Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
627579 | 6cgx RC | 30412 | 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 -6.558 1.879 -3.925
2 HA2 GLY 1 HA1 GLY 1 -6.880 2.548 -1.149
3 HA3 GLY 1 HA2 GLY 1 -7.933 1.501 -2.120
4 H CYS 2 H CYS 2 -4.370 1.856 -1.931
5 HA CYS 2 HA CYS 2 -4.026 -1.020 -2.034
6 HB3 CYS 2 HB2 CYS 2 -1.593 -0.133 -1.239
7 H CYS 3 H CYS 3 -3.737 1.468 0.511
8 HA CYS 3 HA CYS 3 -2.794 -0.248 2.563
9 HB3 CYS 3 HB2 CYS 3 -4.198 1.542 4.001
10 H SER 4 H SER 4 -6.039 0.360 1.314
11 HA SER 4 HA SER 4 -7.381 -1.009 3.493
12 HB3 SER 4 HB2 SER 4 -8.740 -0.856 0.851
13 HG SER 4 HG SER 4 -10.338 0.118 2.210
14 H ASP 5 H ASP 5 -6.082 -1.909 0.337
15 HA ASP 5 HA ASP 5 -7.262 -4.603 0.520
16 HB3 ASP 5 HB2 ASP 5 -5.171 -3.889 -1.512
17 HA PRO 6 HA PRO 6 -3.839 -6.390 2.665
18 HB3 PRO 6 HB2 PRO 6 -5.282 -8.109 3.188
19 HG3 PRO 6 HG2 PRO 6 -6.939 -8.791 1.693
20 HD3 PRO 6 HD2 PRO 6 -7.320 -6.510 1.706
21 H ARG 7 H ARG 7 -4.424 -6.936 -0.770
22 HA ARG 7 HA ARG 7 -2.071 -8.378 -1.400
23 HB3 ARG 7 HB2 ARG 7 -3.707 -6.386 -3.001
24 HG3 ARG 7 HG2 ARG 7 -1.509 -6.459 -4.031
25 HD3 ARG 7 HD2 ARG 7 -0.546 -8.468 -3.217
26 HE ARG 7 HE ARG 7 -2.031 -10.201 -2.863
27 HH11 ARG 7 HH11 ARG 7 -2.285 -9.046 -6.190
28 HH12 ARG 7 HH12 ARG 7 -3.365 -10.352 -6.688
29 HH21 ARG 7 HH21 ARG 7 -3.425 -11.882 -3.514
30 HH22 ARG 7 HH22 ARG 7 -4.010 -11.951 -5.179
31 H CYS 8 H CYS 8 -2.659 -4.838 -1.563
32 HA CYS 8 HA CYS 8 0.074 -4.222 -2.200
33 HB3 CYS 8 HB2 CYS 8 -0.708 -1.885 -1.266
34 H ASN 9 H ASN 9 -1.687 -4.705 0.804
35 HA ASN 9 HA ASN 9 0.265 -3.470 2.521
36 HB3 ASN 9 HB2 ASN 9 -1.444 -5.768 3.451
37 HD21 ASN 9 HD21 ASN 9 -0.954 -2.247 3.859
38 HD22 ASN 9 HD22 ASN 9 -0.655 -2.337 5.630
39 H TYR 10 H TYR 10 -0.348 -6.869 1.570
40 HA TYR 10 HA TYR 10 1.955 -7.837 3.050
41 HB3 TYR 10 HB2 TYR 10 0.415 -9.216 0.820
42 HD1 TYR 10 HD1 TYR 10 1.551 -10.195 4.235
43 HD2 TYR 10 HD2 TYR 10 1.899 -10.846 0.046
44 HE1 TYR 10 HE1 TYR 10 2.945 -12.174 4.666
45 HE2 TYR 10 HE2 TYR 10 3.294 -12.829 0.464
46 HH TYR 10 HH TYR 10 4.045 -14.266 2.010
47 H ALA 11 H ALA 11 1.314 -6.750 -0.233
48 HA ALA 11 HA ALA 11 3.809 -7.791 -1.309
49 HB1 ALA 11 HB1 ALA 11 1.698 -7.310 -2.624
50 HB2 ALA 11 HB2 ALA 11 2.107 -5.583 -2.484
51 HB3 ALA 11 HB3 ALA 11 3.211 -6.694 -3.329
52 H HIS 12 H HIS 12 2.652 -4.666 -0.063
53 HA HIS 12 HA HIS 12 5.491 -3.719 -0.176
54 HB3 HIS 12 HB2 HIS 12 4.857 -1.581 -0.751
55 HD2 HIS 12 HD2 HIS 12 1.567 -1.139 -1.936
56 HE1 HIS 12 HE1 HIS 12 3.066 -3.917 -4.768
57 HE2 HIS 12 HE2 HIS 12 1.228 -2.225 -4.281
58 HA PRO 13 HA PRO 13 3.952 -3.945 4.252
59 HB3 PRO 13 HB2 PRO 13 4.582 -6.149 4.499
60 HG3 PRO 13 HG2 PRO 13 6.195 -7.105 3.108
61 HD3 PRO 13 HD2 PRO 13 4.810 -6.149 1.521
62 H ALA 14 H ALA 14 7.165 -3.427 2.808
63 HA ALA 14 HA ALA 14 8.411 -2.129 4.976
64 HB1 ALA 14 HB1 ALA 14 9.708 -0.910 3.122
65 HB2 ALA 14 HB2 ALA 14 9.771 -2.689 3.148
66 HB3 ALA 14 HB3 ALA 14 8.713 -1.853 1.986
67 H ILE 15 H ILE 15 6.405 -0.748 2.352
68 HA ILE 15 HA ILE 15 5.598 1.424 4.149
69 HB ILE 15 HB ILE 15 6.200 3.159 2.331
70 HG13 ILE 15 HG12 ILE 15 6.955 1.164 0.793
71 HG21 ILE 15 HG21 ILE 15 7.299 2.585 4.682
72 HG22 ILE 15 HG22 ILE 15 8.687 2.160 3.650
73 HG23 ILE 15 HG23 ILE 15 8.000 3.802 3.588
74 HD11 ILE 15 HD11 ILE 15 8.938 3.421 0.925
75 HD12 ILE 15 HD12 ILE 15 8.311 2.549 -0.496
76 HD13 ILE 15 HD13 ILE 15 7.264 3.685 0.385
77 H CYS 16 H CYS 16 3.539 1.914 3.795
78 HA CYS 16 HA CYS 16 2.164 0.680 1.541
79 HB3 CYS 16 HB2 CYS 16 1.077 2.658 3.579
80 H GLY 17 H GLY 17 3.820 2.079 0.167
81 HA2 GLY 17 HA1 GLY 17 3.074 4.848 -0.243
82 HA3 GLY 17 HA2 GLY 17 4.109 3.863 -1.295
83 H GLY 18 H GLY 18 2.143 1.766 -1.735
84 HA2 GLY 18 HA1 GLY 18 0.941 2.732 -4.084
85 HA3 GLY 18 HA2 GLY 18 0.401 1.300 -3.189
86 H ALA 19 H ALA 19 -0.138 3.021 -0.771
87 HA ALA 19 HA ALA 19 -2.905 3.388 -1.175
88 HB1 ALA 19 HB1 ALA 19 -2.758 3.577 1.036
89 HB2 ALA 19 HB2 ALA 19 -0.996 3.818 0.927
90 HB3 ALA 19 HB3 ALA 19 -2.093 5.216 0.831
91 H ALA 20 H ALA 20 -0.189 5.569 -1.727
92 HA ALA 20 HA ALA 20 -1.564 8.022 -1.885
93 HB1 ALA 20 HB1 ALA 20 0.934 7.608 -2.008
94 HB2 ALA 20 HB2 ALA 20 0.697 7.222 -3.729
95 HB3 ALA 20 HB3 ALA 20 0.292 8.844 -3.115
96 H GLY 21 H GLY 21 -1.041 5.539 -4.409
97 HA2 GLY 21 HA1 GLY 21 -2.409 7.056 -6.456
98 HA3 GLY 21 HA2 GLY 21 -2.003 5.330 -6.513
99 H GLY 22 H GLY 22 -3.393 4.366 -4.307
100 HA2 GLY 22 HA1 GLY 22 -6.156 5.285 -4.413
101 HA3 GLY 22 HA2 GLY 22 -5.898 3.795 -5.341
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -6.441 1.940 -3.946
2 HA2 GLY 1 HA1 GLY 1 -6.887 2.525 -1.168
3 HA3 GLY 1 HA2 GLY 1 -7.892 1.503 -2.213
4 H CYS 2 H CYS 2 -4.337 1.845 -1.957
5 HA CYS 2 HA CYS 2 -4.006 -1.032 -2.059
6 HB3 CYS 2 HB2 CYS 2 -1.574 -0.158 -1.250
7 H CYS 3 H CYS 3 -3.723 1.454 0.489
8 HA CYS 3 HA CYS 3 -2.795 -0.264 2.546
9 HB3 CYS 3 HB2 CYS 3 -4.204 1.528 3.976
10 H SER 4 H SER 4 -6.031 0.349 1.276
11 HA SER 4 HA SER 4 -7.392 -1.013 3.447
12 HB3 SER 4 HB2 SER 4 -8.772 -0.908 0.833
13 HG SER 4 HG SER 4 -10.309 0.190 2.167
