HA PRO 4 HA PRO 4 2.257 -2.591 2.165
18 HB2 PRO 4 HB2 PRO 4 3.897 -4.752 2.074
19 HB3 PRO 4 HB1 PRO 4 2.692 -4.514 3.345
20 HG2 PRO 4 HG2 PRO 4 2.541 -6.214 0.885
21 HG3 PRO 4 HG1 PRO 4 2.027 -6.592 2.540
22 HD2 PRO 4 HD2 PRO 4 0.285 -5.831 0.611
23 HD3 PRO 4 HD1 PRO 4 0.048 -5.430 2.324
24 H VAL 5 H VAL 5 4.191 -1.814 1.319
25 HA VAL 5 HA VAL 5 4.913 -2.646 -1.400
26 HB VAL 5 HB VAL 5 5.294 -0.224 -1.982
27 HG11 VAL 5 HG11 VAL 5 3.222 -1.731 -2.514
28 HG12 VAL 5 HG12 VAL 5 2.387 -0.612 -1.434
29 HG13 VAL 5 HG13 VAL 5 3.189 -0.007 -2.885
30 HG21 VAL 5 HG21 VAL 5 3.625 0.205 0.494
31 HG22 VAL 5 HG22 VAL 5 5.293 0.720 0.246
32 HG23 VAL 5 HG23 VAL 5 3.996 1.445 -0.705
33 HA PRO 6 HA PRO 6 9.065 -2.448 0.015
34 HB2 PRO 6 HB2 PRO 6 10.368 -1.730 -2.255
35 HB3 PRO 6 HB1 PRO 6 9.675 -3.338 -2.013
36 HG2 PRO 6 HG2 PRO 6 8.563 -1.003 -3.520
37 HG3 PRO 6 HG1 PRO 6 8.585 -2.717 -3.972
38 HD2 PRO 6 HD2 PRO 6 6.390 -1.510 -2.945
39 HD3 PRO 6 HD1 PRO 6 6.767 -3.219 -2.648
40 H TYR 7 H TYR 7 8.269 0.305 -2.113
41 HA TYR 7 HA TYR 7 10.154 2.016 -0.748
42 HB2 TYR 7 HB2 TYR 7 9.438 3.728 -2.336
43 HB3 TYR 7 HB1 TYR 7 9.790 2.222 -3.177
44 HD1 TYR 7 HD2 TYR 7 7.115 4.496 -2.077
45 HD2 TYR 7 HD1 TYR 7 8.060 1.005 -4.317
46 HE1 TYR 7 HE2 TYR 7 4.882 4.560 -3.108
47 HE2 TYR 7 HE1 TYR 7 5.831 1.059 -5.355
48 HH TYR 7 HH TYR 7 3.351 3.250 -4.265
49 HA PRO 8 HA PRO 8 7.384 3.561 2.310
50 HB2 PRO 8 HB2 PRO 8 8.663 5.886 2.881
51 HB3 PRO 8 HB1 PRO 8 9.261 4.308 3.406
52 HG2 PRO 8 HG2 PRO 8 10.118 5.977 1.074
53 HG3 PRO 8 HG1 PRO 8 11.114 5.071 2.228
54 HD2 PRO 8 HD2 PRO 8 10.535 4.137 -0.247
55 HD3 PRO 8 HD1 PRO 8 10.758 3.065 1.150
56 HA PRO 9 HA PRO 9 6.132 4.699 3.620
57 HB2 PRO 9 HB2 PRO 9 3.421 4.535 3.619
58 HB3 PRO 9 HB1 PRO 9 4.293 6.023 4.006
59 HG2 PRO 9 HG2 PRO 9 2.998 5.203 1.435
60 HG3 PRO 9 HG1 PRO 9 2.967 6.776 2.251
61 HD2 PRO 9 HD2 PRO 9 4.597 6.254 0.152
62 HD3 PRO 9 HD1 PRO 9 5.049 7.369 1.458
63 H PHE 10 H PHE 10 5.559 2.626 4.363
64 HA PHE 10 HA PHE 10 5.601 0.590 2.342
65 HB2 PHE 10 HB2 PHE 10 5.329 0.361 5.347
66 HB3 PHE 10 HB1 PHE 10 5.633 -0.980 4.246
67 HD1 PHE 10 HD2 PHE 10 7.587 0.421 2.423
68 HD2 PHE 10 HD1 PHE 10 7.270 0.265 6.665
69 HE1 PHE 10 HE2 PHE 10 10.007 0.815 2.615
70 HE2 PHE 10 HE1 PHE 10 9.691 0.659 6.864
71 HZ PHE 10 HZ PHE 10 11.063 0.933 4.837
72 H PHE 11 H PHE 11 3.156 2.416 3.583
73 HA PHE 11 HA PHE 11 1.168 0.266 3.277
74 HB2 PHE 11 HB2 PHE 11 -0.358 1.955 4.470
75 HB3 PHE 11 HB1 PHE 11 0.885 1.164 5.432
76 HD1 PHE 11 HD2 PHE 11 2.882 2.401 6.138
77 HD2 PHE 11 HD1 PHE 11 -0.308 4.301 4.057
78 HE1 PHE 11 HE2 PHE 11 3.742 4.599 6.833
79 HE2 PHE 11 HE1 PHE 11 0.548 6.502 4.747
80 HZ PHE 11 HZ PHE 11 2.574 6.653 6.139
81 H THR 12 H THR 12 0.184 0.258 1.377
82 HA THR 12 HA THR 12 -0.357 2.838 0.057
83 HB THR 12 HB THR 12 0.285 0.201 -1.276
84 HG1 THR 12 HG1 THR 12 2.030 1.766 -2.099
85 HG21 THR 12 HG21 THR 12 0.315 1.688 -3.347
86 HG22 THR 12 HG22 THR 12 -0.558 2.872 -2.374
87 HG23 THR 12 HG23 THR 12 -1.268 1.287 -2.681
88 H CYS 13 H CYS 13 -2.461 3.248 0.228
89 HA CYS 13 HA CYS 13 -4.353 1.024 -0.173
90 HB2 CYS 13 HB2 CYS 13 -4.940 3.558 1.358
91 HB3 CYS 13 HB1 CYS 13 -5.890 2.076 1.319
92 H ASP 14 H ASP 14 -6.333 1.522 -1.275
93 HA ASP 14 HA ASP 14 -6.105 3.854 -3.063
94 HB2 ASP 14 HB2 ASP 14 -5.781 1.549 -4.106
95 HB3 ASP 14 HB1 ASP 14 -7.488 1.269 -3.774
96 HA PRO 15 HA PRO 15 -9.986 4.366 -0.622
97 HB2 PRO 15 HB2 PRO 15 -9.733 7.058 -0.376
98 HB3 PRO 15 HB1 PRO 15 -8.963 5.916 0.731
99 HG2 PRO 15 HG2 PRO 15 -7.787 7.373 -1.604
100 HG3 PRO 15 HG1 PRO 15 -7.095 7.095 0.004
101 HD2 PRO 15 HD2 PRO 15 -6.398 5.618 -2.155
102 HD3 PRO 15 HD1 PRO 15 -6.434 4.948 -0.512
103 H ASN 16 H ASN 16 -8.692 5.901 -3.483
104 HA ASN 16 HA ASN 16 -10.858 7.401 -4.337
105 HB2 ASN 16 HB2 ASN 16 -8.460 7.035 -5.361
106 HB3 ASN 16 HB1 ASN 16 -9.285 5.820 -6.333
107 HD21 ASN 16 HD21 ASN 16 -8.145 8.736 -6.600
108 HD22 ASN 16 HD22 ASN 16 -9.331 9.493 -7.602
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -9.599 -0.704 -1.241
2 HA2 GLY 1 HA2 GLY 1 -8.164 -2.528 0.231
3 HA3 GLY 1 HA1 GLY 1 -8.076 -2.404 -1.520
4 H CYS 2 H CYS 2 -6.355 -2.184 1.346
5 HA CYS 2 HA CYS 2 -4.219 -0.590 0.100
6 HB2 CYS 2 HB2 CYS 2 -4.421 -1.383 3.007
7 HB3 CYS 2 HB1 CYS 2 -3.377 -0.157 2.296
8 H TYR 3 H TYR 3 -2.143 -1.384 -0.074
9 HA TYR 3 HA TYR 3 -1.652 -4.142 0.781
10 HB2 TYR 3 HB2 TYR 3 -0.531 -4.496 -1.506
11 HB3 TYR 3 HB1 TYR 3 -2.289 -4.549 -1.444
12 HD1 TYR 3 HD2 TYR 3 -3.618 -2.670 -2.336
13 HD2 TYR 3 HD1 TYR 3 0.619 -2.775 -2.713
14 HE1 TYR 3 HE2 TYR 3 -3.736 -0.934 -4.074
15 HE2 TYR 3 HE1 TYR 3 0.513 -1.037 -4.451
16 HH TYR 3 HH TYR 3 -1.526 0.952 -4.942
17 HA PRO 4 HA PRO 4 2.341 -2.705 1.898
18 HB2 PRO 4 HB2 PRO 4 3.865 -4.903 1.433
19 HB3 PRO 4 HB1 PRO 4 2.725 -4.792 2.778
20 HG2 PRO 4 HG2 PRO 4 2.391 -6.120 0.115
21 HG3 PRO 4 HG1 PRO 4 1.924 -6.705 1.724
22 HD2 PRO 4 HD2 PRO 4 0.149 -5.602 0.002
23 HD3 PRO 4 HD1 PRO 4 -0.001 -5.438 1.763
24 H VAL 5 H VAL 5 4.247 -1.866 1.074
25 HA VAL 5 HA VAL 5 4.845 -2.359 -1.757
26 HB VAL 5 HB VAL 5 5.280 0.099 -2.048
27 HG11 VAL 5 HG11 VAL 5 3.140 -1.238 -2.682
28 HG12 VAL 5 HG12 VAL 5 2.389 -0.295 -1.392
29 HG13 VAL 5 HG13 VAL 5 3.126 0.524 -2.771
30 HG21 VAL 5 HG21 VAL 5 4.173 1.649 -0.513
31 HG22 VAL 5 HG22 VAL 5 3.711 0.299 0.523
32 HG23 VAL 5 HG23 VAL 5 5.413 0.707 0.313
33 HA PRO 6 HA PRO 6 9.048 -2.475 -0.496
34 HB2 PRO 6 HB2 PRO 6 10.293 -1.513 -2.708
35 HB3 PRO 6 HB1 PRO 6 9.552 -3.116 -2.644
36 HG2 PRO 6 HG2 PRO 6 8.469 -0.574 -3.796
37 HG3 PRO 6 HG1 PRO 6 8.415 -2.217 -4.462
38 HD2 PRO 6 HD2 PRO 6 6.303 -1.085 -3.202
39 HD3 PRO 6 HD1 PRO 6 6.628 -2.828 -3.140
40 H TYR 7 H TYR 7 8.269 0.551 -2.220
41 HA TYR 7 HA TYR 7 10.262 2.015 -0.726
42 HB2 TYR 7 HB2 TYR 7 9.669 3.896 -2.090
43 HB3 TYR 7 HB1 TYR 7 9.721 2.479 -3.133
44 HD1 TYR 7 HD2 TYR 7 7.522 4.935 -1.508
45 HD2 TYR 7 HD1 TYR 7 7.728 1.639 -4.190
46 HE1 TYR 7 HE2 TYR 7 5.236 5.422 -2.272
47 HE2 TYR 7 HE1 TYR 7 5.443 2.117 -4.963
48 HH TYR 7 HH TYR 7 3.541 3.277 -4.481
49 HA PRO 8 HA PRO 8 7.654 3.238 2.608
50 HB2 PRO 8 HB2 PRO 8 9.038 5.424 3.426
51 HB3 PRO 8 HB1 PRO 8 9.591 3.771 3.721
52 HG2 PRO 8 HG2 PRO 8 10.437 5.701 1.594
53 HG3 PRO 8 HG1 PRO 8 11.435 4.618 2.582
54 HD2 PRO 8 HD2 PRO 8 10.740 4.034 0.031
55 HD3 PRO 8 HD1 PRO 8 10.967 2.783 1.270
56 HA PRO 9 HA PRO 9 6.487 4.236 4.098
57 HB2 PRO 9 HB2 PRO 9 3.774 4.166 4.174
58 HB3 PRO 9 HB1 PRO 9 4.714 5.561 4.718
59 HG2 PRO 9 HG2 PRO 9 3.308 5.126 2.112
60 HG3 PRO 9 HG1 PRO 9 3.363 6.581 3.124
61 HD2 PRO 9 HD2 PRO 9 4.904 6.282 0.917
62 HD3 PRO 9 HD1 PRO 9 5.439 7.201 2.340
63 H PHE 10 H PHE 10 5.843 2.107 4.591
64 HA PHE 10 HA PHE 10 5.736 0.354 2.317
65 HB2 PHE 10 HB2 PHE 10 5.587 -0.271 5.273
66 HB3 PHE 10 HB1 PHE 10 5.807 -1.454 3.989
67 HD1 PHE 10 HD2 PHE 10 7.722 0.153 2.291
68 HD2 PHE 10 HD1 PHE 10 7.578 -0.607 6.476
69 HE1 PHE 10 HE2 PHE 10 10.159 0.460 2.426
70 HE2 PHE 10 HE1 PHE 10 10.015 -0.301 6.619
71 HZ PHE 10 HZ PHE 10 11.310 0.231 4.593
72 H PHE 11 H PHE 11 3.419 2.088 3.866
73 HA PHE 11 HA PHE 11 1.340 0.051 3.414
74 HB2 PHE 11 HB2 PHE 11 -0.070 1.637 4.861
75 HB3 PHE 11 HB1 PHE 11 1.187 0.707 5.669
76 HD1 PHE 11 HD2 PHE 11 3.254 1.799 6.412
77 HD2 PHE 11 HD1 PHE 11 0.042 4.012 4.710
78 HE1 PHE 11 HE2 PHE 11 4.218 3.878 7.307
79 HE2 PHE 11 HE1 PHE 11 1.001 6.096 5.601
80 HZ PHE 11 HZ PHE 11 3.091 6.030 6.902
81 H THR 12 H THR 12 0.268 0.291 1.579
82 HA THR 12 HA THR 12 -0.227 3.022 0.582
83 HB THR 12 HB THR 12 0.197 0.542 -1.096