14 H ASP 5 H ASP 5 -6.070 -1.926 0.305
15 HA ASP 5 HA ASP 5 -7.251 -4.619 0.494
16 HB3 ASP 5 HB2 ASP 5 -5.154 -3.912 -1.534
17 HA PRO 6 HA PRO 6 -3.835 -6.393 2.660
18 HB3 PRO 6 HB2 PRO 6 -5.279 -8.111 3.187
19 HG3 PRO 6 HG2 PRO 6 -6.930 -8.801 1.691
20 HD3 PRO 6 HD2 PRO 6 -7.311 -6.520 1.690
21 H ARG 7 H ARG 7 -4.409 -6.958 -0.774
22 HA ARG 7 HA ARG 7 -2.054 -8.403 -1.390
23 HB3 ARG 7 HB2 ARG 7 -3.683 -6.418 -3.005
24 HG3 ARG 7 HG2 ARG 7 -1.481 -6.496 -4.026
25 HD3 ARG 7 HD2 ARG 7 -0.525 -8.505 -3.200
26 HE ARG 7 HE ARG 7 -1.982 -10.256 -2.859
27 HH11 ARG 7 HH11 ARG 7 -2.327 -9.034 -6.154
28 HH12 ARG 7 HH12 ARG 7 -3.432 -10.323 -6.645
29 HH21 ARG 7 HH21 ARG 7 -3.409 -11.915 -3.500
30 HH22 ARG 7 HH22 ARG 7 -4.043 -11.945 -5.149
31 H CYS 8 H CYS 8 -2.640 -4.864 -1.572
32 HA CYS 8 HA CYS 8 0.092 -4.248 -2.206
33 HB3 CYS 8 HB2 CYS 8 -0.695 -1.909 -1.268
34 H ASN 9 H ASN 9 -1.668 -4.725 0.798
35 HA ASN 9 HA ASN 9 0.283 -3.488 2.513
36 HB3 ASN 9 HB2 ASN 9 -0.965 -5.459 4.041
37 HD21 ASN 9 HD21 ASN 9 0.168 -3.396 4.920
38 HD22 ASN 9 HD22 ASN 9 -0.967 -2.083 5.393
39 H TYR 10 H TYR 10 -0.333 -6.889 1.571
40 HA TYR 10 HA TYR 10 1.969 -7.855 3.054
41 HB3 TYR 10 HB2 TYR 10 0.441 -9.245 0.823
42 HD1 TYR 10 HD1 TYR 10 1.297 -10.354 4.251
43 HD2 TYR 10 HD2 TYR 10 2.156 -10.726 0.100
44 HE1 TYR 10 HE1 TYR 10 2.677 -12.335 4.720
45 HE2 TYR 10 HE2 TYR 10 3.539 -12.710 0.558
46 HH TYR 10 HH TYR 10 4.136 -14.231 2.091
47 H ALA 11 H ALA 11 1.328 -6.777 -0.233
48 HA ALA 11 HA ALA 11 3.822 -7.825 -1.306
49 HB1 ALA 11 HB1 ALA 11 2.125 -5.618 -2.488
50 HB2 ALA 11 HB2 ALA 11 3.223 -6.737 -3.330
51 HB3 ALA 11 HB3 ALA 11 1.708 -7.343 -2.620
52 H HIS 12 H HIS 12 2.667 -4.691 -0.077
53 HA HIS 12 HA HIS 12 5.506 -3.750 -0.187
54 HB3 HIS 12 HB2 HIS 12 4.878 -1.615 -0.777
55 HD2 HIS 12 HD2 HIS 12 1.591 -1.170 -1.971
56 HE1 HIS 12 HE1 HIS 12 3.087 -3.973 -4.783
57 HE2 HIS 12 HE2 HIS 12 1.254 -2.270 -4.309
58 HA PRO 13 HA PRO 13 3.954 -3.947 4.238
59 HB3 PRO 13 HB2 PRO 13 4.576 -6.151 4.497
60 HG3 PRO 13 HG2 PRO 13 6.191 -7.119 3.119
61 HD3 PRO 13 HD2 PRO 13 4.814 -6.169 1.523
62 H ALA 14 H ALA 14 7.163 -3.434 2.789
63 HA ALA 14 HA ALA 14 8.416 -2.134 4.953
64 HB1 ALA 14 HB1 ALA 14 9.512 -0.814 2.882
65 HB2 ALA 14 HB2 ALA 14 9.924 -2.497 3.295
66 HB3 ALA 14 HB3 ALA 14 8.749 -2.159 2.001
67 H ILE 15 H ILE 15 6.405 -0.753 2.334
68 HA ILE 15 HA ILE 15 5.599 1.416 4.133
69 HB ILE 15 HB ILE 15 6.201 3.152 2.314
70 HG13 ILE 15 HG12 ILE 15 6.947 1.195 0.756
71 HG21 ILE 15 HG21 ILE 15 7.247 2.719 4.657
72 HG22 ILE 15 HG22 ILE 15 8.621 2.065 3.732
73 HG23 ILE 15 HG23 ILE 15 8.111 3.754 3.494
74 HD11 ILE 15 HD11 ILE 15 7.710 3.892 0.860
75 HD12 ILE 15 HD12 ILE 15 9.205 2.973 0.559
76 HD13 ILE 15 HD13 ILE 15 7.806 2.783 -0.526
77 H CYS 16 H CYS 16 3.539 1.906 3.781
78 HA CYS 16 HA CYS 16 2.167 0.675 1.524
79 HB3 CYS 16 HB2 CYS 16 1.075 2.646 3.568
80 H GLY 17 H GLY 17 3.821 2.085 0.156
81 HA2 GLY 17 HA1 GLY 17 3.069 4.854 -0.245
82 HA3 GLY 17 HA2 GLY 17 4.108 3.875 -1.297
83 H GLY 18 H GLY 18 2.151 1.776 -1.752
84 HA2 GLY 18 HA1 GLY 18 0.948 2.748 -4.098
85 HA3 GLY 18 HA2 GLY 18 0.410 1.310 -3.208
86 H ALA 19 H ALA 19 -0.139 3.015 -0.784
87 HA ALA 19 HA ALA 19 -2.906 3.382 -1.193
88 HB1 ALA 19 HB1 ALA 19 -1.002 3.805 0.915
89 HB2 ALA 19 HB2 ALA 19 -2.109 5.196 0.829
90 HB3 ALA 19 HB3 ALA 19 -2.760 3.550 1.019
91 H ALA 20 H ALA 20 -0.191 5.570 -1.721
92 HA ALA 20 HA ALA 20 -1.568 8.023 -1.866
93 HB1 ALA 20 HB1 ALA 20 0.969 7.448 -2.064
94 HB2 ALA 20 HB2 ALA 20 0.633 7.379 -3.810
95 HB3 ALA 20 HB3 ALA 20 0.321 8.879 -2.903
96 H GLY 21 H GLY 21 -1.137 5.487 -4.338
97 HA2 GLY 21 HA1 GLY 21 -2.407 7.018 -6.439
98 HA3 GLY 21 HA2 GLY 21 -2.101 5.270 -6.441
99 H GLY 22 H GLY 22 -3.553 4.419 -4.252
100 HA2 GLY 22 HA1 GLY 22 -6.260 5.505 -4.389
101 HA3 GLY 22 HA2 GLY 22 -6.083 3.976 -5.268
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -6.459 2.061 -3.888
2 HA2 GLY 1 HA1 GLY 1 -6.876 2.641 -1.104
3 HA3 GLY 1 HA2 GLY 1 -7.898 1.632 -2.144
4 H CYS 2 H CYS 2 -4.340 1.945 -1.901
5 HA CYS 2 HA CYS 2 -4.030 -0.933 -2.028
6 HB3 CYS 2 HB2 CYS 2 -1.589 -0.084 -1.218
7 H CYS 3 H CYS 3 -3.723 1.529 0.539
8 HA CYS 3 HA CYS 3 -2.804 -0.213 2.581
9 HB3 CYS 3 HB2 CYS 3 -4.197 1.578 4.028
10 H SER 4 H SER 4 -6.038 0.434 1.324
11 HA SER 4 HA SER 4 -7.404 -0.936 3.486
12 HB3 SER 4 HB2 SER 4 -8.141 0.288 0.866
13 HG SER 4 HG SER 4 -10.231 -0.698 0.981
14 H ASP 5 H ASP 5 -6.095 -1.832 0.335
15 HA ASP 5 HA ASP 5 -7.294 -4.520 0.503
16 HB3 ASP 5 HB2 ASP 5 -5.197 -3.810 -1.524
17 HA PRO 6 HA PRO 6 -3.885 -6.334 2.646
18 HB3 PRO 6 HB2 PRO 6 -5.340 -8.048 3.164
19 HG3 PRO 6 HG2 PRO 6 -6.999 -8.713 1.664
20 HD3 PRO 6 HD2 PRO 6 -7.366 -6.430 1.683
21 H ARG 7 H ARG 7 -4.473 -6.875 -0.790
22 HA ARG 7 HA ARG 7 -2.127 -8.327 -1.423
23 HB3 ARG 7 HB2 ARG 7 -3.629 -6.260 -3.074
24 HG3 ARG 7 HG2 ARG 7 -1.196 -7.475 -3.713
25 HD3 ARG 7 HD2 ARG 7 -2.094 -8.746 -5.815
26 HE ARG 7 HE ARG 7 -1.126 -9.697 -3.407
27 HH11 ARG 7 HH11 ARG 7 -3.524 -10.775 -5.764
28 HH12 ARG 7 HH12 ARG 7 -3.260 -12.491 -5.428