84 HG1 THR 12 HG1 THR 12 2.043 1.797 0.038
85 HG21 THR 12 HG21 THR 12 -0.319 3.423 -1.830
86 HG22 THR 12 HG22 THR 12 -1.326 2.025 -2.205
87 HG23 THR 12 HG23 THR 12 0.253 2.205 -2.968
88 H CYS 13 H CYS 13 -2.284 3.556 0.161
89 HA CYS 13 HA CYS 13 -4.297 1.404 0.224
90 HB2 CYS 13 HB2 CYS 13 -4.354 4.191 1.358
91 HB3 CYS 13 HB1 CYS 13 -5.842 3.312 1.020
92 H ASP 14 H ASP 14 -5.906 1.403 -1.294
93 HA ASP 14 HA ASP 14 -5.697 3.445 -3.411
94 HB2 ASP 14 HB2 ASP 14 -5.009 0.963 -3.877
95 HB3 ASP 14 HB1 ASP 14 -6.748 0.687 -3.941
96 HA PRO 15 HA PRO 15 -9.932 3.788 -1.621
97 HB2 PRO 15 HB2 PRO 15 -10.044 6.490 -1.852
98 HB3 PRO 15 HB1 PRO 15 -9.314 5.674 -0.465
99 HG2 PRO 15 HG2 PRO 15 -7.990 6.872 -2.867
100 HG3 PRO 15 HG1 PRO 15 -7.515 6.972 -1.162
101 HD2 PRO 15 HD2 PRO 15 -6.334 5.271 -2.905
102 HD3 PRO 15 HD1 PRO 15 -6.531 4.889 -1.182
103 H ASN 16 H ASN 16 -11.742 5.362 -2.601
104 HA ASN 16 HA ASN 16 -11.597 5.115 -5.533
105 HB2 ASN 16 HB2 ASN 16 -14.047 4.659 -5.492
106 HB3 ASN 16 HB1 ASN 16 -13.095 3.413 -4.690
107 HD21 ASN 16 HD21 ASN 16 -15.843 5.095 -4.468
108 HD22 ASN 16 HD22 ASN 16 -16.074 5.098 -2.755
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -8.763 -3.204 0.340
2 HA2 GLY 1 HA2 GLY 1 -7.502 -3.858 -1.537
3 HA3 GLY 1 HA1 GLY 1 -7.939 -2.351 -2.328
4 H CYS 2 H CYS 2 -6.413 -3.019 0.817
5 HA CYS 2 HA CYS 2 -4.216 -1.235 0.010
6 HB2 CYS 2 HB2 CYS 2 -5.707 -0.668 2.030
7 HB3 CYS 2 HB1 CYS 2 -4.876 -1.987 2.849
8 H TYR 3 H TYR 3 -2.193 -1.994 -0.088
9 HA TYR 3 HA TYR 3 -1.542 -4.522 1.240
10 HB2 TYR 3 HB2 TYR 3 -0.274 -5.152 -0.908
11 HB3 TYR 3 HB1 TYR 3 -2.024 -5.347 -0.906
12 HD1 TYR 3 HD1 TYR 3 0.758 -3.249 -2.122
13 HD2 TYR 3 HD2 TYR 3 -3.408 -4.076 -2.376
14 HE1 TYR 3 HE1 TYR 3 0.607 -1.839 -4.132
15 HE2 TYR 3 HE2 TYR 3 -3.570 -2.669 -4.387
16 HH TYR 3 HH TYR 3 -2.502 -1.185 -5.687
17 HA PRO 4 HA PRO 4 2.266 -2.595 2.260
18 HB2 PRO 4 HB2 PRO 4 3.974 -4.706 2.232
19 HB3 PRO 4 HB1 PRO 4 2.757 -4.470 3.493
20 HG2 PRO 4 HG2 PRO 4 2.668 -6.240 1.080
21 HG3 PRO 4 HG1 PRO 4 2.160 -6.589 2.743
22 HD2 PRO 4 HD2 PRO 4 0.402 -5.936 0.789
23 HD3 PRO 4 HD1 PRO 4 0.146 -5.498 2.491
24 H VAL 5 H VAL 5 4.171 -1.773 1.395
25 HA VAL 5 HA VAL 5 4.930 -2.657 -1.298
26 HB VAL 5 HB VAL 5 5.229 -0.251 -1.955
27 HG11 VAL 5 HG11 VAL 5 3.113 -0.116 -2.843
28 HG12 VAL 5 HG12 VAL 5 3.187 -1.826 -2.412
29 HG13 VAL 5 HG13 VAL 5 2.338 -0.687 -1.365
30 HG21 VAL 5 HG21 VAL 5 3.578 0.213 0.526
31 HG22 VAL 5 HG22 VAL 5 5.228 0.766 0.239
32 HG23 VAL 5 HG23 VAL 5 3.900 1.424 -0.716
33 HA PRO 6 HA PRO 6 9.069 -2.290 0.118
34 HB2 PRO 6 HB2 PRO 6 10.356 -1.587 -2.166
35 HB3 PRO 6 HB1 PRO 6 9.714 -3.209 -1.886
36 HG2 PRO 6 HG2 PRO 6 8.531 -0.949 -3.452
37 HG3 PRO 6 HG1 PRO 6 8.610 -2.673 -3.861
38 HD2 PRO 6 HD2 PRO 6 6.374 -1.512 -2.869
39 HD3 PRO 6 HD1 PRO 6 6.805 -3.200 -2.529
40 H TYR 7 H TYR 7 8.185 0.384 -2.074
41 HA TYR 7 HA TYR 7 10.013 2.188 -0.753
42 HB2 TYR 7 HB2 TYR 7 9.275 3.827 -2.386
43 HB3 TYR 7 HB1 TYR 7 9.614 2.302 -3.196
44 HD1 TYR 7 HD2 TYR 7 6.958 4.604 -2.112
45 HD2 TYR 7 HD1 TYR 7 7.862 1.049 -4.267
46 HE1 TYR 7 HE2 TYR 7 4.708 4.640 -3.104
47 HE2 TYR 7 HE1 TYR 7 5.616 1.075 -5.266
48 HH TYR 7 HH TYR 7 3.615 3.731 -5.216
49 HA PRO 8 HA PRO 8 7.191 3.701 2.274
50 HB2 PRO 8 HB2 PRO 8 8.407 6.068 2.811
51 HB3 PRO 8 HB1 PRO 8 9.043 4.514 3.364
52 HG2 PRO 8 HG2 PRO 8 9.866 6.167 1.008
53 HG3 PRO 8 HG1 PRO 8 10.880 5.305 2.180
54 HD2 PRO 8 HD2 PRO 8 10.336 4.315 -0.281
55 HD3 PRO 8 HD1 PRO 8 10.581 3.272 1.135
56 HA PRO 9 HA PRO 9 5.892 4.812 3.553
57 HB2 PRO 9 HB2 PRO 9 3.188 4.570 3.529
58 HB3 PRO 9 HB1 PRO 9 4.013 6.087 3.907
59 HG2 PRO 9 HG2 PRO 9 2.766 5.199 1.334
60 HG3 PRO 9 HG1 PRO 9 2.682 6.780 2.130
61 HD2 PRO 9 HD2 PRO 9 4.346 6.282 0.052
62 HD3 PRO 9 HD1 PRO 9 4.753 7.424 1.349
63 H PHE 10 H PHE 10 5.368 2.733 4.316
64 HA PHE 10 HA PHE 10 5.484 0.676 2.317
65 HB2 PHE 10 HB2 PHE 10 5.205 0.466 5.323
66 HB3 PHE 10 HB1 PHE 10 5.564 -0.871 4.234
67 HD1 PHE 10 HD1 PHE 10 7.474 0.604 2.413
68 HD2 PHE 10 HD2 PHE 10 7.144 0.428 6.652
69 HE1 PHE 10 HE1 PHE 10 9.878 1.083 2.615
70 HE2 PHE 10 HE2 PHE 10 9.548 0.910 6.862
71 HZ PHE 10 HZ PHE 10 10.919 1.238 4.842
72 H PHE 11 H PHE 11 2.983 2.446 3.507
73 HA PHE 11 HA PHE 11 1.059 0.233 3.243
74 HB2 PHE 11 HB2 PHE 11 -0.523 1.905 4.384
75 HB3 PHE 11 HB1 PHE 11 0.739 1.180 5.374
76 HD1 PHE 11 HD1 PHE 11 2.691 2.498 6.057
77 HD2 PHE 11 HD2 PHE 11 -0.543 4.240 3.905
78 HE1 PHE 11 HE1 PHE 11 3.479 4.739 6.696
79 HE2 PHE 11 HE2 PHE 11 0.240 6.484 4.540
80 HZ PHE 11 HZ PHE 11 2.254 6.736 5.936
81 H THR 12 H THR 12 0.080 0.147 1.343
82 HA THR 12 HA THR 12 -0.530 2.675 -0.046
83 HB THR 12 HB THR 12 0.160 0.032 -1.343
84 HG1 THR 12 HG1 THR 12 1.841 1.579 -0.305
85 HG21 THR 12 HG21 THR 12 0.357 2.083 -3.206
86 HG22 THR 12 HG22 THR 12 -1.126 2.440 -2.321
87 HG23 THR 12 HG23 THR 12 -0.923 0.874 -3.107
88 H CYS 13 H CYS 13 -2.648 3.017 0.097
89 HA CYS 13 HA CYS 13 -4.462 0.721 -0.259
90 HB2 CYS 13 HB2 CYS 13 -5.182 3.272 1.179
91 HB3 CYS 13 HB1 CYS 13 -6.030 1.729 1.209
92 H ASP 14 H ASP 14 -6.573 1.269 -1.233
93 HA ASP 14 HA ASP 14 -6.297 2.486 -3.717
94 HB2 ASP 14 HB2 ASP 14 -8.888 2.551 -3.616
95 HB3 ASP 14 HB1 ASP 14 -8.080 0.988 -3.554
96 HA PRO 15 HA PRO 15 -6.779 6.805 -3.125
97 HB2 PRO 15 HB2 PRO 15 -8.244 7.511 -5.298
98 HB3 PRO 15 HB1 PRO 15 -6.544 7.037 -5.399
99 HG2 PRO 15 HG2 PRO 15 -9.000 5.415 -5.949
100 HG3 PRO 15 HG1 PRO 15 -7.483 5.495 -6.864
101 HD2 PRO 15 HD2 PRO 15 -8.046 3.475 -5.151
102 HD3 PRO 15 HD1 PRO 15 -6.393 4.061 -5.426
103 H ASN 16 H ASN 16 -9.825 5.242 -4.123
104 HA ASN 16 HA ASN 16 -11.413 7.246 -2.785
105 HB2 ASN 16 HB2 ASN 16 -11.984 4.816 -4.432
106 HB3 ASN 16 HB1 ASN 16 -13.260 5.459 -3.402
107 HD21 ASN 16 HD21 ASN 16 -13.830 7.721 -3.694
108 HD22 ASN 16 HD22 ASN 16 -13.708 8.417 -5.270
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -8.126 -2.406 -3.353
2 HA2 GLY 1 HA2 GLY 1 -8.128 -3.174 -0.541
3 HA3 GLY 1 HA1 GLY 1 -7.328 -4.025 -1.854
4 H CYS 2 H CYS 2 -6.367 -3.128 0.820
5 HA CYS 2 HA CYS 2 -4.169 -1.370 -0.047
6 HB2 CYS 2 HB2 CYS 2 -5.716 -0.657 1.873
7 HB3 CYS 2 HB1 CYS 2 -4.928 -1.918 2.816
8 H TYR 3 H TYR 3 -2.140 -2.117 -0.039
9 HA TYR 3 HA TYR 3 -1.504 -4.527 1.499
10 HB2 TYR 3 HB2 TYR 3 -0.175 -5.309 -0.560
11 HB3 TYR 3 HB1 TYR 3 -1.922 -5.522 -0.586
12 HD1 TYR 3 HD1 TYR 3 0.861 -3.457 -1.872
13 HD2 TYR 3 HD2 TYR 3 -3.270 -4.424 -2.208
14 HE1 TYR 3 HE1 TYR 3 0.747 -2.210 -3.988
15 HE2 TYR 3 HE2 TYR 3 -3.394 -3.180 -4.326
16 HH TYR 3 HH TYR 3 -0.601 -2.084 -5.981
17 HA PRO 4 HA PRO 4 2.261 -2.489 2.461
18 HB2 PRO 4 HB2 PRO 4 3.985 -4.577 2.641
19 HB3 PRO 4 HB1 PRO 4 2.735 -4.257 3.848
20 HG2 PRO 4 HG2 PRO 4 2.724 -6.209 1.578
21 HG3 PRO 4 HG1 PRO 4 2.176 -6.434 3.250
22 HD2 PRO 4 HD2 PRO 4 0.464 -5.953 1.209
23 HD3 PRO 4 HD1 PRO 4 0.160 -5.386 2.864
24 H VAL 5 H VAL 5 4.187 -1.725 1.587
25 HA VAL 5 HA VAL 5 5.018 -2.801 -1.013
26 HB VAL 5 HB VAL 5 5.322 -0.449 -1.841
27 HG11 VAL 5 HG11 VAL 5 3.126 -0.273 -2.670
28 HG12 VAL 5 HG12 VAL 5 3.383 -1.997 -2.393
29 HG13 VAL 5 HG13 VAL 5 2.438 -1.049 -1.243
30 HG21 VAL 5 HG21 VAL 5 5.264 0.732 0.264
31 HG22 VAL 5 HG22 VAL 5 3.948 1.303 -0.763
32 HG23 VAL 5 HG23 VAL 5 3.612 0.188 0.562
33 HA PRO 6 HA PRO 6 9.118 -2.304 0.472
34 HB2 PRO 6 HB2 PRO 6 10.458 -1.761 -1.827
35 HB3 PRO 6 HB1 PRO 6 9.816 -3.363 -1.443
36 HG2 PRO 6 HG2 PRO 6 8.662 -1.232 -3.201
37 HG3 PRO 6 HG1 PRO 6 8.759 -2.980 -3.480
38 HD2 PRO 6 HD2 PRO 6 6.494 -1.764 -2.630
39 HD3 PRO 6 HD1 PRO 6 6.924 -3.421 -2.157
40 H TYR 7 H TYR 7 8.266 0.198 -1.927
41 HA TYR 7 HA TYR 7 10.054 2.106 -0.700
42 HB2 TYR 7 HB2 TYR 7 9.213 3.647 -2.450
43 HB3 TYR 7 HB1 TYR 7 9.813 2.132 -3.115
44 HD1 TYR 7 HD2 TYR 7 6.785 4.098 -2.378
45 HD2 TYR 7 HD1 TYR 7 8.353 0.620 -4.263
46 HE1 TYR 7 HE2 TYR 7 4.645 3.771 -3.544
47 HE2 TYR 7 HE1 TYR 7 6.217 0.285 -5.436
48 HH TYR 7 HH TYR 7 3.380 2.007 -4.612
49 HA PRO 8 HA PRO 8 7.153 3.819 2.139
50 HB2 PRO 8 HB2 PRO 8 8.341 6.229 2.525
51 HB3 PRO 8 HB1 PRO 8 8.973 4.726 3.208
52 HG2 PRO 8 HG2 PRO 8 9.841 6.206 0.754
53 HG3 PRO 8 HG1 PRO 8 10.833 5.442 2.010
54 HD2 PRO 8 HD2 PRO 8 10.353 4.267 -0.382
55 HD3 PRO 8 HD1 PRO 8 10.572 3.335 1.114
56 HA PRO 9 HA PRO 9 5.817 5.011 3.300
57 HB2 PRO 9 HB2 PRO 9 3.116 4.745 3.232
58 HB3 PRO 9 HB1 PRO 9 3.921 6.292 3.515
59 HG2 PRO 9 HG2 PRO 9 2.742 5.204 0.987
60 HG3 PRO 9 HG1 PRO 9 2.629 6.841 1.661
61 HD2 PRO 9 HD2 PRO 9 4.344 6.203 -0.334
62 HD3 PRO 9 HD1 PRO 9 4.713 7.441 0.882
63 H PHE 10 H PHE 10 5.286 2.990 4.204
64 HA PHE 10 HA PHE 10 5.464 0.791 2.367
65 HB2 PHE 10 HB2 PHE 10 5.118 0.804 5.373
66 HB3 PHE 10 HB1 PHE 10 5.509 -0.609 4.396
67 HD1 PHE 10 HD1 PHE 10 7.451 0.740 2.511
68 HD2 PHE 10 HD2 PHE 10 7.028 0.879 6.744
69 HE1 PHE 10 HE1 PHE 10 9.847 1.252 2.729
70 HE2 PHE 10 HE2 PHE 10 9.423 1.392 6.970
71 HZ PHE 10 HZ PHE 10 10.837 1.580 4.961
72 H PHE 11 H PHE 11 2.924 2.625 3.359
73 HA PHE 11 HA PHE 11 1.022 0.381 3.218
74 HB2 PHE 11 HB2 PHE 11 -0.597 2.125 4.194
75 HB3 PHE 11 HB1 PHE 11 0.641 1.476 5.265
76 HD1 PHE 11 HD2 PHE 11 2.570 2.846 5.905
77 HD2 PHE 11 HD1 PHE 11 -0.604 4.420 3.547
78 HE1 PHE 11 HE2 PHE 11 3.338 5.129 6.403
79 HE2 PHE 11 HE1 PHE 11 0.160 6.706 4.040
80 HZ PHE 11 HZ PHE 11 2.133 7.063 5.471
81 H THR 12 H THR 12 0.088 0.147 1.308
82 HA THR 12 HA THR 12 -0.506 2.561 -0.276
83 HB THR 12 HB THR 12 0.234 -0.165 -1.357
84 HG1 THR 12 HG1 THR 12 1.724 2.213 -1.704
85 HG21 THR 12 HG21 THR 12 0.446 1.408 -3.476
86 HG22 THR 12 HG22 THR 12 -0.765 2.347 -2.603
87 HG23 THR 12 HG23 THR 12 -1.091 0.668 -3.031
88 H CYS 13 H CYS 13 -2.629 2.894 -0.207
89 HA CYS 13 HA CYS 13 -4.418 0.562 -0.440
90 HB2 CYS 13 HB2 CYS 13 -5.189 3.197 0.805
91 HB3 CYS 13 HB1 CYS 13 -6.025 1.652 0.923
92 H ASP 14 H ASP 14 -6.659 1.289 -1.288
93 HA ASP 14 HA ASP 14 -6.223 2.449 -3.881
94 HB2 ASP 14 HB2 ASP 14 -8.737 2.058 -4.098
95 HB3 ASP 14 HB1 ASP 14 -7.734 0.632 -3.846
96 HA PRO 15 HA PRO 15 -7.430 6.602 -3.151
97 HB2 PRO 15 HB2 PRO 15 -8.744 7.203 -5.449
98 HB3 PRO 15 HB1 PRO 15 -6.990 7.004 -5.370
99 HG2 PRO 15 HG2 PRO 15 -9.080 5.058 -6.271
100 HG3 PRO 15 HG1 PRO 15 -7.505 5.426 -6.999
101 HD2 PRO 15 HD2 PRO 15 -7.920 3.245 -5.449
102 HD3 PRO 15 HD1 PRO 15 -6.362 4.095 -5.504
103 H ASN 16 H ASN 16 -8.914 6.051 -1.408
104 HA ASN 16 HA ASN 16 -11.683 5.569 -1.982
105 HB2 ASN 16 HB2 ASN 16 -10.318 4.901 0.128
106 HB3 ASN 16 HB1 ASN 16 -10.663 6.541 0.671
107 HD21 ASN 16 HD21 ASN 16 -11.537 3.811 1.571
108 HD22 ASN 16 HD22 ASN 16 -13.259 3.920 1.662
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -9.590 -2.133 -0.244
2 HA2 GLY 1 HA2 GLY 1 -7.671 -4.054 -0.810
3 HA3 GLY 1 HA1 GLY 1 -8.067 -2.705 -1.865
4 H CYS 2 H CYS 2 -6.322 -3.216 1.206
5 HA CYS 2 HA CYS 2 -4.236 -1.397 0.201
6 HB2 CYS 2 HB2 CYS 2 -4.883 -2.143 3.061
7 HB3 CYS 2 HB1 CYS 2 -3.645 -1.001 2.547
8 H TYR 3 H TYR 3 -2.168 -2.074 0.043
9 HA TYR 3 HA TYR 3 -1.428 -4.661 1.199
10 HB2 TYR 3 HB2 TYR 3 -0.237 -5.147 -1.031
11 HB3 TYR 3 HB1 TYR 3 -1.980 -5.377 -0.968
12 HD1 TYR 3 HD2 TYR 3 -3.483 -3.768 -2.075
13 HD2 TYR 3 HD1 TYR 3 0.746 -3.446 -2.409
14 HE1 TYR 3 HE2 TYR 3 -3.756 -2.256 -3.995
15 HE2 TYR 3 HE1 TYR 3 0.485 -1.931 -4.330
16 HH TYR 3 HH TYR 3 -1.215 -1.430 -6.061
17 HA PRO 4 HA PRO 4 2.390 -2.731 2.174
18 HB2 PRO 4 HB2 PRO 4 4.127 -4.806 1.959
19 HB3 PRO 4 HB1 PRO 4 2.959 -4.664 3.279
20 HG2 PRO 4 HG2 PRO 4 2.798 -6.297 0.774
21 HG3 PRO 4 HG1 PRO 4 2.364 -6.747 2.433
22 HD2 PRO 4 HD2 PRO 4 0.519 -6.015 0.592
23 HD3 PRO 4 HD1 PRO 4 0.324 -5.678 2.324
24 H VAL 5 H VAL 5 4.225 -1.809 1.276
25 HA VAL 5 HA VAL 5 4.912 -2.542 -1.480
26 HB VAL 5 HB VAL 5 5.116 -0.092 -2.026
27 HG11 VAL 5 HG11 VAL 5 2.932 0.051 -2.802
28 HG12 VAL 5 HG12 VAL 5 3.161 -1.687 -2.590
29 HG13 VAL 5 HG13 VAL 5 2.268 -0.759 -1.384
30 HG21 VAL 5 HG21 VAL 5 5.114 0.761 0.263
31 HG22 VAL 5 HG22 VAL 5 3.818 1.489 -0.687
32 HG23 VAL 5 HG23 VAL 5 3.451 0.212 0.472
33 HA PRO 6 HA PRO 6 9.085 -2.098 -0.190
34 HB2 PRO 6 HB2 PRO 6 10.265 -1.254 -2.484
35 HB3 PRO 6 HB1 PRO 6 9.686 -2.908 -2.254
36 HG2 PRO 6 HG2 PRO 6 8.377 -0.624 -3.678
37 HG3 PRO 6 HG1 PRO 6 8.497 -2.324 -4.164
38 HD2 PRO 6 HD2 PRO 6 6.261 -1.284 -3.047
39 HD3 PRO 6 HD1 PRO 6 6.758 -2.970 -2.797
40 H TYR 7 H TYR 7 8.045 0.635 -2.237
41 HA TYR 7 HA TYR 7 9.851 2.440 -0.880
42 HB2 TYR 7 HB2 TYR 7 9.035 4.120 -2.434
43 HB3 TYR 7 HB1 TYR 7 9.408 2.640 -3.309
44 HD1 TYR 7 HD2 TYR 7 6.732 4.868 -2.170
45 HD2 TYR 7 HD1 TYR 7 7.649 1.317 -4.327
46 HE1 TYR 7 HE2 TYR 7 4.466 4.871 -3.126
47 HE2 TYR 7 HE1 TYR 7 5.386 1.311 -5.290
48 HH TYR 7 HH TYR 7 2.912 3.499 -4.184
49 HA PRO 8 HA PRO 8 7.049 3.771 2.245
50 HB2 PRO 8 HB2 PRO 8 8.169 6.179 2.808
51 HB3 PRO 8 HB1 PRO 8 8.891 4.645 3.305
52 HG2 PRO 8 HG2 PRO 8 9.572 6.389 0.970
53 HG3 PRO 8 HG1 PRO 8 10.658 5.548 2.093
54 HD2 PRO 8 HD2 PRO 8 10.091 4.591 -0.376
55 HD3 PRO 8 HD1 PRO 8 10.422 3.529 1.006
56 HA PRO 9 HA PRO 9 5.766 4.835 3.604
57 HB2 PRO 9 HB2 PRO 9 3.075 4.490 3.689
58 HB3 PRO 9 HB1 PRO 9 3.857 6.034 4.048
59 HG2 PRO 9 HG2 PRO 9 2.539 5.122 1.520
60 HG3 PRO 9 HG1 PRO 9 2.429 6.694 2.336
61 HD2 PRO 9 HD2 PRO 9 4.023 6.277 0.187
62 HD3 PRO 9 HD1 PRO 9 4.441 7.421 1.478
63 H PHE 10 H PHE 10 5.374 2.729 4.361
64 HA PHE 10 HA PHE 10 5.473 0.699 2.336
65 HB2 PHE 10 HB2 PHE 10 5.345 0.454 5.350
66 HB3 PHE 10 HB1 PHE 10 5.694 -0.862 4.235
67 HD1 PHE 10 HD2 PHE 10 7.469 0.658 2.332
68 HD2 PHE 10 HD1 PHE 10 7.340 0.503 6.585
69 HE1 PHE 10 HE2 PHE 10 9.863 1.217 2.422
70 HE2 PHE 10 HE1 PHE 10 9.734 1.062 6.681
71 HZ PHE 10 HZ PHE 10 10.999 1.420 4.598
72 H PHE 11 H PHE 11 2.963 2.351 3.688
73 HA PHE 11 HA PHE 11 1.116 0.070 3.450
74 HB2 PHE 11 HB2 PHE 11 -0.468 1.639 4.727
75 HB3 PHE 11 HB1 PHE 11 0.869 0.929 5.626
76 HD1 PHE 11 HD2 PHE 11 2.806 2.298 6.255
77 HD2 PHE 11 HD1 PHE 11 -0.600 3.986 4.341
78 HE1 PHE 11 HE2 PHE 11 3.542 4.544 6.935
79 HE2 PHE 11 HE1 PHE 11 0.131 6.236 5.017
80 HZ PHE 11 HZ PHE 11 2.203 6.517 6.317
81 H THR 12 H THR 12 0.053 0.007 1.595
82 HA THR 12 HA THR 12 -0.613 2.551 0.261
83 HB THR 12 HB THR 12 -0.168 -0.167 -0.990
84 HG1 THR 12 HG1 THR 12 1.365 2.215 -0.857
85 HG21 THR 12 HG21 THR 12 -0.287 1.229 -3.128
86 HG22 THR 12 HG22 THR 12 -1.058 2.468 -2.137
87 HG23 THR 12 HG23 THR 12 -1.811 0.882 -2.311
88 H CYS 13 H CYS 13 -2.671 2.854 -0.553
89 HA CYS 13 HA CYS 13 -4.651 0.741 -0.125
90 HB2 CYS 13 HB2 CYS 13 -4.738 3.502 1.082
91 HB3 CYS 13 HB1 CYS 13 -6.196 2.544 0.841
92 H ASP 14 H ASP 14 -6.639 1.074 -1.288
93 HA ASP 14 HA ASP 14 -6.300 1.925 -3.913
94 HB2 ASP 14 HB2 ASP 14 -8.894 1.940 -3.905
95 HB3 ASP 14 HB1 ASP 14 -8.056 0.423 -3.591
96 HA PRO 15 HA PRO 15 -6.889 6.271 -3.974
97 HB2 PRO 15 HB2 PRO 15 -8.291 6.618 -6.272
98 HB3 PRO 15 HB1 PRO 15 -6.579 6.176 -6.248
99 HG2 PRO 15 HG2 PRO 15 -8.981 4.431 -6.634
100 HG3 PRO 15 HG1 PRO 15 -7.434 4.414 -7.502
101 HD2 PRO 15 HD2 PRO 15 -8.017 2.651 -5.531
102 HD3 PRO 15 HD1 PRO 15 -6.367 3.232 -5.836
103 H ASN 16 H ASN 16 -8.327 6.122 -2.053
104 HA ASN 16 HA ASN 16 -11.165 6.058 -2.434
105 HB2 ASN 16 HB2 ASN 16 -9.700 5.502 -0.307