29 HH21 ARG 7 HH21 ARG 7 -0.791 -11.911 -2.980
30 HH22 ARG 7 HH22 ARG 7 -1.718 -13.131 -3.860
31 H CYS 8 H CYS 8 -2.692 -4.782 -1.577
32 HA CYS 8 HA CYS 8 0.043 -4.179 -2.213
33 HB3 CYS 8 HB2 CYS 8 -0.730 -1.843 -1.249
34 H ASN 9 H ASN 9 -1.712 -4.672 0.793
35 HA ASN 9 HA ASN 9 0.252 -3.460 2.512
36 HB3 ASN 9 HB2 ASN 9 -1.407 -5.747 3.502
37 HD21 ASN 9 HD21 ASN 9 -1.173 -2.185 3.708
38 HD22 ASN 9 HD22 ASN 9 -0.871 -2.150 5.480
39 H TYR 10 H TYR 10 -0.388 -6.848 1.545
40 HA TYR 10 HA TYR 10 1.915 -7.840 3.010
41 HB3 TYR 10 HB2 TYR 10 0.336 -9.187 0.786
42 HD1 TYR 10 HD1 TYR 10 1.566 -10.965 -0.023
43 HD2 TYR 10 HD2 TYR 10 1.777 -10.070 4.130
44 HE1 TYR 10 HE1 TYR 10 2.962 -12.960 0.328
45 HE2 TYR 10 HE2 TYR 10 3.175 -12.062 4.493
46 HH TYR 10 HH TYR 10 4.316 -13.719 3.534
47 H ALA 11 H ALA 11 1.268 -6.731 -0.265
48 HA ALA 11 HA ALA 11 3.753 -7.784 -1.356
49 HB1 ALA 11 HB1 ALA 11 2.065 -5.556 -2.512
50 HB2 ALA 11 HB2 ALA 11 3.154 -6.675 -3.367
51 HB3 ALA 11 HB3 ALA 11 1.636 -7.279 -2.658
52 H HIS 12 H HIS 12 2.621 -4.655 -0.097
53 HA HIS 12 HA HIS 12 5.467 -3.730 -0.207
54 HB3 HIS 12 HB2 HIS 12 4.851 -1.586 -0.778
55 HD2 HIS 12 HD2 HIS 12 1.569 -1.107 -1.964
56 HE1 HIS 12 HE1 HIS 12 3.036 -3.902 -4.798
57 HE2 HIS 12 HE2 HIS 12 1.219 -2.188 -4.310
58 HA PRO 13 HA PRO 13 3.923 -3.952 4.220
59 HB3 PRO 13 HB2 PRO 13 4.531 -6.162 4.461
60 HG3 PRO 13 HG2 PRO 13 6.135 -7.131 3.071
61 HD3 PRO 13 HD2 PRO 13 4.762 -6.158 1.485
62 H ALA 14 H ALA 14 7.132 -3.449 2.767
63 HA ALA 14 HA ALA 14 8.401 -2.177 4.938
64 HB1 ALA 14 HB1 ALA 14 9.093 -0.907 2.424
65 HB2 ALA 14 HB2 ALA 14 10.062 -1.979 3.465
66 HB3 ALA 14 HB3 ALA 14 8.971 -2.674 2.243
67 H ILE 15 H ILE 15 6.392 -0.759 2.335
68 HA ILE 15 HA ILE 15 5.605 1.401 4.156
69 HB ILE 15 HB ILE 15 6.214 3.148 2.352
70 HG13 ILE 15 HG12 ILE 15 7.017 1.041 0.883
71 HG21 ILE 15 HG21 ILE 15 7.249 2.754 4.675
72 HG22 ILE 15 HG22 ILE 15 8.594 1.989 3.798
73 HG23 ILE 15 HG23 ILE 15 8.190 3.695 3.493
74 HD11 ILE 15 HD11 ILE 15 7.493 2.629 -0.586
75 HD12 ILE 15 HD12 ILE 15 7.392 3.835 0.720
76 HD13 ILE 15 HD13 ILE 15 8.953 3.077 0.325
77 H CYS 16 H CYS 16 3.550 1.906 3.813
78 HA CYS 16 HA CYS 16 2.161 0.706 1.549
79 HB3 CYS 16 HB2 CYS 16 1.089 2.664 3.615
80 H GLY 17 H GLY 17 3.822 2.116 0.190
81 HA2 GLY 17 HA1 GLY 17 3.087 4.892 -0.184
82 HA3 GLY 17 HA2 GLY 17 4.115 3.917 -1.249
83 H GLY 18 H GLY 18 2.145 1.835 -1.718
84 HA2 GLY 18 HA1 GLY 18 0.941 2.835 -4.050
85 HA3 GLY 18 HA2 GLY 18 0.396 1.394 -3.172
86 H ALA 19 H ALA 19 -0.137 3.079 -0.732
87 HA ALA 19 HA ALA 19 -2.901 3.469 -1.133
88 HB1 ALA 19 HB1 ALA 19 -0.987 3.862 0.976
89 HB2 ALA 19 HB2 ALA 19 -2.093 5.254 0.909
90 HB3 ALA 19 HB3 ALA 19 -2.747 3.608 1.083
91 H ALA 20 H ALA 20 -0.172 5.641 -1.644
92 HA ALA 20 HA ALA 20 -1.528 8.105 -1.761
93 HB1 ALA 20 HB1 ALA 20 0.808 8.197 -1.834
94 HB2 ALA 20 HB2 ALA 20 0.906 7.041 -3.185
95 HB3 ALA 20 HB3 ALA 20 0.310 8.694 -3.469
96 H GLY 21 H GLY 21 -1.122 5.597 -4.264
97 HA2 GLY 21 HA1 GLY 21 -2.392 7.158 -6.340
98 HA3 GLY 21 HA2 GLY 21 -2.095 5.410 -6.365
99 H GLY 22 H GLY 22 -3.541 4.509 -4.214
100 HA2 GLY 22 HA1 GLY 22 -6.247 5.617 -4.328
101 HA3 GLY 22 HA2 GLY 22 -6.072 4.089 -5.209
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -6.379 2.151 -4.012
2 HA2 GLY 1 HA1 GLY 1 -6.870 2.676 -1.230
3 HA3 GLY 1 HA2 GLY 1 -7.859 1.681 -2.314
4 H CYS 2 H CYS 2 -4.309 2.009 -1.992
5 HA CYS 2 HA CYS 2 -3.980 -0.865 -2.153
6 HB3 CYS 2 HB2 CYS 2 -1.559 -0.014 -1.285
7 H CYS 3 H CYS 3 -3.734 1.562 0.454
8 HA CYS 3 HA CYS 3 -2.844 -0.204 2.489
9 HB3 CYS 3 HB2 CYS 3 -4.273 1.561 3.934
10 H SER 4 H SER 4 -6.057 0.445 1.178
11 HA SER 4 HA SER 4 -7.456 -0.962 3.296
12 HB3 SER 4 HB2 SER 4 -8.752 -0.758 0.629
13 HG SER 4 HG SER 4 -10.375 0.205 1.966
14 H ASP 5 H ASP 5 -6.084 -1.806 0.157
15 HA ASP 5 HA ASP 5 -7.273 -4.502 0.266
16 HB3 ASP 5 HB2 ASP 5 -5.142 -3.754 -1.711
17 HA PRO 6 HA PRO 6 -3.896 -6.330 2.446
18 HB3 PRO 6 HB2 PRO 6 -5.351 -8.058 2.912
19 HG3 PRO 6 HG2 PRO 6 -6.979 -8.710 1.371
20 HD3 PRO 6 HD2 PRO 6 -7.357 -6.429 1.416
21 H ARG 7 H ARG 7 -4.415 -6.818 -1.009
22 HA ARG 7 HA ARG 7 -2.052 -8.253 -1.617
23 HB3 ARG 7 HB2 ARG 7 -2.821 -6.193 -3.591
24 HG3 ARG 7 HG2 ARG 7 -1.541 -8.306 -4.085
25 HD3 ARG 7 HD2 ARG 7 -3.521 -10.127 -4.601
26 HE ARG 7 HE ARG 7 -1.389 -9.961 -2.625
27 HH11 ARG 7 HH11 ARG 7 -4.121 -11.854 -3.815
28 HH12 ARG 7 HH12 ARG 7 -3.491 -13.382 -3.189
29 HH21 ARG 7 HH21 ARG 7 -0.582 -11.935 -1.820
30 HH22 ARG 7 HH22 ARG 7 -1.497 -13.427 -2.062
31 H CYS 8 H CYS 8 -2.630 -4.709 -1.730
32 HA CYS 8 HA CYS 8 0.114 -4.084 -2.307
33 HB3 CYS 8 HB2 CYS 8 -0.686 -1.767 -1.327
34 H ASN 9 H ASN 9 -1.697 -4.626 0.657
35 HA ASN 9 HA ASN 9 0.230 -3.432 2.432
36 HB3 ASN 9 HB2 ASN 9 -1.665 -5.708 3.108
37 HD21 ASN 9 HD21 ASN 9 -0.730 -2.430 4.189
38 HD22 ASN 9 HD22 ASN 9 -0.391 -2.918 5.886
39 H TYR 10 H TYR 10 -0.379 -6.809 1.404
40 HA TYR 10 HA TYR 10 1.897 -7.815 2.901
41 HB3 TYR 10 HB2 TYR 10 0.193 -9.049 0.705
42 HD1 TYR 10 HD1 TYR 10 0.922 -10.987 -0.298
43 HD2 TYR 10 HD2 TYR 10 2.562 -9.923 3.481