106 HB3 ASN 16 HB1 ASN 16 -9.921 7.218 0.026
107 HD21 ASN 16 HD21 ASN 16 -11.498 7.554 1.398
108 HD22 ASN 16 HD22 ASN 16 -12.987 6.681 1.481
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -8.544 -4.121 -1.496
2 HA2 GLY 1 HA2 GLY 1 -7.595 -2.342 -2.716
3 HA3 GLY 1 HA1 GLY 1 -8.354 -1.513 -1.365
4 H CYS 2 H CYS 2 -6.489 -2.521 0.615
5 HA CYS 2 HA CYS 2 -4.175 -0.848 -0.098
6 HB2 CYS 2 HB2 CYS 2 -5.692 -0.230 1.881
7 HB3 CYS 2 HB1 CYS 2 -4.976 -1.612 2.704
8 H TYR 3 H TYR 3 -2.200 -1.717 -0.179
9 HA TYR 3 HA TYR 3 -1.701 -4.280 1.146
10 HB2 TYR 3 HB2 TYR 3 -0.431 -4.965 -0.984
11 HB3 TYR 3 HB1 TYR 3 -2.188 -5.071 -1.010
12 HD1 TYR 3 HD1 TYR 3 -3.510 -3.526 -2.352
13 HD2 TYR 3 HD2 TYR 3 0.740 -3.315 -2.319
14 HE1 TYR 3 HE1 TYR 3 -3.571 -2.105 -4.358
15 HE2 TYR 3 HE2 TYR 3 0.690 -1.891 -4.324
16 HH TYR 3 HH TYR 3 -2.177 -1.413 -6.168
17 HA PRO 4 HA PRO 4 2.182 -2.554 2.238
18 HB2 PRO 4 HB2 PRO 4 3.782 -4.747 2.226
19 HB3 PRO 4 HB1 PRO 4 2.557 -4.457 3.468
20 HG2 PRO 4 HG2 PRO 4 2.419 -6.209 1.044
21 HG3 PRO 4 HG1 PRO 4 1.867 -6.540 2.697
22 HD2 PRO 4 HD2 PRO 4 0.177 -5.790 0.719
23 HD3 PRO 4 HD1 PRO 4 -0.085 -5.346 2.418
24 H VAL 5 H VAL 5 4.146 -1.833 1.411
25 HA VAL 5 HA VAL 5 4.902 -2.739 -1.275
26 HB VAL 5 HB VAL 5 5.340 -0.340 -1.903
27 HG11 VAL 5 HG11 VAL 5 2.417 -0.634 -1.407
28 HG12 VAL 5 HG12 VAL 5 3.269 -0.120 -2.865
29 HG13 VAL 5 HG13 VAL 5 3.235 -1.826 -2.417
30 HG21 VAL 5 HG21 VAL 5 4.005 1.367 -0.682
31 HG22 VAL 5 HG22 VAL 5 3.671 0.158 0.558
32 HG23 VAL 5 HG23 VAL 5 5.327 0.689 0.267
33 HA PRO 6 HA PRO 6 9.030 -2.589 0.213
34 HB2 PRO 6 HB2 PRO 6 10.388 -1.948 -2.049
35 HB3 PRO 6 HB1 PRO 6 9.659 -3.537 -1.784
36 HG2 PRO 6 HG2 PRO 6 8.620 -1.215 -3.363
37 HG3 PRO 6 HG1 PRO 6 8.618 -2.940 -3.776
38 HD2 PRO 6 HD2 PRO 6 6.428 -1.668 -2.817
39 HD3 PRO 6 HD1 PRO 6 6.766 -3.377 -2.476
40 H TYR 7 H TYR 7 8.328 0.129 -1.991
41 HA TYR 7 HA TYR 7 10.219 1.834 -0.630
42 HB2 TYR 7 HB2 TYR 7 9.642 3.497 -2.281
43 HB3 TYR 7 HB1 TYR 7 9.840 1.947 -3.093
44 HD1 TYR 7 HD1 TYR 7 7.905 0.768 -4.013
45 HD2 TYR 7 HD2 TYR 7 7.482 4.572 -2.155
46 HE1 TYR 7 HE1 TYR 7 5.668 0.999 -5.009
47 HE2 TYR 7 HE2 TYR 7 5.244 4.814 -3.145
48 HH TYR 7 HH TYR 7 3.965 2.414 -5.402
49 HA PRO 8 HA PRO 8 7.429 3.499 2.344
50 HB2 PRO 8 HB2 PRO 8 8.743 5.812 2.886
51 HB3 PRO 8 HB1 PRO 8 9.299 4.234 3.456
52 HG2 PRO 8 HG2 PRO 8 10.230 5.835 1.104
53 HG3 PRO 8 HG1 PRO 8 11.188 4.935 2.295
54 HD2 PRO 8 HD2 PRO 8 10.634 3.957 -0.169
55 HD3 PRO 8 HD1 PRO 8 10.811 2.913 1.256
56 HA PRO 9 HA PRO 9 6.174 4.690 3.604
57 HB2 PRO 9 HB2 PRO 9 3.462 4.578 3.557
58 HB3 PRO 9 HB1 PRO 9 4.356 6.057 3.928
59 HG2 PRO 9 HG2 PRO 9 3.091 5.204 1.352
60 HG3 PRO 9 HG1 PRO 9 3.077 6.796 2.132
61 HD2 PRO 9 HD2 PRO 9 4.733 6.197 0.076
62 HD3 PRO 9 HD1 PRO 9 5.183 7.331 1.365
63 H PHE 10 H PHE 10 5.545 2.645 4.382
64 HA PHE 10 HA PHE 10 5.585 0.564 2.407
65 HB2 PHE 10 HB2 PHE 10 5.256 0.407 5.411
66 HB3 PHE 10 HB1 PHE 10 5.554 -0.963 4.345
67 HD1 PHE 10 HD2 PHE 10 7.566 0.361 2.527
68 HD2 PHE 10 HD1 PHE 10 7.171 0.302 6.765
69 HE1 PHE 10 HE2 PHE 10 9.990 0.712 2.755
70 HE2 PHE 10 HE1 PHE 10 9.595 0.654 6.999
71 HZ PHE 10 HZ PHE 10 11.008 0.858 4.993
72 H PHE 11 H PHE 11 3.155 2.465 3.560
73 HA PHE 11 HA PHE 11 1.131 0.347 3.265
74 HB2 PHE 11 HB2 PHE 11 -0.383 2.090 4.392
75 HB3 PHE 11 HB1 PHE 11 0.828 1.297 5.395
76 HD1 PHE 11 HD2 PHE 11 2.835 2.513 6.109
77 HD2 PHE 11 HD1 PHE 11 -0.281 4.425 3.929
78 HE1 PHE 11 HE2 PHE 11 3.725 4.709 6.771
79 HE2 PHE 11 HE1 PHE 11 0.605 6.625 4.586
80 HZ PHE 11 HZ PHE 11 2.610 6.769 6.010
81 H THR 12 H THR 12 0.182 0.314 1.348
82 HA THR 12 HA THR 12 -0.285 2.875 -0.039
83 HB THR 12 HB THR 12 0.329 0.194 -1.300
84 HG1 THR 12 HG1 THR 12 1.810 2.614 -1.057
85 HG21 THR 12 HG21 THR 12 0.319 1.451 -3.426
86 HG22 THR 12 HG22 THR 12 -0.250 2.878 -2.559
87 HG23 THR 12 HG23 THR 12 -1.264 1.439 -2.649
88 H CYS 13 H CYS 13 -2.383 3.328 0.085
89 HA CYS 13 HA CYS 13 -4.312 1.133 -0.302
90 HB2 CYS 13 HB2 CYS 13 -4.876 3.709 1.164
91 HB3 CYS 13 HB1 CYS 13 -5.854 2.246 1.137
92 H ASP 14 H ASP 14 -6.463 1.940 -1.163
93 HA ASP 14 HA ASP 14 -5.922 3.583 -3.507
94 HB2 ASP 14 HB2 ASP 14 -7.996 1.586 -2.746
95 HB3 ASP 14 HB1 ASP 14 -8.449 2.830 -3.908
96 HA PRO 15 HA PRO 15 -8.038 7.190 -2.190
97 HB2 PRO 15 HB2 PRO 15 -9.362 7.950 -4.435
98 HB3 PRO 15 HB1 PRO 15 -7.609 8.086 -4.262
99 HG2 PRO 15 HG2 PRO 15 -9.215 5.977 -5.653
100 HG3 PRO 15 HG1 PRO 15 -7.725 6.780 -6.181
101 HD2 PRO 15 HD2 PRO 15 -7.737 4.304 -5.085
102 HD3 PRO 15 HD1 PRO 15 -6.387 5.437 -4.869
103 H ASN 16 H ASN 16 -10.156 5.075 -4.129
104 HA ASN 16 HA ASN 16 -12.358 5.736 -2.285
105 HB2 ASN 16 HB2 ASN 16 -12.287 5.272 -5.235
106 HB3 ASN 16 HB1 ASN 16 -13.730 4.792 -4.347
107 HD21 ASN 16 HD21 ASN 16 -12.364 7.223 -6.048
108 HD22 ASN 16 HD22 ASN 16 -13.248 8.564 -5.413
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -9.051 -0.855 -0.924
2 HA2 GLY 1 HA2 GLY 1 -7.591 -3.349 -1.470
3 HA3 GLY 1 HA1 GLY 1 -7.771 -2.004 -2.587
4 H CYS 2 H CYS 2 -6.370 -2.762 0.598
5 HA CYS 2 HA CYS 2 -4.140 -0.954 -0.071
6 HB2 CYS 2 HB2 CYS 2 -5.650 -0.386 1.928
7 HB3 CYS 2 HB1 CYS 2 -4.905 -1.766 2.728
8 H TYR 3 H TYR 3 -2.152 -1.792 -0.179
9 HA TYR 3 HA TYR 3 -1.602 -4.363 1.112
10 HB2 TYR 3 HB2 TYR 3 -0.339 -5.001 -1.036
11 HB3 TYR 3 HB1 TYR 3 -2.094 -5.136 -1.050
12 HD1 TYR 3 HD1 TYR 3 0.760 -3.080 -2.187
13 HD2 TYR 3 HD2 TYR 3 -3.413 -3.830 -2.536
14 HE1 TYR 3 HE1 TYR 3 0.673 -1.634 -4.173
15 HE2 TYR 3 HE2 TYR 3 -3.512 -2.387 -4.524
16 HH TYR 3 HH TYR 3 -0.764 -0.472 -5.543
17 HA PRO 4 HA PRO 4 2.263 -2.588 2.191
18 HB2 PRO 4 HB2 PRO 4 3.897 -4.755 2.141
19 HB3 PRO 4 HB1 PRO 4 2.679 -4.500 3.396
20 HG2 PRO 4 HG2 PRO 4 2.548 -6.225 0.953
21 HG3 PRO 4 HG1 PRO 4 2.015 -6.584 2.605
22 HD2 PRO 4 HD2 PRO 4 0.296 -5.837 0.651
23 HD3 PRO 4 HD1 PRO 4 0.042 -5.419 2.357
24 H VAL 5 H VAL 5 4.209 -1.826 1.358
25 HA VAL 5 HA VAL 5 4.957 -2.688 -1.345
26 HB VAL 5 HB VAL 5 5.350 -0.275 -1.948
27 HG11 VAL 5 HG11 VAL 5 2.437 -0.677 -1.420
28 HG12 VAL 5 HG12 VAL 5 3.241 -0.041 -2.857
29 HG13 VAL 5 HG13 VAL 5 3.292 -1.770 -2.508
30 HG21 VAL 5 HG21 VAL 5 3.664 0.182 0.509
31 HG22 VAL 5 HG22 VAL 5 5.332 0.699 0.264
32 HG23 VAL 5 HG23 VAL 5 4.038 1.408 -0.701
33 HA PRO 6 HA PRO 6 9.094 -2.490 0.111
34 HB2 PRO 6 HB2 PRO 6 10.423 -1.800 -2.153
35 HB3 PRO 6 HB1 PRO 6 9.721 -3.403 -1.901
36 HG2 PRO 6 HG2 PRO 6 8.633 -1.080 -3.445
37 HG3 PRO 6 HG1 PRO 6 8.654 -2.799 -3.877
38 HD2 PRO 6 HD2 PRO 6 6.453 -1.575 -2.887
39 HD3 PRO 6 HD1 PRO 6 6.820 -3.282 -2.568
40 H TYR 7 H TYR 7 8.330 0.243 -2.055
41 HA TYR 7 HA TYR 7 10.205 1.962 -0.689
42 HB2 TYR 7 HB2 TYR 7 9.385 3.689 -2.284
43 HB3 TYR 7 HB1 TYR 7 9.957 2.228 -3.079
44 HD1 TYR 7 HD2 TYR 7 6.919 4.084 -2.072
45 HD2 TYR 7 HD1 TYR 7 8.516 0.939 -4.450
46 HE1 TYR 7 HE2 TYR 7 4.773 3.899 -3.257
47 HE2 TYR 7 HE1 TYR 7 6.376 0.746 -5.644
48 HH TYR 7 HH TYR 7 3.522 2.320 -4.567
49 HA PRO 8 HA PRO 8 7.411 3.548 2.326
50 HB2 PRO 8 HB2 PRO 8 8.694 5.874 2.887
51 HB3 PRO 8 HB1 PRO 8 9.280 4.300 3.433
52 HG2 PRO 8 HG2 PRO 8 10.166 5.942 1.093
53 HG3 PRO 8 HG1 PRO 8 11.147 5.044 2.265
54 HD2 PRO 8 HD2 PRO 8 10.589 4.086 -0.205
55 HD3 PRO 8 HD1 PRO 8 10.794 3.028 1.205
56 HA PRO 9 HA PRO 9 6.149 4.703 3.612
57 HB2 PRO 9 HB2 PRO 9 3.438 4.548 3.585
58 HB3 PRO 9 HB1 PRO 9 4.312 6.037 3.966
59 HG2 PRO 9 HG2 PRO 9 3.039 5.194 1.390
60 HG3 PRO 9 HG1 PRO 9 3.006 6.777 2.190
61 HD2 PRO 9 HD2 PRO 9 4.655 6.228 0.113
62 HD3 PRO 9 HD1 PRO 9 5.098 7.354 1.412
63 H PHE 10 H PHE 10 5.562 2.639 4.370
64 HA PHE 10 HA PHE 10 5.618 0.583 2.370
65 HB2 PHE 10 HB2 PHE 10 5.315 0.384 5.374
66 HB3 PHE 10 HB1 PHE 10 5.627 -0.967 4.290
67 HD1 PHE 10 HD1 PHE 10 7.601 0.409 2.472
68 HD2 PHE 10 HD2 PHE 10 7.242 0.296 6.713
69 HE1 PHE 10 HE1 PHE 10 10.022 0.797 2.685
70 HE2 PHE 10 HE2 PHE 10 9.662 0.685 6.931
71 HZ PHE 10 HZ PHE 10 11.055 0.936 4.916
72 H PHE 11 H PHE 11 3.166 2.430 3.568
73 HA PHE 11 HA PHE 11 1.174 0.283 3.262
74 HB2 PHE 11 HB2 PHE 11 -0.358 1.988 4.423
75 HB3 PHE 11 HB1 PHE 11 0.874 1.203 5.407
76 HD1 PHE 11 HD1 PHE 11 2.867 2.441 6.120
77 HD2 PHE 11 HD2 PHE 11 -0.297 4.330 3.989
78 HE1 PHE 11 HE1 PHE 11 3.727 4.643 6.802
79 HE2 PHE 11 HE2 PHE 11 0.559 6.535 4.667
80 HZ PHE 11 HZ PHE 11 2.573 6.694 6.074
81 H THR 12 H THR 12 0.210 0.259 1.353
82 HA THR 12 HA THR 12 -0.309 2.828 0.003
83 HB THR 12 HB THR 12 0.306 0.176 -1.317
84 HG1 THR 12 HG1 THR 12 2.021 1.683 -0.283
85 HG21 THR 12 HG21 THR 12 0.384 1.592 -3.391
86 HG22 THR 12 HG22 THR 12 -0.336 2.898 -2.449
87 HG23 THR 12 HG23 THR 12 -1.224 1.394 -2.693
88 H CYS 13 H CYS 13 -2.414 3.246 0.148
89 HA CYS 13 HA CYS 13 -4.311 1.025 -0.249
90 HB2 CYS 13 HB2 CYS 13 -4.902 3.575 1.251
91 HB3 CYS 13 HB1 CYS 13 -5.858 2.096 1.216
92 H ASP 14 H ASP 14 -6.327 1.575 -1.313
93 HA ASP 14 HA ASP 14 -5.998 3.800 -3.219
94 HB2 ASP 14 HB2 ASP 14 -6.014 1.293 -4.000
95 HB3 ASP 14 HB1 ASP 14 -7.756 1.445 -3.795
96 HA PRO 15 HA PRO 15 -9.697 4.821 -0.657
97 HB2 PRO 15 HB2 PRO 15 -9.187 7.486 -0.596
98 HB3 PRO 15 HB1 PRO 15 -8.474 6.345 0.550
99 HG2 PRO 15 HG2 PRO 15 -7.281 7.542 -1.920
100 HG3 PRO 15 HG1 PRO 15 -6.542 7.298 -0.326
101 HD2 PRO 15 HD2 PRO 15 -6.085 5.635 -2.414
102 HD3 PRO 15 HD1 PRO 15 -6.105 5.071 -0.731
103 H ASN 16 H ASN 16 -10.905 4.205 -2.577
104 HA ASN 16 HA ASN 16 -12.374 4.628 -4.260
105 HB2 ASN 16 HB2 ASN 16 -12.885 6.554 -2.566
106 HB3 ASN 16 HB1 ASN 16 -12.120 7.577 -3.778
107 HD21 ASN 16 HD21 ASN 16 -13.897 8.682 -4.417
108 HD22 ASN 16 HD22 ASN 16 -15.249 7.957 -5.210
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -8.938 0.379 -0.796
2 HA2 GLY 1 HA2 GLY 1 -8.264 -2.203 0.477
3 HA3 GLY 1 HA1 GLY 1 -8.243 -1.951 -1.262
4 H CYS 2 H CYS 2 -6.393 -2.019 1.521
5 HA CYS 2 HA CYS 2 -4.267 -0.382 0.320
6 HB2 CYS 2 HB2 CYS 2 -4.420 -1.413 3.157
7 HB3 CYS 2 HB1 CYS 2 -3.291 -0.223 2.519
8 H TYR 3 H TYR 3 -2.213 -1.210 0.008
9 HA TYR 3 HA TYR 3 -1.784 -4.052 0.572
10 HB2 TYR 3 HB2 TYR 3 -0.745 -4.200 -1.782
11 HB3 TYR 3 HB1 TYR 3 -2.499 -4.235 -1.655
12 HD1 TYR 3 HD2 TYR 3 -3.828 -2.252 -2.296
13 HD2 TYR 3 HD1 TYR 3 0.387 -2.390 -2.869
14 HE1 TYR 3 HE2 TYR 3 -3.982 -0.353 -3.850
15 HE2 TYR 3 HE1 TYR 3 0.243 -0.490 -4.424
16 HH TYR 3 HH TYR 3 -1.189 0.767 -5.668
17 HA PRO 4 HA PRO 4 2.289 -2.854 1.674
18 HB2 PRO 4 HB2 PRO 4 3.725 -5.036 0.934
19 HB3 PRO 4 HB1 PRO 4 2.635 -5.030 2.325
20 HG2 PRO 4 HG2 PRO 4 2.169 -6.070 -0.443
21 HG3 PRO 4 HG1 PRO 4 1.737 -6.801 1.113
22 HD2 PRO 4 HD2 PRO 4 -0.059 -5.479 -0.421
23 HD3 PRO 4 HD1 PRO 4 -0.143 -5.490 1.352
24 H VAL 5 H VAL 5 4.162 -1.953 0.866
25 HA VAL 5 HA VAL 5 4.679 -2.201 -2.012
26 HB VAL 5 HB VAL 5 5.136 0.274 -2.090
27 HG11 VAL 5 HG11 VAL 5 2.745 0.887 -2.315
28 HG12 VAL 5 HG12 VAL 5 3.154 -0.630 -3.119
29 HG13 VAL 5 HG13 VAL 5 2.314 -0.652 -1.568
30 HG21 VAL 5 HG21 VAL 5 5.265 0.581 0.367
31 HG22 VAL 5 HG22 VAL 5 4.157 1.706 -0.417
32 HG23 VAL 5 HG23 VAL 5 3.525 0.313 0.459
33 HA PRO 6 HA PRO 6 8.913 -2.448 -0.880
34 HB2 PRO 6 HB2 PRO 6 10.108 -1.299 -3.030
35 HB3 PRO 6 HB1 PRO 6 9.357 -2.897 -3.089
36 HG2 PRO 6 HG2 PRO 6 8.264 -0.257 -3.981
37 HG3 PRO 6 HG1 PRO 6 8.180 -1.833 -4.789
38 HD2 PRO 6 HD2 PRO 6 6.109 -0.807 -3.379
39 HD3 PRO 6 HD1 PRO 6 6.423 -2.551 -3.480
40 H TYR 7 H TYR 7 8.117 0.725 -2.310
41 HA TYR 7 HA TYR 7 10.145 2.029 -0.709
42 HB2 TYR 7 HB2 TYR 7 9.441 4.073 -1.877
43 HB3 TYR 7 HB1 TYR 7 9.769 2.768 -3.012
44 HD1 TYR 7 HD2 TYR 7 7.136 4.813 -1.461
45 HD2 TYR 7 HD1 TYR 7 8.013 1.824 -4.359
46 HE1 TYR 7 HE2 TYR 7 4.902 5.118 -2.443
47 HE2 TYR 7 HE1 TYR 7 5.782 2.122 -5.351
48 HH TYR 7 HH TYR 7 3.905 4.674 -4.918
49 HA PRO 8 HA PRO 8 7.537 3.045 2.693
50 HB2 PRO 8 HB2 PRO 8 8.935 5.159 3.667
51 HB3 PRO 8 HB1 PRO 8 9.475 3.486 3.846
52 HG2 PRO 8 HG2 PRO 8 10.341 5.554 1.862
53 HG3 PRO 8 HG1 PRO 8 11.328 4.398 2.775
54 HD2 PRO 8 HD2 PRO 8 10.638 4.000 0.187
55 HD3 PRO 8 HD1 PRO 8 10.851 2.663 1.335
56 HA PRO 9 HA PRO 9 6.417 3.990 4.280
57 HB2 PRO 9 HB2 PRO 9 3.706 3.952 4.402
58 HB3 PRO 9 HB1 PRO 9 4.676 5.302 5.004
59 HG2 PRO 9 HG2 PRO 9 3.217 5.029 2.404
60 HG3 PRO 9 HG1 PRO 9 3.312 6.425 3.493
61 HD2 PRO 9 HD2 PRO 9 4.808 6.226 1.245
62 HD3 PRO 9 HD1 PRO 9 5.383 7.058 2.704
63 H PHE 10 H PHE 10 5.876 1.833 4.628
64 HA PHE 10 HA PHE 10 5.682 0.210 2.288
65 HB2 PHE 10 HB2 PHE 10 5.521 -0.558 5.210
66 HB3 PHE 10 HB1 PHE 10 5.710 -1.684 3.870
67 HD1 PHE 10 HD1 PHE 10 7.656 -0.059 2.238
68 HD2 PHE 10 HD2 PHE 10 7.507 -0.978 6.390
69 HE1 PHE 10 HE1 PHE 10 10.100 0.187 2.376
70 HE2 PHE 10 HE2 PHE 10 9.950 -0.733 6.536
71 HZ PHE 10 HZ PHE 10 11.251 -0.149 4.528
72 H PHE 11 H PHE 11 3.388 1.829 4.069
73 HA PHE 11 HA PHE 11 1.282 -0.109 3.381
74 HB2 PHE 11 HB2 PHE 11 -0.096 1.299 5.030
75 HB3 PHE 11 HB1 PHE 11 1.153 0.256 5.701
76 HD1 PHE 11 HD1 PHE 11 3.242 1.213 6.558
77 HD2 PHE 11 HD2 PHE 11 0.053 3.674 5.182
78 HE1 PHE 11 HE1 PHE 11 4.246 3.147 7.701
79 HE2 PHE 11 HE2 PHE 11 1.052 5.612 6.322
80 HZ PHE 11 HZ PHE 11 3.151 5.350 7.582
81 H THR 12 H THR 12 0.205 0.372 1.596
82 HA THR 12 HA THR 12 -0.299 3.210 0.976
83 HB THR 12 HB THR 12 -0.361 2.442 -1.460
84 HG1 THR 12 HG1 THR 12 -0.336 0.158 -0.899
85 HG21 THR 12 HG21 THR 12 2.043 2.682 -1.729
86 HG22 THR 12 HG22 THR 12 2.292 2.310 -0.023
87 HG23 THR 12 HG23 THR 12 1.460 3.793 -0.490
88 H CYS 13 H CYS 13 -2.315 3.751 0.174
89 HA CYS 13 HA CYS 13 -4.311 1.595 0.041
90 HB2 CYS 13 HB2 CYS 13 -4.690 4.269 1.407
91 HB3 CYS 13 HB1 CYS 13 -5.926 3.030 1.214
92 H ASP 14 H ASP 14 -5.976 1.881 -1.427
93 HA ASP 14 HA ASP 14 -5.447 3.868 -3.495
94 HB2 ASP 14 HB2 ASP 14 -6.896 1.272 -3.368
95 HB3 ASP 14 HB1 ASP 14 -7.461 2.457 -4.543
96 HA PRO 15 HA PRO 15 -8.826 6.516 -2.599
97 HB2 PRO 15 HB2 PRO 15 -9.775 7.117 -5.070
98 HB3 PRO 15 HB1 PRO 15 -8.239 7.739 -4.454
99 HG2 PRO 15 HG2 PRO 15 -8.747 5.433 -6.295
100 HG3 PRO 15 HG1 PRO 15 -7.503 6.692 -6.395
101 HD2 PRO 15 HD2 PRO 15 -6.990 4.210 -5.446
102 HD3 PRO 15 HD1 PRO 15 -6.149 5.654 -4.847
103 H ASN 16 H ASN 16 -9.500 3.788 -4.719
104 HA ASN 16 HA ASN 16 -12.339 3.970 -4.533
105 HB2 ASN 16 HB2 ASN 16 -12.409 2.002 -5.792
106 HB3 ASN 16 HB1 ASN 16 -10.897 2.745 -6.305
107 HD21 ASN 16 HD21 ASN 16 -12.298 -0.067 -5.355
108 HD22 ASN 16 HD22 ASN 16 -10.893 -0.928 -4.834
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -8.589 -2.563 0.825
2 HA2 GLY 1 HA2 GLY 1 -7.425 -3.906 -1.489
3 HA3 GLY 1 HA1 GLY 1 -8.166 -2.339 -1.785
4 H CYS 2 H CYS 2 -6.004 -3.736 0.687
5 HA CYS 2 HA CYS 2 -4.086 -1.592 0.117
6 HB2 CYS 2 HB2 CYS 2 -5.643 -1.155 2.163
7 HB3 CYS 2 HB1 CYS 2 -4.648 -2.367 2.963
8 H TYR 3 H TYR 3 -2.043 -2.287 0.005
9 HA TYR 3 HA TYR 3 -1.296 -4.781 1.346
10 HB2 TYR 3 HB2 TYR 3 -0.019 -5.382 -0.805
11 HB3 TYR 3 HB1 TYR 3 -1.760 -5.638 -0.791
12 HD1 TYR 3 HD1 TYR 3 0.925 -3.406 -2.005
13 HD2 TYR 3 HD2 TYR 3 -3.183 -4.474 -2.296
14 HE1 TYR 3 HE1 TYR 3 0.713 -2.016 -4.023
15 HE2 TYR 3 HE2 TYR 3 -3.407 -3.089 -4.316
16 HH TYR 3 HH TYR 3 -0.722 -1.832 -5.990
17 HA PRO 4 HA PRO 4 2.447 -2.713 2.328
18 HB2 PRO 4 HB2 PRO 4 4.229 -4.761 2.304
19 HB3 PRO 4 HB1 PRO 4 3.012 -4.561 3.572
20 HG2 PRO 4 HG2 PRO 4 2.972 -6.350 1.171