44 HE1 TYR 10 HE1 TYR 10 2.403 -12.947 -0.395
45 HE2 TYR 10 HE2 TYR 10 4.048 -11.881 3.394
46 HH TYR 10 HH TYR 10 4.852 -13.535 2.113
47 H ALA 11 H ALA 11 1.313 -6.661 -0.372
48 HA ALA 11 HA ALA 11 3.823 -7.690 -1.426
49 HB1 ALA 11 HB1 ALA 11 3.261 -6.559 -3.433
50 HB2 ALA 11 HB2 ALA 11 1.730 -7.173 -2.763
51 HB3 ALA 11 HB3 ALA 11 2.151 -5.453 -2.588
52 H HIS 12 H HIS 12 2.653 -4.583 -0.146
53 HA HIS 12 HA HIS 12 5.495 -3.644 -0.187
54 HB3 HIS 12 HB2 HIS 12 4.881 -1.496 -0.741
55 HD2 HIS 12 HD2 HIS 12 1.616 -1.017 -1.977
56 HE1 HIS 12 HE1 HIS 12 3.151 -3.759 -4.828
57 HE2 HIS 12 HE2 HIS 12 1.315 -2.062 -4.346
58 HA PRO 13 HA PRO 13 3.868 -3.938 4.206
59 HB3 PRO 13 HB2 PRO 13 4.482 -6.149 4.426
60 HG3 PRO 13 HG2 PRO 13 6.117 -7.089 3.054
61 HD3 PRO 13 HD2 PRO 13 4.769 -6.101 1.456
62 H ALA 14 H ALA 14 7.102 -3.399 2.823
63 HA ALA 14 HA ALA 14 8.321 -2.152 5.036
64 HB1 ALA 14 HB1 ALA 14 8.669 -1.614 2.073
65 HB2 ALA 14 HB2 ALA 14 9.755 -1.007 3.348
66 HB3 ALA 14 HB3 ALA 14 9.589 -2.761 3.077
67 H ILE 15 H ILE 15 6.357 -0.708 2.416
68 HA ILE 15 HA ILE 15 5.526 1.423 4.250
69 HB ILE 15 HB ILE 15 6.160 3.198 2.480
70 HG13 ILE 15 HG12 ILE 15 6.967 1.182 0.950
71 HG21 ILE 15 HG21 ILE 15 7.931 3.813 3.788
72 HG22 ILE 15 HG22 ILE 15 7.218 2.567 4.838
73 HG23 ILE 15 HG23 ILE 15 8.624 2.173 3.820
74 HD11 ILE 15 HD11 ILE 15 7.091 3.399 0.099
75 HD12 ILE 15 HD12 ILE 15 8.425 3.816 1.204
76 HD13 ILE 15 HD13 ILE 15 8.693 2.654 -0.117
77 H CYS 16 H CYS 16 3.473 1.925 3.874
78 HA CYS 16 HA CYS 16 2.135 0.749 1.567
79 HB3 CYS 16 HB2 CYS 16 1.014 2.674 3.638
80 H GLY 17 H GLY 17 3.816 2.185 0.261
81 HA2 GLY 17 HA1 GLY 17 3.074 4.964 -0.090
82 HA3 GLY 17 HA2 GLY 17 4.129 4.009 -1.149
83 H GLY 18 H GLY 18 2.175 1.923 -1.680
84 HA2 GLY 18 HA1 GLY 18 1.013 2.950 -4.024
85 HA3 GLY 18 HA2 GLY 18 0.458 1.494 -3.176
86 H ALA 19 H ALA 19 -0.127 3.146 -0.723
87 HA ALA 19 HA ALA 19 -2.887 3.526 -1.170
88 HB1 ALA 19 HB1 ALA 19 -2.777 3.646 1.047
89 HB2 ALA 19 HB2 ALA 19 -1.016 3.898 0.978
90 HB3 ALA 19 HB3 ALA 19 -2.120 5.293 0.905
91 H ALA 20 H ALA 20 -0.160 5.721 -1.604
92 HA ALA 20 HA ALA 20 -1.531 8.178 -1.718
93 HB1 ALA 20 HB1 ALA 20 0.611 7.790 -3.727
94 HB2 ALA 20 HB2 ALA 20 0.428 9.028 -2.459
95 HB3 ALA 20 HB3 ALA 20 1.043 7.411 -2.042
96 H GLY 21 H GLY 21 -1.064 5.697 -4.236
97 HA2 GLY 21 HA1 GLY 21 -2.295 7.274 -6.325
98 HA3 GLY 21 HA2 GLY 21 -1.994 5.528 -6.360
99 H GLY 22 H GLY 22 -3.482 4.631 -4.216
100 HA2 GLY 22 HA1 GLY 22 -6.186 5.726 -4.374
101 HA3 GLY 22 HA2 GLY 22 -5.997 4.216 -5.283
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -6.519 2.051 -3.855
2 HA2 GLY 1 HA1 GLY 1 -6.921 2.651 -1.073
3 HA3 GLY 1 HA2 GLY 1 -7.955 1.644 -2.104
4 H CYS 2 H CYS 2 -4.392 1.927 -1.893
5 HA CYS 2 HA CYS 2 -4.111 -0.955 -1.990
6 HB3 CYS 2 HB2 CYS 2 -1.654 -0.121 -1.216
7 H CYS 3 H CYS 3 -3.752 1.532 0.545
8 HA CYS 3 HA CYS 3 -2.830 -0.198 2.596
9 HB3 CYS 3 HB2 CYS 3 -4.189 1.624 4.038
10 H SER 4 H SER 4 -6.070 0.468 1.366
11 HA SER 4 HA SER 4 -7.425 -0.864 3.558
12 HB3 SER 4 HB2 SER 4 -8.854 -0.756 0.978
13 HG SER 4 HG SER 4 -10.326 0.414 2.322
14 H ASP 5 H ASP 5 -6.159 -1.807 0.403
15 HA ASP 5 HA ASP 5 -7.384 -4.480 0.613
16 HB3 ASP 5 HB2 ASP 5 -5.302 -3.814 -1.444
17 HA PRO 6 HA PRO 6 -3.972 -6.307 2.740
18 HB3 PRO 6 HB2 PRO 6 -5.438 -7.999 3.290
19 HG3 PRO 6 HG2 PRO 6 -7.120 -8.664 1.816
20 HD3 PRO 6 HD2 PRO 6 -7.462 -6.377 1.815
21 H ARG 7 H ARG 7 -4.599 -6.872 -0.685
22 HA ARG 7 HA ARG 7 -2.277 -8.356 -1.326
23 HB3 ARG 7 HB2 ARG 7 -3.050 -6.347 -3.340
24 HG3 ARG 7 HG2 ARG 7 -3.710 -8.516 -4.560
25 HD3 ARG 7 HD2 ARG 7 -1.223 -7.230 -4.112
26 HE ARG 7 HE ARG 7 0.089 -8.964 -3.348
27 HH11 ARG 7 HH11 ARG 7 -2.272 -10.178 -5.675
28 HH12 ARG 7 HH12 ARG 7 -1.577 -11.804 -5.715
29 HH21 ARG 7 HH21 ARG 7 0.979 -11.062 -3.404
30 HH22 ARG 7 HH22 ARG 7 0.255 -12.301 -4.434
31 H CYS 8 H CYS 8 -2.805 -4.808 -1.512
32 HA CYS 8 HA CYS 8 -0.070 -4.242 -2.181
33 HB3 CYS 8 HB2 CYS 8 -0.805 -1.887 -1.242
34 H ASN 9 H ASN 9 -1.801 -4.681 0.846
35 HA ASN 9 HA ASN 9 0.193 -3.472 2.533
36 HB3 ASN 9 HB2 ASN 9 -1.079 -5.432 4.070
37 HD21 ASN 9 HD21 ASN 9 0.231 -3.183 4.619
38 HD22 ASN 9 HD22 ASN 9 -0.892 -1.936 5.261
39 H TYR 10 H TYR 10 -0.494 -6.864 1.610
40 HA TYR 10 HA TYR 10 1.810 -7.866 3.066
41 HB3 TYR 10 HB2 TYR 10 0.118 -9.177 0.902
42 HD1 TYR 10 HD1 TYR 10 0.637 -11.347 0.259
43 HD2 TYR 10 HD2 TYR 10 2.476 -9.751 3.746
44 HE1 TYR 10 HE1 TYR 10 2.053 -13.350 0.419
45 HE2 TYR 10 HE2 TYR 10 3.898 -11.748 3.919
46 HH TYR 10 HH TYR 10 4.445 -13.709 3.051
47 H ALA 11 H ALA 11 1.147 -6.785 -0.217
48 HA ALA 11 HA ALA 11 3.609 -7.878 -1.317
49 HB1 ALA 11 HB1 ALA 11 3.005 -6.787 -3.335
50 HB2 ALA 11 HB2 ALA 11 1.488 -7.364 -2.605
51 HB3 ALA 11 HB3 ALA 11 1.935 -5.645 -2.484
52 H HIS 12 H HIS 12 2.523 -4.723 -0.081
53 HA HIS 12 HA HIS 12 5.377 -3.829 -0.229
54 HB3 HIS 12 HB2 HIS 12 4.777 -1.685 -0.817
55 HD2 HIS 12 HD2 HIS 12 1.484 -1.189 -1.969
56 HE1 HIS 12 HE1 HIS 12 2.895 -4.021 -4.795
57 HE2 HIS 12 HE2 HIS 12 1.098 -2.287 -4.301
58 HA PRO 13 HA PRO 13 3.877 -3.991 4.215
59 HB3 PRO 13 HB2 PRO 13 4.465 -6.205 4.473
60 HG3 PRO 13 HG2 PRO 13 6.045 -7.203 3.077
61 HD3 PRO 13 HD2 PRO 13 4.664 -6.233 1.495
62 H ALA 14 H ALA 14 7.076 -3.536 2.726
63 HA ALA 14 HA ALA 14 8.377 -2.253 4.871
64 HB1 ALA 14 HB1 ALA 14 10.030 -1.988 3.387
65 HB2 ALA 14 HB2 ALA 14 8.974 -2.842 2.238
66 HB3 ALA 14 HB3 ALA 14 8.999 -1.062 2.270
67 H ILE 15 H ILE 15 6.358 -0.844 2.271
68 HA ILE 15 HA ILE 15 5.611 1.344 4.073
69 HB ILE 15 HB ILE 15 6.220 3.065 2.242
70 HG13 ILE 15 HG12 ILE 15 6.931 1.045 0.711
71 HG21 ILE 15 HG21 ILE 15 7.310 2.548 4.581
72 HG22 ILE 15 HG22 ILE 15 8.674 1.985 3.586
73 HG23 ILE 15 HG23 ILE 15 8.098 3.662 3.438
74 HD11 ILE 15 HD11 ILE 15 7.643 3.767 0.725
75 HD12 ILE 15 HD12 ILE 15 9.133 2.857 0.372
76 HD13 ILE 15 HD13 ILE 15 7.687 2.627 -0.640
77 H CYS 16 H CYS 16 3.556 1.868 3.745
78 HA CYS 16 HA CYS 16 2.134 0.654 1.510
79 HB3 CYS 16 HB2 CYS 16 1.104 2.649 3.561
80 H GLY 17 H GLY 17 3.797 2.030 0.117
81 HA2 GLY 17 HA1 GLY 17 3.087 4.810 -0.284
82 HA3 GLY 17 HA2 GLY 17 4.095 3.811 -1.346
83 H GLY 18 H GLY 18 2.097 1.745 -1.770
84 HA2 GLY 18 HA1 GLY 18 0.881 2.731 -4.103
85 HA3 GLY 18 HA2 GLY 18 0.331 1.305 -3.203
86 H ALA 19 H ALA 19 -0.159 3.027 -0.777
87 HA ALA 19 HA ALA 19 -2.924 3.439 -1.153
88 HB1 ALA 19 HB1 ALA 19 -2.071 5.246 0.852
89 HB2 ALA 19 HB2 ALA 19 -2.748 3.612 1.058
90 HB3 ALA 19 HB3 ALA 19 -0.986 3.837 0.930
91 H ALA 20 H ALA 20 -0.179 5.580 -1.721
92 HA ALA 20 HA ALA 20 -1.516 8.054 -1.859
93 HB1 ALA 20 HB1 ALA 20 0.840 7.014 -3.455
94 HB2 ALA 20 HB2 ALA 20 0.311 8.713 -3.442
95 HB3 ALA 20 HB3 ALA 20 0.880 7.948 -1.940
96 H GLY 21 H GLY 21 -1.161 5.504 -4.326
97 HA2 GLY 21 HA1 GLY 21 -2.429 7.048 -6.416
98 HA3 GLY 21 HA2 GLY 21 -2.155 5.295 -6.416
99 H GLY 22 H GLY 22 -3.592 4.480 -4.203
100 HA2 GLY 22 HA1 GLY 22 -6.283 5.612 -4.309
101 HA3 GLY 22 HA2 GLY 22 -6.143 4.077 -5.187
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -6.443 2.169 -3.921
2 HA2 GLY 1 HA1 GLY 1 -6.903 2.655 -1.127
3 HA3 GLY 1 HA2 GLY 1 -7.899 1.667 -2.211
4 H CYS 2 H CYS 2 -4.347 2.011 -1.930
5 HA CYS 2 HA CYS 2 -4.007 -0.860 -2.130
6 HB3 CYS 2 HB2 CYS 2 -1.580 -0.006 -1.282
7 H CYS 3 H CYS 3 -3.740 1.538 0.502
8 HA CYS 3 HA CYS 3 -2.815 -0.248 2.503
9 HB3 CYS 3 HB2 CYS 3 -4.234 1.490 3.990
10 H SER 4 H SER 4 -6.048 0.399 1.244
11 HA SER 4 HA SER 4 -7.412 -1.042 3.361
12 HB3 SER 4 HB2 SER 4 -8.751 -0.821 0.720
13 HG SER 4 HG SER 4 -10.349 0.139 2.088
14 H ASP 5 H ASP 5 -6.076 -1.841 0.195
15 HA ASP 5 HA ASP 5 -7.249 -4.544 0.284
16 HB3 ASP 5 HB2 ASP 5 -5.147 -3.760 -1.709
17 HA PRO 6 HA PRO 6 -3.834 -6.381 2.400
18 HB3 PRO 6 HB2 PRO 6 -5.275 -8.121 2.862
19 HG3 PRO 6 HG2 PRO 6 -6.919 -8.763 1.335
20 HD3 PRO 6 HD2 PRO 6 -7.308 -6.485 1.414
21 H ARG 7 H ARG 7 -4.395 -6.828 -1.054
22 HA ARG 7 HA ARG 7 -2.032 -8.242 -1.709
23 HB3 ARG 7 HB2 ARG 7 -2.866 -6.150 -3.634
24 HG3 ARG 7 HG2 ARG 7 -1.516 -8.218 -4.180
25 HD3 ARG 7 HD2 ARG 7 -3.746 -9.927 -4.679
26 HE ARG 7 HE ARG 7 -1.147 -10.147 -3.383
27 HH11 ARG 7 HH11 ARG 7 -4.234 -11.735 -4.024
28 HH12 ARG 7 HH12 ARG 7 -3.576 -13.363 -3.829
29 HH21 ARG 7 HH21 ARG 7 -0.304 -12.250 -3.133
30 HH22 ARG 7 HH22 ARG 7 -1.361 -13.653 -3.326
31 H CYS 8 H CYS 8 -2.630 -4.701 -1.772
32 HA CYS 8 HA CYS 8 0.103 -4.055 -2.373
33 HB3 CYS 8 HB2 CYS 8 -0.694 -1.753 -1.358
34 H ASN 9 H ASN 9 -1.668 -4.642 0.605
35 HA ASN 9 HA ASN 9 0.273 -3.460 2.371
36 HB3 ASN 9 HB2 ASN 9 -1.491 -5.783 3.156
37 HD21 ASN 9 HD21 ASN 9 -0.764 -2.352 3.870
38 HD22 ASN 9 HD22 ASN 9 -0.476 -2.617 5.625
39 H TYR 10 H TYR 10 -0.328 -6.827 1.309
40 HA TYR 10 HA TYR 10 1.972 -7.837 2.764
41 HB3 TYR 10 HB2 TYR 10 0.649 -9.254 0.445
42 HD1 TYR 10 HD1 TYR 10 0.341 -10.524 3.800
43 HD2 TYR 10 HD2 TYR 10 2.889 -10.432 0.396
44 HE1 TYR 10 HE1 TYR 10 1.537 -12.499 4.650
45 HE2 TYR 10 HE2 TYR 10 4.092 -12.407 1.235
46 HH TYR 10 HH TYR 10 4.270 -13.918 2.837
47 H ALA 11 H ALA 11 1.340 -6.648 -0.485
48 HA ALA 11 HA ALA 11 3.842 -7.650 -1.583
49 HB1 ALA 11 HB1 ALA 11 1.732 -7.130 -2.888
50 HB2 ALA 11 HB2 ALA 11 2.141 -5.408 -2.696
51 HB3 ALA 11 HB3 ALA 11 3.247 -6.495 -3.570
52 H HIS 12 H HIS 12 2.671 -4.564 -0.251
53 HA HIS 12 HA HIS 12 5.507 -3.610 -0.317
54 HB3 HIS 12 HB2 HIS 12 4.875 -1.457 -0.836
55 HD2 HIS 12 HD2 HIS 12 1.590 -0.984 -2.023
56 HE1 HIS 12 HE1 HIS 12 3.106 -3.680 -4.928
57 HE2 HIS 12 HE2 HIS 12 1.264 -2.002 -4.400
58 HA PRO 13 HA PRO 13 3.940 -3.967 4.092
59 HB3 PRO 13 HB2 PRO 13 4.568 -6.176 4.278
60 HG3 PRO 13 HG2 PRO 13 6.191 -7.092 2.873
61 HD3 PRO 13 HD2 PRO 13 4.817 -6.090 1.305
62 H ALA 14 H ALA 14 7.152 -3.394 2.677
63 HA ALA 14 HA ALA 14 8.392 -2.166 4.888
64 HB1 ALA 14 HB1 ALA 14 9.863 -1.084 3.264
65 HB2 ALA 14 HB2 ALA 14 9.559 -2.778 2.814
66 HB3 ALA 14 HB3 ALA 14 8.718 -1.466 1.955
67 H ILE 15 H ILE 15 6.389 -0.702 2.310
68 HA ILE 15 HA ILE 15 5.567 1.403 4.180
69 HB ILE 15 HB ILE 15 6.170 3.202 2.424
70 HG13 ILE 15 HG12 ILE 15 6.875 1.598 0.664
71 HG21 ILE 15 HG21 ILE 15 7.246 2.586 4.761
72 HG22 ILE 15 HG22 ILE 15 8.639 2.145 3.746