21 HG3 PRO 4 HG1 PRO 4 2.488 -6.705 2.840
22 HD2 PRO 4 HD2 PRO 4 0.695 -6.129 0.893
23 HD3 PRO 4 HD1 PRO 4 0.434 -5.688 2.593
24 H VAL 5 H VAL 5 4.282 -1.799 1.431
25 HA VAL 5 HA VAL 5 5.093 -2.697 -1.241
26 HB VAL 5 HB VAL 5 5.253 -0.284 -1.945
27 HG11 VAL 5 HG11 VAL 5 3.506 -1.667 -2.832
28 HG12 VAL 5 HG12 VAL 5 2.537 -1.458 -1.371
29 HG13 VAL 5 HG13 VAL 5 2.823 -0.088 -2.445
30 HG21 VAL 5 HG21 VAL 5 3.965 1.376 -0.773
31 HG22 VAL 5 HG22 VAL 5 3.413 0.180 0.398
32 HG23 VAL 5 HG23 VAL 5 5.112 0.649 0.352
33 HA PRO 6 HA PRO 6 9.201 -2.047 0.166
34 HB2 PRO 6 HB2 PRO 6 10.446 -1.324 -2.137
35 HB3 PRO 6 HB1 PRO 6 9.902 -2.975 -1.816
36 HG2 PRO 6 HG2 PRO 6 8.587 -0.829 -3.438
37 HG3 PRO 6 HG1 PRO 6 8.771 -2.554 -3.804
38 HD2 PRO 6 HD2 PRO 6 6.468 -1.507 -2.840
39 HD3 PRO 6 HD1 PRO 6 6.999 -3.157 -2.458
40 H TYR 7 H TYR 7 8.164 0.514 -2.095
41 HA TYR 7 HA TYR 7 9.871 2.455 -0.805
42 HB2 TYR 7 HB2 TYR 7 9.112 3.992 -2.502
43 HB3 TYR 7 HB1 TYR 7 9.468 2.449 -3.269
44 HD1 TYR 7 HD1 TYR 7 7.684 1.071 -4.183
45 HD2 TYR 7 HD2 TYR 7 6.831 4.810 -2.340
46 HE1 TYR 7 HE1 TYR 7 5.430 1.034 -5.166
47 HE2 TYR 7 HE2 TYR 7 4.573 4.783 -3.316
48 HH TYR 7 HH TYR 7 2.973 3.232 -4.210
49 HA PRO 8 HA PRO 8 6.923 3.890 2.138
50 HB2 PRO 8 HB2 PRO 8 7.981 6.345 2.611
51 HB3 PRO 8 HB1 PRO 8 8.706 4.852 3.220
52 HG2 PRO 8 HG2 PRO 8 9.453 6.478 0.820
53 HG3 PRO 8 HG1 PRO 8 10.506 5.721 2.030
54 HD2 PRO 8 HD2 PRO 8 10.055 4.620 -0.403
55 HD3 PRO 8 HD1 PRO 8 10.347 3.641 1.049
56 HA PRO 9 HA PRO 9 5.562 4.990 3.380
57 HB2 PRO 9 HB2 PRO 9 2.875 4.594 3.365
58 HB3 PRO 9 HB1 PRO 9 3.613 6.170 3.679
59 HG2 PRO 9 HG2 PRO 9 2.425 5.105 1.146
60 HG3 PRO 9 HG1 PRO 9 2.250 6.712 1.875
61 HD2 PRO 9 HD2 PRO 9 3.944 6.220 -0.179
62 HD3 PRO 9 HD1 PRO 9 4.284 7.437 1.067
63 H PHE 10 H PHE 10 5.219 2.916 4.216
64 HA PHE 10 HA PHE 10 5.448 0.788 2.318
65 HB2 PHE 10 HB2 PHE 10 5.136 0.698 5.326
66 HB3 PHE 10 HB1 PHE 10 5.574 -0.670 4.306
67 HD1 PHE 10 HD2 PHE 10 7.438 0.785 2.436
68 HD2 PHE 10 HD1 PHE 10 7.050 0.847 6.675
69 HE1 PHE 10 HE2 PHE 10 9.813 1.393 2.641
70 HE2 PHE 10 HE1 PHE 10 9.425 1.457 6.886
71 HZ PHE 10 HZ PHE 10 10.810 1.729 4.867
72 H PHE 11 H PHE 11 2.828 2.441 3.501
73 HA PHE 11 HA PHE 11 1.043 0.118 3.199
74 HB2 PHE 11 HB2 PHE 11 -0.635 1.661 4.382
75 HB3 PHE 11 HB1 PHE 11 0.672 0.992 5.352
76 HD1 PHE 11 HD2 PHE 11 2.548 2.413 6.054
77 HD2 PHE 11 HD1 PHE 11 -0.806 4.000 3.967
78 HE1 PHE 11 HE2 PHE 11 3.196 4.684 6.744
79 HE2 PHE 11 HE1 PHE 11 -0.161 6.273 4.653
80 HZ PHE 11 HZ PHE 11 1.842 6.617 6.044
81 H THR 12 H THR 12 0.074 0.017 1.294
82 HA THR 12 HA THR 12 -0.700 2.535 -0.030
83 HB THR 12 HB THR 12 -0.503 1.169 -2.194
84 HG1 THR 12 HG1 THR 12 -0.176 -0.842 -0.889
85 HG21 THR 12 HG21 THR 12 2.019 1.821 -0.663
86 HG22 THR 12 HG22 THR 12 1.043 2.977 -1.570
87 HG23 THR 12 HG23 THR 12 1.873 1.671 -2.414
88 H CYS 13 H CYS 13 -2.836 2.736 0.120
89 HA CYS 13 HA CYS 13 -4.499 0.329 -0.230
90 HB2 CYS 13 HB2 CYS 13 -5.367 2.884 1.119
91 HB3 CYS 13 HB1 CYS 13 -6.163 1.314 1.162
92 H ASP 14 H ASP 14 -6.689 0.799 -1.172
93 HA ASP 14 HA ASP 14 -6.461 1.855 -3.733
94 HB2 ASP 14 HB2 ASP 14 -9.051 1.911 -3.596
95 HB3 ASP 14 HB1 ASP 14 -8.230 0.360 -3.446
96 HA PRO 15 HA PRO 15 -6.963 6.200 -3.417
97 HB2 PRO 15 HB2 PRO 15 -8.467 6.755 -5.608
98 HB3 PRO 15 HB1 PRO 15 -6.766 6.284 -5.704
99 HG2 PRO 15 HG2 PRO 15 -9.218 4.615 -6.108
100 HG3 PRO 15 HG1 PRO 15 -7.717 4.644 -7.051
101 HD2 PRO 15 HD2 PRO 15 -8.239 2.738 -5.200
102 HD3 PRO 15 HD1 PRO 15 -6.594 3.314 -5.539
103 H ASN 16 H ASN 16 -8.411 7.873 -2.875
104 HA ASN 16 HA ASN 16 -11.113 6.951 -2.147
105 HB2 ASN 16 HB2 ASN 16 -9.345 7.645 -0.332
106 HB3 ASN 16 HB1 ASN 16 -9.803 9.282 -0.797
107 HD21 ASN 16 HD21 ASN 16 -10.621 6.534 1.005
108 HD22 ASN 16 HD22 ASN 16 -12.157 7.074 1.583
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -8.637 0.112 0.488
2 HA2 GLY 1 HA2 GLY 1 -8.114 -2.444 0.510
3 HA3 GLY 1 HA1 GLY 1 -8.105 -2.206 -1.231
4 H CYS 2 H CYS 2 -6.261 -2.162 1.576
5 HA CYS 2 HA CYS 2 -4.150 -0.549 0.316
6 HB2 CYS 2 HB2 CYS 2 -4.251 -1.469 3.190
7 HB3 CYS 2 HB1 CYS 2 -3.207 -0.235 2.493
8 H TYR 3 H TYR 3 -2.083 -1.363 0.050
9 HA TYR 3 HA TYR 3 -1.621 -4.172 0.739
10 HB2 TYR 3 HB2 TYR 3 -0.566 -4.408 -1.601
11 HB3 TYR 3 HB1 TYR 3 -2.321 -4.460 -1.481
12 HD1 TYR 3 HD1 TYR 3 -3.672 -2.528 -2.217
13 HD2 TYR 3 HD2 TYR 3 0.546 -2.632 -2.761
14 HE1 TYR 3 HE1 TYR 3 -3.843 -0.698 -3.851
15 HE2 TYR 3 HE2 TYR 3 0.387 -0.802 -4.396
16 HH TYR 3 HH TYR 3 -1.650 1.220 -4.702
17 HA PRO 4 HA PRO 4 2.431 -2.873 1.809
18 HB2 PRO 4 HB2 PRO 4 3.899 -5.066 1.171
19 HB3 PRO 4 HB1 PRO 4 2.802 -5.015 2.555
20 HG2 PRO 4 HG2 PRO 4 2.364 -6.179 -0.168
21 HG3 PRO 4 HG1 PRO 4 1.935 -6.847 1.417
22 HD2 PRO 4 HD2 PRO 4 0.129 -5.617 -0.183
23 HD3 PRO 4 HD1 PRO 4 0.035 -5.553 1.590
24 H VAL 5 H VAL 5 4.267 -1.946 0.965
25 HA VAL 5 HA VAL 5 4.832 -2.339 -1.886
26 HB VAL 5 HB VAL 5 5.208 0.143 -2.099
27 HG11 VAL 5 HG11 VAL 5 2.447 -0.953 -1.622
28 HG12 VAL 5 HG12 VAL 5 2.743 0.653 -2.290
29 HG13 VAL 5 HG13 VAL 5 3.300 -0.780 -3.156
30 HG21 VAL 5 HG21 VAL 5 5.334 0.740 0.233
31 HG22 VAL 5 HG22 VAL 5 3.973 1.585 -0.507
32 HG23 VAL 5 HG23 VAL 5 3.688 0.170 0.506
33 HA PRO 6 HA PRO 6 9.055 -2.374 -0.687
34 HB2 PRO 6 HB2 PRO 6 10.243 -1.305 -2.883
35 HB3 PRO 6 HB1 PRO 6 9.547 -2.931 -2.862
36 HG2 PRO 6 HG2 PRO 6 8.379 -0.383 -3.915
37 HG3 PRO 6 HG1 PRO 6 8.361 -2.004 -4.635
38 HD2 PRO 6 HD2 PRO 6 6.235 -0.973 -3.311
39 HD3 PRO 6 HD1 PRO 6 6.611 -2.709 -3.311
40 H TYR 7 H TYR 7 8.171 0.684 -2.301
41 HA TYR 7 HA TYR 7 10.144 2.153 -0.790
42 HB2 TYR 7 HB2 TYR 7 9.457 4.068 -2.072
43 HB3 TYR 7 HB1 TYR 7 9.561 2.691 -3.165
44 HD1 TYR 7 HD2 TYR 7 7.301 5.044 -1.495
45 HD2 TYR 7 HD1 TYR 7 7.568 1.756 -4.181
46 HE1 TYR 7 HE2 TYR 7 4.990 5.460 -2.225
47 HE2 TYR 7 HE1 TYR 7 5.259 2.163 -4.919
48 HH TYR 7 HH TYR 7 3.699 4.424 -4.920
49 HA PRO 8 HA PRO 8 7.563 3.184 2.629
50 HB2 PRO 8 HB2 PRO 8 8.902 5.378 3.501
51 HB3 PRO 8 HB1 PRO 8 9.505 3.732 3.728
52 HG2 PRO 8 HG2 PRO 8 10.260 5.758 1.656
53 HG3 PRO 8 HG1 PRO 8 11.303 4.669 2.590
54 HD2 PRO 8 HD2 PRO 8 10.581 4.156 0.031
55 HD3 PRO 8 HD1 PRO 8 10.862 2.868 1.221
56 HA PRO 9 HA PRO 9 6.394 4.096 4.171
57 HB2 PRO 9 HB2 PRO 9 3.686 3.947 4.290
58 HB3 PRO 9 HB1 PRO 9 4.598 5.347 4.868
59 HG2 PRO 9 HG2 PRO 9 3.158 4.966 2.271
60 HG3 PRO 9 HG1 PRO 9 3.191 6.384 3.334
61 HD2 PRO 9 HD2 PRO 9 4.702 6.207 1.093
62 HD3 PRO 9 HD1 PRO 9 5.236 7.090 2.538
63 H PHE 10 H PHE 10 5.865 1.930 4.586
64 HA PHE 10 HA PHE 10 5.768 0.254 2.264
65 HB2 PHE 10 HB2 PHE 10 5.643 -0.465 5.200
66 HB3 PHE 10 HB1 PHE 10 5.874 -1.607 3.880
67 HD1 PHE 10 HD1 PHE 10 7.752 0.060 2.212
68 HD2 PHE 10 HD2 PHE 10 7.645 -0.778 6.383
69 HE1 PHE 10 HE1 PHE 10 10.185 0.407 2.340
70 HE2 PHE 10 HE2 PHE 10 10.077 -0.432 6.519
71 HZ PHE 10 HZ PHE 10 11.350 0.162 4.495
72 H PHE 11 H PHE 11 3.412 1.841 3.958
73 HA PHE 11 HA PHE 11 1.380 -0.176 3.258
74 HB2 PHE 11 HB2 PHE 11 -0.038 1.067 4.996
75 HB3 PHE 11 HB1 PHE 11 1.271 0.057 5.601
76 HD1 PHE 11 HD1 PHE 11 3.332 1.085 6.463
77 HD2 PHE 11 HD2 PHE 11 -0.028 3.426 5.298
78 HE1 PHE 11 HE1 PHE 11 4.246 3.008 7.698
79 HE2 PHE 11 HE2 PHE 11 0.882 5.351 6.529
80 HZ PHE 11 HZ PHE 11 3.022 5.144 7.730
81 H THR 12 H THR 12 0.273 0.366 1.509
82 HA THR 12 HA THR 12 -0.367 3.210 1.070
83 HB THR 12 HB THR 12 1.314 2.492 -0.560
84 HG1 THR 12 HG1 THR 12 0.162 3.182 -2.371
85 HG21 THR 12 HG21 THR 12 0.513 0.809 -2.317
86 HG22 THR 12 HG22 THR 12 -0.687 0.319 -1.121