73 HG23 ILE 15 HG23 ILE 15 7.989 3.802 3.693
74 HD11 ILE 15 HD11 ILE 15 8.647 2.794 -0.183
75 HD12 ILE 15 HD12 ILE 15 7.953 3.958 0.973
76 HD13 ILE 15 HD13 ILE 15 9.400 3.019 1.413
77 H CYS 16 H CYS 16 3.509 1.896 3.836
78 HA CYS 16 HA CYS 16 2.147 0.742 1.534
79 HB3 CYS 16 HB2 CYS 16 1.042 2.636 3.640
80 H GLY 17 H GLY 17 3.803 2.202 0.221
81 HA2 GLY 17 HA1 GLY 17 3.044 4.980 -0.086
82 HA3 GLY 17 HA2 GLY 17 4.090 4.042 -1.169
83 H GLY 18 H GLY 18 2.141 1.953 -1.703
84 HA2 GLY 18 HA1 GLY 18 0.943 3.003 -4.018
85 HA3 GLY 18 HA2 GLY 18 0.407 1.533 -3.180
86 H ALA 19 H ALA 19 -0.156 3.153 -0.701
87 HA ALA 19 HA ALA 19 -2.922 3.526 -1.109
88 HB1 ALA 19 HB1 ALA 19 -1.027 3.881 1.020
89 HB2 ALA 19 HB2 ALA 19 -2.140 5.270 0.978
90 HB3 ALA 19 HB3 ALA 19 -2.785 3.617 1.108
91 H ALA 20 H ALA 20 -0.213 5.738 -1.550
92 HA ALA 20 HA ALA 20 -1.595 8.190 -1.617
93 HB1 ALA 20 HB1 ALA 20 0.375 9.032 -2.287
94 HB2 ALA 20 HB2 ALA 20 0.986 7.377 -2.055
95 HB3 ALA 20 HB3 ALA 20 0.489 7.925 -3.675
96 H GLY 21 H GLY 21 -1.151 5.741 -4.172
97 HA2 GLY 21 HA1 GLY 21 -2.417 7.340 -6.223
98 HA3 GLY 21 HA2 GLY 21 -2.108 5.595 -6.285
99 H GLY 22 H GLY 22 -3.563 4.667 -4.128
100 HA2 GLY 22 HA1 GLY 22 -6.273 5.749 -4.235
101 HA3 GLY 22 HA2 GLY 22 -6.089 4.252 -5.170
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -6.394 2.133 -3.930
2 HA2 GLY 1 HA1 GLY 1 -6.873 2.591 -1.134
3 HA3 GLY 1 HA2 GLY 1 -7.855 1.604 -2.232
4 H CYS 2 H CYS 2 -4.306 1.976 -1.929
5 HA CYS 2 HA CYS 2 -3.940 -0.889 -2.152
6 HB3 CYS 2 HB2 CYS 2 -1.527 -0.023 -1.282
7 H CYS 3 H CYS 3 -3.710 1.486 0.505
8 HA CYS 3 HA CYS 3 -2.782 -0.309 2.494
9 HB3 CYS 3 HB2 CYS 3 -4.224 1.403 3.987
10 H SER 4 H SER 4 -6.012 0.320 1.221
11 HA SER 4 HA SER 4 -7.376 -1.150 3.318
12 HB3 SER 4 HB2 SER 4 -8.593 -0.800 0.594
13 HG SER 4 HG SER 4 -10.370 -0.170 1.933
14 H ASP 5 H ASP 5 -6.015 -1.910 0.152
15 HA ASP 5 HA ASP 5 -7.164 -4.623 0.211
16 HB3 ASP 5 HB2 ASP 5 -5.059 -3.803 -1.764
17 HA PRO 6 HA PRO 6 -3.747 -6.449 2.330
18 HB3 PRO 6 HB2 PRO 6 -5.175 -8.205 2.768
19 HG3 PRO 6 HG2 PRO 6 -6.804 -8.849 1.226
20 HD3 PRO 6 HD2 PRO 6 -7.213 -6.575 1.323
21 H ARG 7 H ARG 7 -4.284 -6.870 -1.131
22 HA ARG 7 HA ARG 7 -1.906 -8.259 -1.786
23 HB3 ARG 7 HB2 ARG 7 -2.743 -6.157 -3.697
24 HG3 ARG 7 HG2 ARG 7 -1.424 -8.412 -4.062
25 HD3 ARG 7 HD2 ARG 7 -3.486 -9.828 -5.192
26 HE ARG 7 HE ARG 7 -1.668 -10.273 -3.038
27 HH11 ARG 7 HH11 ARG 7 -4.760 -11.398 -4.319
28 HH12 ARG 7 HH12 ARG 7 -4.578 -13.028 -3.660
29 HH21 ARG 7 HH21 ARG 7 -1.440 -12.378 -2.192
30 HH22 ARG 7 HH22 ARG 7 -2.707 -13.581 -2.461
31 H CYS 8 H CYS 8 -2.533 -4.721 -1.820
32 HA CYS 8 HA CYS 8 0.198 -4.047 -2.399
33 HB3 CYS 8 HB2 CYS 8 -0.627 -1.761 -1.369
34 H ASN 9 H ASN 9 -1.585 -4.676 0.563
35 HA ASN 9 HA ASN 9 0.337 -3.492 2.351
36 HB3 ASN 9 HB2 ASN 9 -1.073 -5.754 3.517
37 HD21 ASN 9 HD21 ASN 9 -1.966 -2.351 2.937
38 HD22 ASN 9 HD22 ASN 9 -1.765 -1.839 4.649
39 H TYR 10 H TYR 10 -0.231 -6.855 1.253
40 HA TYR 10 HA TYR 10 2.069 -7.860 2.715
41 HB3 TYR 10 HB2 TYR 10 0.811 -9.288 0.373
42 HD1 TYR 10 HD1 TYR 10 1.079 -9.946 4.037
43 HD2 TYR 10 HD2 TYR 10 2.332 -11.036 0.121
44 HE1 TYR 10 HE1 TYR 10 2.241 -11.907 4.962
45 HE2 TYR 10 HE2 TYR 10 3.496 -13.001 1.033
46 HH TYR 10 HH TYR 10 3.810 -14.290 2.840
47 H ALA 11 H ALA 11 1.446 -6.647 -0.528
48 HA ALA 11 HA ALA 11 3.963 -7.617 -1.621
49 HB1 ALA 11 HB1 ALA 11 1.855 -7.103 -2.932
50 HB2 ALA 11 HB2 ALA 11 2.250 -5.380 -2.724
51 HB3 ALA 11 HB3 ALA 11 3.370 -6.450 -3.601
52 H HIS 12 H HIS 12 2.758 -4.554 -0.266
53 HA HIS 12 HA HIS 12 5.586 -3.575 -0.308
54 HB3 HIS 12 HB2 HIS 12 4.937 -1.423 -0.811
55 HD2 HIS 12 HD2 HIS 12 1.657 -0.967 -2.013
56 HE1 HIS 12 HE1 HIS 12 3.211 -3.622 -4.933
57 HE2 HIS 12 HE2 HIS 12 1.354 -1.964 -4.401
58 HA PRO 13 HA PRO 13 3.996 -3.985 4.089
59 HB3 PRO 13 HB2 PRO 13 4.642 -6.191 4.258
60 HG3 PRO 13 HG2 PRO 13 6.282 -7.079 2.854
61 HD3 PRO 13 HD2 PRO 13 4.908 -6.076 1.288
62 H ALA 14 H ALA 14 7.212 -3.371 2.698
63 HA ALA 14 HA ALA 14 8.428 -2.154 4.927
64 HB1 ALA 14 HB1 ALA 14 9.140 -0.777 2.484
65 HB2 ALA 14 HB2 ALA 14 10.104 -1.894 3.482
66 HB3 ALA 14 HB3 ALA 14 9.032 -2.534 2.213
67 H ILE 15 H ILE 15 6.426 -0.683 2.351
68 HA ILE 15 HA ILE 15 5.578 1.397 4.235
69 HB ILE 15 HB ILE 15 6.174 3.217 2.499
70 HG13 ILE 15 HG12 ILE 15 6.904 1.621 0.735
71 HG21 ILE 15 HG21 ILE 15 7.964 3.825 3.796
72 HG22 ILE 15 HG22 ILE 15 7.248 2.573 4.837
73 HG23 ILE 15 HG23 ILE 15 8.653 2.184 3.815
74 HD11 ILE 15 HD11 ILE 15 8.190 3.216 -0.099
75 HD12 ILE 15 HD12 ILE 15 8.287 3.966 1.513
76 HD13 ILE 15 HD13 ILE 15 9.504 2.768 1.013
77 H CYS 16 H CYS 16 3.516 1.876 3.885
78 HA CYS 16 HA CYS 16 2.179 0.731 1.562
79 HB3 CYS 16 HB2 CYS 16 1.045 2.598 3.679
80 H GLY 17 H GLY 17 3.829 2.217 0.274
81 HA2 GLY 17 HA1 GLY 17 3.048 4.992 -0.013
82 HA3 GLY 17 HA2 GLY 17 4.108 4.074 -1.099
83 H GLY 18 H GLY 18 2.180 1.973 -1.662
84 HA2 GLY 18 HA1 GLY 18 0.986 3.032 -3.974
85 HA3 GLY 18 HA2 GLY 18 0.458 1.552 -3.155
86 H ALA 19 H ALA 19 -0.133 3.144 -0.664
87 HA ALA 19 HA ALA 19 -2.901 3.495 -1.083
88 HB1 ALA 19 HB1 ALA 19 -2.143 5.229 1.022
89 HB2 ALA 19 HB2 ALA 19 -2.778 3.571 1.137
90 HB3 ALA 19 HB3 ALA 19 -1.020 3.848 1.060
91 H ALA 20 H ALA 20 -0.209 5.736 -1.489
92 HA ALA 20 HA ALA 20 -1.613 8.174 -1.542
93 HB1 ALA 20 HB1 ALA 20 0.266 9.097 -2.564
94 HB2 ALA 20 HB2 ALA 20 0.925 7.675 -1.718
95 HB3 ALA 20 HB3 ALA 20 0.628 7.610 -3.473
96 H GLY 21 H GLY 21 -1.130 5.753 -4.116
97 HA2 GLY 21 HA1 GLY 21 -2.397 7.357 -6.162
98 HA3 GLY 21 HA2 GLY 21 -2.072 5.617 -6.235
99 H GLY 22 H GLY 22 -3.533 4.656 -4.099
100 HA2 GLY 22 HA1 GLY 22 -6.252 5.717 -4.214
101 HA3 GLY 22 HA2 GLY 22 -6.050 4.229 -5.158
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -6.619 1.932 -3.817
2 HA2 GLY 1 HA1 GLY 1 -6.959 2.593 -1.041
3 HA3 GLY 1 HA2 GLY 1 -8.023 1.575 -2.030
4 H CYS 2 H CYS 2 -4.454 1.831 -1.882
5 HA CYS 2 HA CYS 2 -4.199 -1.054 -1.935
6 HB3 CYS 2 HB2 CYS 2 -1.724 -0.228 -1.210
7 H CYS 3 H CYS 3 -3.783 1.471 0.553
8 HA CYS 3 HA CYS 3 -2.843 -0.231 2.619
9 HB3 CYS 3 HB2 CYS 3 -4.168 1.624 4.051
10 H SER 4 H SER 4 -6.096 0.440 1.424
11 HA SER 4 HA SER 4 -7.430 -0.845 3.658
12 HB3 SER 4 HB2 SER 4 -8.847 -0.731 1.052
13 HG SER 4 HG SER 4 -10.373 0.350 2.413
14 H ASP 5 H ASP 5 -6.217 -1.852 0.501
15 HA ASP 5 HA ASP 5 -7.457 -4.512 0.775
16 HB3 ASP 5 HB2 ASP 5 -5.401 -3.896 -1.323
17 HA PRO 6 HA PRO 6 -4.025 -6.327 2.883
18 HB3 PRO 6 HB2 PRO 6 -5.495 -7.998 3.484
19 HG3 PRO 6 HG2 PRO 6 -7.204 -8.676 2.046
20 HD3 PRO 6 HD2 PRO 6 -7.531 -6.387 2.011
21 H ARG 7 H ARG 7 -4.710 -6.951 -0.522
22 HA ARG 7 HA ARG 7 -2.407 -8.461 -1.172
23 HB3 ARG 7 HB2 ARG 7 -3.324 -6.417 -3.141
24 HG3 ARG 7 HG2 ARG 7 -3.751 -8.666 -4.409
25 HD3 ARG 7 HD2 ARG 7 -1.560 -6.911 -4.163
26 HE ARG 7 HE ARG 7 -0.584 -9.310 -3.240
27 HH11 ARG 7 HH11 ARG 7 -0.145 -7.421 -6.189
28 HH12 ARG 7 HH12 ARG 7 1.511 -7.983 -6.447
29 HH21 ARG 7 HH21 ARG 7 1.552 -10.031 -3.580
30 HH22 ARG 7 HH22 ARG 7 2.467 -9.455 -4.977
31 H CYS 8 H CYS 8 -2.914 -4.913 -1.410
32 HA CYS 8 HA CYS 8 -0.186 -4.377 -2.130
33 HB3 CYS 8 HB2 CYS 8 -0.893 -2.002 -1.213
34 H ASN 9 H ASN 9 -1.872 -4.754 0.930
35 HA ASN 9 HA ASN 9 0.155 -3.532 2.566
36 HB3 ASN 9 HB2 ASN 9 -1.373 -5.719 3.820
37 HD21 ASN 9 HD21 ASN 9 -1.315 -2.174 3.343
38 HD22 ASN 9 HD22 ASN 9 -1.159 -1.786 5.091
39 H TYR 10 H TYR 10 -0.567 -6.934 1.710
40 HA TYR 10 HA TYR 10 1.756 -7.925 3.145
41 HB3 TYR 10 HB2 TYR 10 0.077 -9.293 1.007
42 HD1 TYR 10 HD1 TYR 10 0.538 -11.528 0.538
43 HD2 TYR 10 HD2 TYR 10 2.359 -9.721 3.931
44 HE1 TYR 10 HE1 TYR 10 1.917 -13.539 0.861
45 HE2 TYR 10 HE2 TYR 10 3.744 -11.725 4.263
46 HH TYR 10 HH TYR 10 4.422 -13.671 3.380
47 H ALA 11 H ALA 11 1.045 -6.896 -0.142
48 HA ALA 11 HA ALA 11 3.482 -8.023 -1.264
49 HB1 ALA 11 HB1 ALA 11 2.852 -6.959 -3.290
50 HB2 ALA 11 HB2 ALA 11 1.343 -7.515 -2.527
51 HB3 ALA 11 HB3 ALA 11 1.804 -5.798 -2.441
52 H HIS 12 H HIS 12 2.436 -4.839 -0.066
53 HA HIS 12 HA HIS 12 5.293 -3.969 -0.272
54 HB3 HIS 12 HB2 HIS 12 4.701 -1.831 -0.888
55 HD2 HIS 12 HD2 HIS 12 1.398 -1.328 -2.005
56 HE1 HIS 12 HE1 HIS 12 2.745 -4.224 -4.797
57 HE2 HIS 12 HE2 HIS 12 0.970 -2.465 -4.310
58 HA PRO 13 HA PRO 13 3.859 -4.041 4.196
59 HB3 PRO 13 HB2 PRO 13 4.433 -6.254 4.484
60 HG3 PRO 13 HG2 PRO 13 5.986 -7.289 3.083
61 HD3 PRO 13 HD2 PRO 13 4.589 -6.338 1.506
62 H ALA 14 H ALA 14 7.038 -3.636 2.651
63 HA ALA 14 HA ALA 14 8.382 -2.328 4.754
64 HB1 ALA 14 HB1 ALA 14 8.976 -1.180 2.130
65 HB2 ALA 14 HB2 ALA 14 10.015 -2.108 3.239
66 HB3 ALA 14 HB3 ALA 14 8.927 -2.959 2.114
67 H ILE 15 H ILE 15 6.334 -0.947 2.163
68 HA ILE 15 HA ILE 15 5.630 1.277 3.940
69 HB ILE 15 HB ILE 15 6.223 2.962 2.073
70 HG13 ILE 15 HG12 ILE 15 6.824 1.236 0.385
71 HG21 ILE 15 HG21 ILE 15 7.319 2.570 4.388
72 HG22 ILE 15 HG22 ILE 15 8.642 1.826 3.459
73 HG23 ILE 15 HG23 ILE 15 8.201 3.526 3.173
74 HD11 ILE 15 HD11 ILE 15 7.846 3.517 0.261
75 HD12 ILE 15 HD12 ILE 15 9.272 2.856 1.098
76 HD13 ILE 15 HD13 ILE 15 8.803 2.222 -0.497
77 H CYS 16 H CYS 16 3.574 1.809 3.636
78 HA CYS 16 HA CYS 16 2.109 0.571 1.440
79 HB3 CYS 16 HB2 CYS 16 1.124 2.604 3.476
80 H GLY 17 H GLY 17 3.758 1.912 0.001
81 HA2 GLY 17 HA1 GLY 17 3.061 4.691 -0.433
82 HA3 GLY 17 HA2 GLY 17 4.047 3.669 -1.495
83 H GLY 18 H GLY 18 2.030 1.609 -1.856
84 HA2 GLY 18 HA1 GLY 18 0.784 2.567 -4.185
85 HA3 GLY 18 HA2 GLY 18 0.237 1.160 -3.253
86 H ALA 19 H ALA 19 -0.204 2.919 -0.849
87 HA ALA 19 HA ALA 19 -2.971 3.349 -1.190
88 HB1 ALA 19 HB1 ALA 19 -2.759 3.547 1.014
89 HB2 ALA 19 HB2 ALA 19 -0.998 3.767 0.859
90 HB3 ALA 19 HB3 ALA 19 -2.082 5.175 0.778
91 H ALA 20 H ALA 20 -0.219 5.457 -1.832
92 HA ALA 20 HA ALA 20 -1.537 7.941 -1.983
93 HB1 ALA 20 HB1 ALA 20 0.369 8.730 -2.976
94 HB2 ALA 20 HB2 ALA 20 0.993 7.204 -2.304
95 HB3 ALA 20 HB3 ALA 20 0.550 7.304 -4.026
96 H GLY 21 H GLY 21 -1.235 5.357 -4.424
97 HA2 GLY 21 HA1 GLY 21 -2.529 6.883 -6.512
98 HA3 GLY 21 HA2 GLY 21 -2.264 5.130 -6.494
99 H GLY 22 H GLY 22 -3.671 4.322 -4.276
100 HA2 GLY 22 HA1 GLY 22 -6.360 5.474 -4.356
101 HA3 GLY 22 HA2 GLY 22 -6.234 3.920 -5.202