87 HG23 THR 12 HG23 THR 12 1.033 0.167 -0.759
88 H CYS 13 H CYS 13 -2.397 3.690 0.227
89 HA CYS 13 HA CYS 13 -4.287 1.436 0.066
90 HB2 CYS 13 HB2 CYS 13 -4.788 4.141 1.328
91 HB3 CYS 13 HB1 CYS 13 -5.995 2.876 1.119
92 H ASP 14 H ASP 14 -5.717 1.465 -1.591
93 HA ASP 14 HA ASP 14 -5.585 3.777 -3.416
94 HB2 ASP 14 HB2 ASP 14 -5.603 0.839 -3.901
95 HB3 ASP 14 HB1 ASP 14 -6.450 1.859 -5.060
96 HA PRO 15 HA PRO 15 -9.924 3.602 -1.856
97 HB2 PRO 15 HB2 PRO 15 -10.220 6.298 -1.740
98 HB3 PRO 15 HB1 PRO 15 -9.510 5.352 -0.427
99 HG2 PRO 15 HG2 PRO 15 -8.148 6.947 -2.564
100 HG3 PRO 15 HG1 PRO 15 -7.776 6.847 -0.833
101 HD2 PRO 15 HD2 PRO 15 -6.380 5.476 -2.704
102 HD3 PRO 15 HD1 PRO 15 -6.642 4.854 -1.062
103 H ASN 16 H ASN 16 -11.876 4.752 -2.787
104 HA ASN 16 HA ASN 16 -11.695 4.653 -5.678
105 HB2 ASN 16 HB2 ASN 16 -13.963 4.765 -3.710
106 HB3 ASN 16 HB1 ASN 16 -14.247 5.074 -5.420
107 HD21 ASN 16 HD21 ASN 16 -15.650 3.149 -5.019
108 HD22 ASN 16 HD22 ASN 16 -14.942 1.592 -5.264
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -8.858 -0.829 -0.917
2 HA2 GLY 1 HA2 GLY 1 -7.977 -3.196 0.617
3 HA3 GLY 1 HA1 GLY 1 -7.954 -3.104 -1.138
4 H CYS 2 H CYS 2 -6.153 -2.733 1.668
5 HA CYS 2 HA CYS 2 -4.126 -1.093 0.307
6 HB2 CYS 2 HB2 CYS 2 -4.207 -1.803 3.241
7 HB3 CYS 2 HB1 CYS 2 -3.233 -0.561 2.463
8 H TYR 3 H TYR 3 -2.011 -1.798 0.120
9 HA TYR 3 HA TYR 3 -1.391 -4.515 1.018
10 HB2 TYR 3 HB2 TYR 3 -0.295 -4.857 -1.289
11 HB3 TYR 3 HB1 TYR 3 -2.046 -5.008 -1.179
12 HD1 TYR 3 HD1 TYR 3 -3.501 -3.221 -2.067
13 HD2 TYR 3 HD2 TYR 3 0.722 -3.107 -2.567
14 HE1 TYR 3 HE1 TYR 3 -3.762 -1.530 -3.833
15 HE2 TYR 3 HE2 TYR 3 0.474 -1.414 -4.335
16 HH TYR 3 HH TYR 3 -2.688 -0.477 -5.548
17 HA PRO 4 HA PRO 4 2.562 -2.899 2.023
18 HB2 PRO 4 HB2 PRO 4 4.166 -5.040 1.561
19 HB3 PRO 4 HB1 PRO 4 3.050 -4.953 2.928
20 HG2 PRO 4 HG2 PRO 4 2.717 -6.338 0.295
21 HG3 PRO 4 HG1 PRO 4 2.308 -6.914 1.922
22 HD2 PRO 4 HD2 PRO 4 0.453 -5.916 0.221
23 HD3 PRO 4 HD1 PRO 4 0.333 -5.727 1.982
24 H VAL 5 H VAL 5 4.350 -1.928 1.128
25 HA VAL 5 HA VAL 5 4.974 -2.494 -1.683
26 HB VAL 5 HB VAL 5 5.203 -0.015 -2.074
27 HG11 VAL 5 HG11 VAL 5 2.511 -1.249 -1.546
28 HG12 VAL 5 HG12 VAL 5 2.707 0.330 -2.311
29 HG13 VAL 5 HG13 VAL 5 3.368 -1.114 -3.081
30 HG21 VAL 5 HG21 VAL 5 3.678 0.096 0.524
31 HG22 VAL 5 HG22 VAL 5 5.267 0.783 0.190
32 HG23 VAL 5 HG23 VAL 5 3.836 1.450 -0.596
33 HA PRO 6 HA PRO 6 9.176 -2.186 -0.450
34 HB2 PRO 6 HB2 PRO 6 10.325 -1.211 -2.707
35 HB3 PRO 6 HB1 PRO 6 9.726 -2.868 -2.573
36 HG2 PRO 6 HG2 PRO 6 8.422 -0.480 -3.821
37 HG3 PRO 6 HG1 PRO 6 8.510 -2.147 -4.419
38 HD2 PRO 6 HD2 PRO 6 6.310 -1.152 -3.192
39 HD3 PRO 6 HD1 PRO 6 6.788 -2.858 -3.061
40 H TYR 7 H TYR 7 8.131 0.688 -2.291
41 HA TYR 7 HA TYR 7 9.994 2.380 -0.875
42 HB2 TYR 7 HB2 TYR 7 9.112 4.177 -2.272
43 HB3 TYR 7 HB1 TYR 7 9.494 2.768 -3.257
44 HD1 TYR 7 HD2 TYR 7 6.755 4.760 -1.803
45 HD2 TYR 7 HD1 TYR 7 7.785 1.590 -4.448
46 HE1 TYR 7 HE2 TYR 7 4.471 4.788 -2.716
47 HE2 TYR 7 HE1 TYR 7 5.505 1.611 -5.369
48 HH TYR 7 HH TYR 7 2.939 3.162 -3.893
49 HA PRO 8 HA PRO 8 7.310 3.501 2.435
50 HB2 PRO 8 HB2 PRO 8 8.505 5.830 3.154
51 HB3 PRO 8 HB1 PRO 8 9.202 4.244 3.507
52 HG2 PRO 8 HG2 PRO 8 9.861 6.155 1.299
53 HG3 PRO 8 HG1 PRO 8 10.956 5.203 2.319
54 HD2 PRO 8 HD2 PRO 8 10.299 4.460 -0.201
55 HD3 PRO 8 HD1 PRO 8 10.641 3.283 1.083
56 HA PRO 9 HA PRO 9 6.070 4.453 3.896
57 HB2 PRO 9 HB2 PRO 9 3.375 4.150 4.002
58 HB3 PRO 9 HB1 PRO 9 4.193 5.641 4.483
59 HG2 PRO 9 HG2 PRO 9 2.813 4.983 1.910
60 HG3 PRO 9 HG1 PRO 9 2.748 6.475 2.864
61 HD2 PRO 9 HD2 PRO 9 4.294 6.226 0.655
62 HD3 PRO 9 HD1 PRO 9 4.757 7.242 2.035
63 H PHE 10 H PHE 10 5.668 2.295 4.464
64 HA PHE 10 HA PHE 10 5.700 0.450 2.273
65 HB2 PHE 10 HB2 PHE 10 5.579 -0.056 5.253
66 HB3 PHE 10 HB1 PHE 10 5.895 -1.278 4.026
67 HD1 PHE 10 HD2 PHE 10 7.692 0.371 2.252
68 HD2 PHE 10 HD1 PHE 10 7.581 -0.161 6.474
69 HE1 PHE 10 HE2 PHE 10 10.099 0.870 2.375
70 HE2 PHE 10 HE1 PHE 10 9.987 0.338 6.604
71 HZ PHE 10 HZ PHE 10 11.249 0.853 4.553
72 H PHE 11 H PHE 11 3.231 2.011 3.829
73 HA PHE 11 HA PHE 11 1.332 -0.170 3.261
74 HB2 PHE 11 HB2 PHE 11 -0.179 1.109 4.891
75 HB3 PHE 11 HB1 PHE 11 1.180 0.226 5.580
76 HD1 PHE 11 HD2 PHE 11 3.164 1.439 6.382
77 HD2 PHE 11 HD1 PHE 11 -0.312 3.479 5.016
78 HE1 PHE 11 HE2 PHE 11 3.946 3.498 7.477
79 HE2 PHE 11 HE1 PHE 11 0.465 5.542 6.108
80 HZ PHE 11 HZ PHE 11 2.596 5.553 7.342
81 H THR 12 H THR 12 0.218 0.174 1.468
82 HA THR 12 HA THR 12 -0.584 2.933 0.814
83 HB THR 12 HB THR 12 1.156 2.201 -0.744
84 HG1 THR 12 HG1 THR 12 -0.079 2.566 -2.658
85 HG21 THR 12 HG21 THR 12 0.479 0.347 -2.379
86 HG22 THR 12 HG22 THR 12 -0.702 -0.126 -1.157
87 HG23 THR 12 HG23 THR 12 1.019 -0.145 -0.773
88 H CYS 13 H CYS 13 -2.630 3.228 -0.071
89 HA CYS 13 HA CYS 13 -4.380 0.859 -0.082
90 HB2 CYS 13 HB2 CYS 13 -5.055 3.615 0.971
91 HB3 CYS 13 HB1 CYS 13 -6.184 2.269 0.845
92 H ASP 14 H ASP 14 -6.494 1.335 -1.247
93 HA ASP 14 HA ASP 14 -5.898 2.892 -3.676
94 HB2 ASP 14 HB2 ASP 14 -6.160 0.405 -3.945
95 HB3 ASP 14 HB1 ASP 14 -7.833 0.584 -3.426
96 HA PRO 15 HA PRO 15 -9.372 5.115 -1.608
97 HB2 PRO 15 HB2 PRO 15 -8.482 7.587 -2.293
98 HB3 PRO 15 HB1 PRO 15 -7.923 6.730 -0.850
99 HG2 PRO 15 HG2 PRO 15 -6.609 6.991 -3.527
100 HG3 PRO 15 HG1 PRO 15 -5.889 7.109 -1.913
101 HD2 PRO 15 HD2 PRO 15 -5.708 4.873 -3.429
102 HD3 PRO 15 HD1 PRO 15 -5.782 4.820 -1.656
103 H ASN 16 H ASN 16 -11.174 6.007 -2.563
104 HA ASN 16 HA ASN 16 -11.336 5.745 -5.448
105 HB2 ASN 16 HB2 ASN 16 -13.098 4.901 -3.794
106 HB3 ASN 16 HB1 ASN 16 -13.566 6.587 -3.601
107 HD21 ASN 16 HD21 ASN 16 -15.199 4.489 -4.593
108 HD22 ASN 16 HD22 ASN 16 -15.618 4.881 -6.222
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -9.445 -3.078 1.254
2 HA2 GLY 1 HA2 GLY 1 -7.993 -3.477 -0.632
3 HA3 GLY 1 HA1 GLY 1 -8.603 -1.837 -0.794
4 H CYS 2 H CYS 2 -6.301 -2.774 1.669
5 HA CYS 2 HA CYS 2 -4.309 -1.052 0.358
6 HB2 CYS 2 HB2 CYS 2 -4.377 -1.905 3.256
7 HB3 CYS 2 HB1 CYS 2 -3.360 -0.662 2.536
8 H TYR 3 H TYR 3 -2.194 -1.731 0.097
9 HA TYR 3 HA TYR 3 -1.541 -4.486 0.844
10 HB2 TYR 3 HB2 TYR 3 -0.484 -4.700 -1.497
11 HB3 TYR 3 HB1 TYR 3 -2.231 -4.871 -1.364
12 HD1 TYR 3 HD2 TYR 3 -3.715 -3.053 -2.132
13 HD2 TYR 3 HD1 TYR 3 0.498 -2.876 -2.700
14 HE1 TYR 3 HE2 TYR 3 -4.021 -1.276 -3.805
15 HE2 TYR 3 HE1 TYR 3 0.204 -1.099 -4.375
16 HH TYR 3 HH TYR 3 -2.422 -0.468 -5.944
17 HA PRO 4 HA PRO 4 2.421 -2.895 1.859
18 HB2 PRO 4 HB2 PRO 4 4.030 -4.997 1.258
19 HB3 PRO 4 HB1 PRO 4 2.938 -4.990 2.647
20 HG2 PRO 4 HG2 PRO 4 2.566 -6.239 -0.046
21 HG3 PRO 4 HG1 PRO 4 2.190 -6.902 1.555
22 HD2 PRO 4 HD2 PRO 4 0.298 -5.830 -0.058
23 HD3 PRO 4 HD1 PRO 4 0.209 -5.733 1.713
24 H VAL 5 H VAL 5 4.218 -1.901 0.990
25 HA VAL 5 HA VAL 5 4.761 -2.292 -1.868
26 HB VAL 5 HB VAL 5 5.018 0.203 -2.105
27 HG11 VAL 5 HG11 VAL 5 2.587 0.605 -2.364
28 HG12 VAL 5 HG12 VAL 5 3.119 -0.920 -3.071
29 HG13 VAL 5 HG13 VAL 5 2.278 -0.911 -1.521
30 HG21 VAL 5 HG21 VAL 5 3.406 0.271 0.442
31 HG22 VAL 5 HG22 VAL 5 5.117 0.681 0.325
32 HG23 VAL 5 HG23 VAL 5 3.918 1.654 -0.525
33 HA PRO 6 HA PRO 6 8.998 -2.125 -0.730
34 HB2 PRO 6 HB2 PRO 6 10.103 -1.023 -2.952
35 HB3 PRO 6 HB1 PRO 6 9.483 -2.677 -2.907
36 HG2 PRO 6 HG2 PRO 6 8.185 -0.195 -3.964
37 HG3 PRO 6 HG1 PRO 6 8.230 -1.822 -4.669
38 HD2 PRO 6 HD2 PRO 6 6.079 -0.877 -3.323
39 HD3 PRO 6 HD1 PRO 6 6.533 -2.593 -3.314
40 H TYR 7 H TYR 7 7.956 0.875 -2.360
41 HA TYR 7 HA TYR 7 9.867 2.439 -0.849
42 HB2 TYR 7 HB2 TYR 7 9.168 4.297 -2.192
43 HB3 TYR 7 HB1 TYR 7 9.306 2.901 -3.255
44 HD1 TYR 7 HD1 TYR 7 7.299 1.842 -4.183
45 HD2 TYR 7 HD2 TYR 7 7.031 5.319 -1.746
46 HE1 TYR 7 HE1 TYR 7 4.991 2.197 -4.953
47 HE2 TYR 7 HE2 TYR 7 4.722 5.683 -2.509
48 HH TYR 7 HH TYR 7 2.938 4.650 -3.537
49 HA PRO 8 HA PRO 8 7.175 3.459 2.485
50 HB2 PRO 8 HB2 PRO 8 8.395 5.737 3.318
51 HB3 PRO 8 HB1 PRO 8 9.067 4.127 3.603
52 HG2 PRO 8 HG2 PRO 8 9.769 6.127 1.489
53 HG3 PRO 8 HG1 PRO 8 10.843 5.115 2.472
54 HD2 PRO 8 HD2 PRO 8 10.196 4.496 -0.083
55 HD3 PRO 8 HD1 PRO 8 10.513 3.258 1.147
56 HA PRO 9 HA PRO 9 5.977 4.410 4.010
57 HB2 PRO 9 HB2 PRO 9 3.277 4.163 4.140
58 HB3 PRO 9 HB1 PRO 9 4.133 5.622 4.652
59 HG2 PRO 9 HG2 PRO 9 2.710 5.066 2.078
60 HG3 PRO 9 HG1 PRO 9 2.688 6.533 3.074
61 HD2 PRO 9 HD2 PRO 9 4.204 6.311 0.841
62 HD3 PRO 9 HD1 PRO 9 4.705 7.279 2.242
63 H PHE 10 H PHE 10 5.611 2.244 4.498
64 HA PHE 10 HA PHE 10 5.555 0.464 2.267
65 HB2 PHE 10 HB2 PHE 10 5.447 -0.126 5.233
66 HB3 PHE 10 HB1 PHE 10 5.730 -1.316 3.968
67 HD1 PHE 10 HD1 PHE 10 7.545 0.352 2.229
68 HD2 PHE 10 HD2 PHE 10 7.457 -0.307 6.433
69 HE1 PHE 10 HE1 PHE 10 9.960 0.803 2.346
70 HE2 PHE 10 HE2 PHE 10 9.873 0.144 6.557
71 HZ PHE 10 HZ PHE 10 11.127 0.699 4.512
72 H PHE 11 H PHE 11 3.133 2.003 3.946
73 HA PHE 11 HA PHE 11 1.192 -0.138 3.388
74 HB2 PHE 11 HB2 PHE 11 -0.300 1.257 4.948
75 HB3 PHE 11 HB1 PHE 11 1.027 0.363 5.682
76 HD1 PHE 11 HD1 PHE 11 3.029 1.537 6.471
77 HD2 PHE 11 HD2 PHE 11 -0.343 3.641 4.948
78 HE1 PHE 11 HE1 PHE 11 3.871 3.615 7.485
79 HE2 PHE 11 HE2 PHE 11 0.494 5.722 5.960
80 HZ PHE 11 HZ PHE 11 2.603 5.712 7.229
81 H THR 12 H THR 12 0.084 0.140 1.579
82 HA THR 12 HA THR 12 -0.645 2.883 0.781
83 HB THR 12 HB THR 12 -0.637 1.964 -1.601
84 HG1 THR 12 HG1 THR 12 -0.457 -0.263 -0.987
85 HG21 THR 12 HG21 THR 12 2.010 2.128 -0.154
86 HG22 THR 12 HG22 THR 12 1.074 3.508 -0.730
87 HG23 THR 12 HG23 THR 12 1.750 2.357 -1.883
88 H CYS 13 H CYS 13 -2.701 3.215 -0.022
89 HA CYS 13 HA CYS 13 -4.515 0.899 -0.020
90 HB2 CYS 13 HB2 CYS 13 -5.099 3.616 1.179
91 HB3 CYS 13 HB1 CYS 13 -6.243 2.283 1.058
92 H ASP 14 H ASP 14 -6.569 1.329 -1.178
93 HA ASP 14 HA ASP 14 -6.128 2.208 -3.778
94 HB2 ASP 14 HB2 ASP 14 -8.720 2.307 -3.843
95 HB3 ASP 14 HB1 ASP 14 -7.940 0.759 -3.529
96 HA PRO 15 HA PRO 15 -6.576 6.571 -3.787
97 HB2 PRO 15 HB2 PRO 15 -7.899 6.996 -6.119
98 HB3 PRO 15 HB1 PRO 15 -6.204 6.499 -6.054
99 HG2 PRO 15 HG2 PRO 15 -8.648 4.839 -6.534
100 HG3 PRO 15 HG1 PRO 15 -7.079 4.785 -7.359
101 HD2 PRO 15 HD2 PRO 15 -7.773 3.014 -5.432
102 HD3 PRO 15 HD1 PRO 15 -6.098 3.545 -5.682
103 H ASN 16 H ASN 16 -9.587 4.945 -4.796
104 HA ASN 16 HA ASN 16 -11.226 7.108 -3.849
105 HB2 ASN 16 HB2 ASN 16 -11.796 5.594 -5.796
106 HB3 ASN 16 HB1 ASN 16 -12.133 4.330 -4.617
107 HD21 ASN 16 HD21 ASN 16 -13.917 4.529 -3.260
108 HD22 ASN 16 HD22 ASN 16 -15.204 5.632 -3.600
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -8.363 -0.959 1.139
2 HA2 GLY 1 HA2 GLY 1 -7.780 -3.015 -0.827
3 HA3 GLY 1 HA1 GLY 1 -8.227 -1.451 -1.493
4 H CYS 2 H CYS 2 -6.187 -2.480 1.244
5 HA CYS 2 HA CYS 2 -4.044 -0.786 0.136
6 HB2 CYS 2 HB2 CYS 2 -4.472 -1.562 3.028
7 HB3 CYS 2 HB1 CYS 2 -3.249 -0.457 2.409
8 H TYR 3 H TYR 3 -1.987 -1.594 -0.025
9 HA TYR 3 HA TYR 3 -1.496 -4.333 0.890
10 HB2 TYR 3 HB2 TYR 3 -0.360 -4.741 -1.375
11 HB3 TYR 3 HB1 TYR 3 -2.119 -4.778 -1.335
12 HD1 TYR 3 HD2 TYR 3 -3.413 -2.853 -2.234
13 HD2 TYR 3 HD1 TYR 3 0.814 -3.109 -2.652
14 HE1 TYR 3 HE2 TYR 3 -3.492 -1.153 -4.009
15 HE2 TYR 3 HE1 TYR 3 0.746 -1.408 -4.428
16 HH TYR 3 HH TYR 3 -0.947 -0.548 -6.091
17 HA PRO 4 HA PRO 4 2.483 -2.864 2.013
18 HB2 PRO 4 HB2 PRO 4 4.017 -5.065 1.604
19 HB3 PRO 4 HB1 PRO 4 2.864 -4.933 2.937
20 HG2 PRO 4 HG2 PRO 4 2.558 -6.312 0.297
21 HG3 PRO 4 HG1 PRO 4 2.078 -6.866 1.912
22 HD2 PRO 4 HD2 PRO 4 0.315 -5.803 0.154
23 HD3 PRO 4 HD1 PRO 4 0.149 -5.605 1.910
24 H VAL 5 H VAL 5 4.335 -1.969 1.172
25 HA VAL 5 HA VAL 5 5.014 -2.561 -1.621
26 HB VAL 5 HB VAL 5 5.359 -0.102 -2.012
27 HG11 VAL 5 HG11 VAL 5 2.983 0.360 -2.442
28 HG12 VAL 5 HG12 VAL 5 3.442 -1.268 -2.943
29 HG13 VAL 5 HG13 VAL 5 2.543 -1.026 -1.445
30 HG21 VAL 5 HG21 VAL 5 3.789 0.106 0.554
31 HG22 VAL 5 HG22 VAL 5 5.433 0.680 0.266
32 HG23 VAL 5 HG23 VAL 5 4.074 1.444 -0.559
33 HA PRO 6 HA PRO 6 9.191 -2.446 -0.273
34 HB2 PRO 6 HB2 PRO 6 10.444 -1.518 -2.495
35 HB3 PRO 6 HB1 PRO 6 9.769 -3.148 -2.383
36 HG2 PRO 6 HG2 PRO 6 8.608 -0.700 -3.657
37 HG3 PRO 6 HG1 PRO 6 8.636 -2.368 -4.258
38 HD2 PRO 6 HD2 PRO 6 6.451 -1.278 -3.090
39 HD3 PRO 6 HD1 PRO 6 6.848 -3.003 -2.950
40 H TYR 7 H TYR 7 8.325 0.477 -2.132
41 HA TYR 7 HA TYR 7 10.224 2.080 -0.662
42 HB2 TYR 7 HB2 TYR 7 9.525 3.899 -2.091
43 HB3 TYR 7 HB1 TYR 7 9.747 2.457 -3.078
44 HD1 TYR 7 HD2 TYR 7 7.257 4.738 -1.609
45 HD2 TYR 7 HD1 TYR 7 7.901 1.443 -4.224
46 HE1 TYR 7 HE2 TYR 7 4.975 4.998 -2.491
47 HE2 TYR 7 HE1 TYR 7 5.622 1.695 -5.112
48 HH TYR 7 HH TYR 7 3.250 3.314 -3.659
49 HA PRO 8 HA PRO 8 7.508 3.306 2.585
50 HB2 PRO 8 HB2 PRO 8 8.794 5.570 3.352
51 HB3 PRO 8 HB1 PRO 8 9.404 3.951 3.712
52 HG2 PRO 8 HG2 PRO 8 10.214 5.839 1.535
53 HG3 PRO 8 HG1 PRO 8 11.233 4.830 2.578
54 HD2 PRO 8 HD2 PRO 8 10.610 4.135 0.037
55 HD3 PRO 8 HD1 PRO 8 10.861 2.935 1.321
56 HA PRO 9 HA PRO 9 6.263 4.291 4.009
57 HB2 PRO 9 HB2 PRO 9 3.554 4.110 4.022
58 HB3 PRO 9 HB1 PRO 9 4.423 5.556 4.549
59 HG2 PRO 9 HG2 PRO 9 3.101 4.992 1.923
60 HG3 PRO 9 HG1 PRO 9 3.072 6.474 2.894
61 HD2 PRO 9 HD2 PRO 9 4.678 6.179 0.734
62 HD3 PRO 9 HD1 PRO 9 5.140 7.159 2.141
63 H PHE 10 H PHE 10 5.712 2.150 4.544
64 HA PHE 10 HA PHE 10 5.739 0.330 2.325
65 HB2 PHE 10 HB2 PHE 10 5.513 -0.209 5.294
66 HB3 PHE 10 HB1 PHE 10 5.814 -1.425 4.056
67 HD1 PHE 10 HD1 PHE 10 7.723 0.206 2.367
68 HD2 PHE 10 HD2 PHE 10 7.479 -0.449 6.566
69 HE1 PHE 10 HE1 PHE 10 10.143 0.602 2.566
70 HE2 PHE 10 HE2 PHE 10 9.898 -0.053 6.772
71 HZ PHE 10 HZ PHE 10 11.233 0.475 4.771
72 H PHE 11 H PHE 11 3.302 2.004 3.774
73 HA PHE 11 HA PHE 11 1.323 -0.096 3.175
74 HB2 PHE 11 HB2 PHE 11 -0.181 1.270 4.738
75 HB3 PHE 11 HB1 PHE 11 1.115 0.341 5.483
76 HD1 PHE 11 HD1 PHE 11 3.124 1.477 6.333
77 HD2 PHE 11 HD2 PHE 11 -0.215 3.645 4.826
78 HE1 PHE 11 HE1 PHE 11 3.960 3.518 7.426
79 HE2 PHE 11 HE2 PHE 11 0.616 5.689 5.916
80 HZ PHE 11 HZ PHE 11 2.706 5.627 7.218
81 H THR 12 H THR 12 0.273 0.274 1.349
82 HA THR 12 HA THR 12 -0.250 3.067 0.563
83 HB THR 12 HB THR 12 1.323 1.778 -0.936
84 HG1 THR 12 HG1 THR 12 0.483 2.802 -2.668
85 HG21 THR 12 HG21 THR 12 0.760 -0.197 -1.815
86 HG22 THR 12 HG22 THR 12 -0.800 0.419 -2.361
87 HG23 THR 12 HG23 THR 12 -0.622 -0.202 -0.720
88 H CYS 13 H CYS 13 -2.259 3.554 -0.388
89 HA CYS 13 HA CYS 13 -4.314 1.472 -0.314
90 HB2 CYS 13 HB2 CYS 13 -4.538 4.138 1.098
91 HB3 CYS 13 HB1 CYS 13 -5.866 3.002 0.878
92 H ASP 14 H ASP 14 -5.883 1.688 -1.841
93 HA ASP 14 HA ASP 14 -5.707 4.060 -3.582
94 HB2 ASP 14 HB2 ASP 14 -4.883 1.926 -4.608
95 HB3 ASP 14 HB1 ASP 14 -6.507 1.270 -4.425
96 HA PRO 15 HA PRO 15 -9.958 4.014 -1.796
97 HB2 PRO 15 HB2 PRO 15 -10.124 6.714 -1.572
98 HB3 PRO 15 HB1 PRO 15 -9.386 5.691 -0.335
99 HG2 PRO 15 HG2 PRO 15 -8.074 7.302 -2.490
100 HG3 PRO 15 HG1 PRO 15 -7.611 7.124 -0.788
101 HD2 PRO 15 HD2 PRO 15 -6.385 5.763 -2.782
102 HD3 PRO 15 HD1 PRO 15 -6.584 5.092 -1.150
103 H ASN 16 H ASN 16 -11.925 5.124 -2.608
104 HA ASN 16 HA ASN 16 -11.670 5.993 -5.406
105 HB2 ASN 16 HB2 ASN 16 -12.474 3.548 -5.017
106 HB3 ASN 16 HB1 ASN 16 -13.986 4.299 -4.516
107 HD21 ASN 16 HD21 ASN 16 -15.428 4.388 -6.062
108 HD22 ASN 16 HD22 ASN 16 -15.111 4.584 -7.750