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -5.686 2.221 -3.721
2 HA2 GLY 1 HA1 GLY 1 -5.888 2.951 -0.949
3 HA3 GLY 1 HA2 GLY 1 -7.024 1.947 -1.868
4 H CYS 2 H CYS 2 -3.448 2.083 -1.903
5 HA CYS 2 HA CYS 2 -3.291 -0.811 -1.880
6 HB3 CYS 2 HB2 CYS 2 -0.756 -0.066 -1.324
7 H CYS 3 H CYS 3 -3.042 1.754 0.528
8 HA CYS 3 HA CYS 3 -1.828 0.262 2.612
9 HB3 CYS 3 HB2 CYS 3 -3.340 1.911 4.057
10 H SER 4 H SER 4 -5.202 0.488 1.539
11 HA SER 4 HA SER 4 -6.106 -1.200 3.776
12 HB3 SER 4 HB2 SER 4 -8.148 -0.979 1.813
13 HG SER 4 HG SER 4 -9.043 0.443 3.402
14 H ASP 5 H ASP 5 -5.790 -1.420 0.222
15 HA ASP 5 HA ASP 5 -6.845 -3.985 -0.151
16 HB3 ASP 5 HB2 ASP 5 -4.472 -2.686 -1.545
17 HA PRO 6 HA PRO 6 -4.132 -6.701 2.031
18 HB3 PRO 6 HB2 PRO 6 -5.854 -8.230 1.930
19 HG3 PRO 6 HG2 PRO 6 -7.280 -8.319 0.084
20 HD3 PRO 6 HD2 PRO 6 -7.362 -6.055 0.550
21 H ARG 7 H ARG 7 -4.315 -7.164 -1.528
22 HA ARG 7 HA ARG 7 -1.869 -8.501 -1.859
23 HB3 ARG 7 HB2 ARG 7 -2.240 -6.653 -4.037
24 HG3 ARG 7 HG2 ARG 7 -1.439 -8.978 -4.260
25 HD3 ARG 7 HD2 ARG 7 -3.850 -10.403 -4.464
26 HE ARG 7 HE ARG 7 -1.387 -10.835 -3.283
27 HH11 ARG 7 HH11 ARG 7 -4.757 -11.309 -2.343
28 HH12 ARG 7 HH12 ARG 7 -4.402 -12.705 -1.318
29 HH21 ARG 7 HH21 ARG 7 -0.936 -12.635 -1.959
30 HH22 ARG 7 HH22 ARG 7 -2.247 -13.452 -1.101
31 H CYS 8 H CYS 8 -2.509 -4.975 -1.979
32 HA CYS 8 HA CYS 8 0.229 -4.255 -2.408
33 HB3 CYS 8 HB2 CYS 8 -0.709 -2.019 -1.292
34 H ASN 9 H ASN 9 -1.631 -5.054 0.449
35 HA ASN 9 HA ASN 9 0.174 -3.864 2.355
36 HB3 ASN 9 HB2 ASN 9 -1.284 -6.256 3.270
37 HD21 ASN 9 HD21 ASN 9 -2.263 -2.852 3.227
38 HD22 ASN 9 HD22 ASN 9 -1.942 -2.561 4.972
39 H TYR 10 H TYR 10 -0.255 -7.210 1.148
40 HA TYR 10 HA TYR 10 2.031 -8.182 2.652
41 HB3 TYR 10 HB2 TYR 10 0.908 -9.596 0.237
42 HD1 TYR 10 HD1 TYR 10 2.503 -11.287 0.035
43 HD2 TYR 10 HD2 TYR 10 0.997 -10.323 3.894
44 HE1 TYR 10 HE1 TYR 10 3.675 -13.235 0.973
45 HE2 TYR 10 HE2 TYR 10 2.166 -12.267 4.845
46 HH TYR 10 HH TYR 10 3.678 -13.879 4.469
47 H ALA 11 H ALA 11 1.452 -6.978 -0.615
48 HA ALA 11 HA ALA 11 4.050 -7.810 -1.621
49 HB1 ALA 11 HB1 ALA 11 3.446 -6.766 -3.625
50 HB2 ALA 11 HB2 ALA 11 1.894 -7.316 -2.950
51 HB3 ALA 11 HB3 ALA 11 2.369 -5.606 -2.809
52 H HIS 12 H HIS 12 2.671 -4.847 -0.231
53 HA HIS 12 HA HIS 12 5.446 -3.721 -0.205
54 HB3 HIS 12 HB2 HIS 12 4.684 -1.569 -0.620
55 HD2 HIS 12 HD2 HIS 12 1.553 -1.216 -2.114
56 HE1 HIS 12 HE1 HIS 12 3.425 -3.784 -4.924
57 HE2 HIS 12 HE2 HIS 12 1.487 -2.179 -4.534
58 HA PRO 13 HA PRO 13 3.815 -4.290 4.150
59 HB3 PRO 13 HB2 PRO 13 4.652 -6.432 4.306
60 HG3 PRO 13 HG2 PRO 13 6.389 -7.153 2.926
61 HD3 PRO 13 HD2 PRO 13 4.963 -6.254 1.344
62 H ALA 14 H ALA 14 6.967 -3.346 2.807
63 HA ALA 14 HA ALA 14 7.956 -2.019 5.128
64 HB1 ALA 14 HB1 ALA 14 9.391 -2.606 3.253
65 HB2 ALA 14 HB2 ALA 14 8.513 -1.472 2.197
66 HB3 ALA 14 HB3 ALA 14 9.470 -0.855 3.565
67 H ILE 15 H ILE 15 6.157 -0.779 2.290
68 HA ILE 15 HA ILE 15 4.964 1.299 3.971
69 HB ILE 15 HB ILE 15 5.688 3.096 2.235
70 HG13 ILE 15 HG12 ILE 15 6.907 1.088 0.958
71 HG21 ILE 15 HG21 ILE 15 7.998 2.350 3.962
72 HG22 ILE 15 HG22 ILE 15 7.146 3.903 3.790
73 HG23 ILE 15 HG23 ILE 15 6.424 2.592 4.755
74 HD11 ILE 15 HD11 ILE 15 7.407 2.786 -0.372
75 HD12 ILE 15 HD12 ILE 15 7.266 3.941 0.977
76 HD13 ILE 15 HD13 ILE 15 8.817 3.128 0.658
77 H CYS 16 H CYS 16 2.933 1.581 3.353
78 HA CYS 16 HA CYS 16 2.125 0.500 0.720
79 HB3 CYS 16 HB2 CYS 16 0.834 -0.191 2.676
80 H GLY 17 H GLY 17 3.654 2.761 0.418
81 HA2 GLY 17 HA1 GLY 17 2.319 5.238 0.418
82 HA3 GLY 17 HA2 GLY 17 3.591 4.774 -0.727
83 H GLY 18 H GLY 18 1.816 2.466 -1.637
84 HA2 GLY 18 HA1 GLY 18 0.792 3.660 -3.960
85 HA3 GLY 18 HA2 GLY 18 0.229 2.117 -3.289
86 H ALA 19 H ALA 19 -0.562 3.621 -0.757
87 HA ALA 19 HA ALA 19 -3.306 3.877 -1.318
88 HB1 ALA 19 HB1 ALA 19 -1.502 4.693 0.894
89 HB2 ALA 19 HB2 ALA 19 -3.083 5.507 0.817
90 HB3 ALA 19 HB3 ALA 19 -3.000 3.732 0.924
91 H ALA 20 H ALA 20 -0.690 6.193 -1.688
92 HA ALA 20 HA ALA 20 -2.146 8.598 -1.774
93 HB1 ALA 20 HB1 ALA 20 -0.308 9.266 -3.482
94 HB2 ALA 20 HB2 ALA 20 0.168 8.834 -1.822
95 HB3 ALA 20 HB3 ALA 20 0.364 7.654 -3.141
96 H GLY 21 H GLY 21 -1.326 6.406 -4.503
97 HA2 GLY 21 HA1 GLY 21 -2.911 7.930 -6.388
98 HA3 GLY 21 HA2 GLY 21 -2.237 6.308 -6.641
99 H GLY 22 H GLY 22 -3.507 5.053 -4.382
100 HA2 GLY 22 HA1 GLY 22 -6.400 5.416 -4.921
101 HA3 GLY 22 HA2 GLY 22 -5.689 3.853 -5.365
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -5.737 2.261 -3.598
2 HA2 GLY 1 HA1 GLY 1 -5.863 3.036 -0.834
3 HA3 GLY 1 HA2 GLY 1 -7.044 2.049 -1.716
4 H CYS 2 H CYS 2 -3.466 2.090 -1.820
5 HA CYS 2 HA CYS 2 -3.385 -0.804 -1.764
6 HB3 CYS 2 HB2 CYS 2 -0.822 -0.122 -1.259
7 H CYS 3 H CYS 3 -3.069 1.774 0.613
8 HA CYS 3 HA CYS 3 -1.838 0.298 2.697
9 HB3 CYS 3 HB2 CYS 3 -3.321 1.968 4.145
10 H SER 4 H SER 4 -5.228 0.539 1.677
11 HA SER 4 HA SER 4 -6.104 -1.131 3.936
12 HB3 SER 4 HB2 SER 4 -8.342 -0.981 2.614
13 HG SER 4 HG SER 4 -8.641 1.183 3.374
14 H ASP 5 H ASP 5 -5.814 -1.372 0.384
15 HA ASP 5 HA ASP 5 -6.909 -3.923 0.025
16 HB3 ASP 5 HB2 ASP 5 -4.403 -3.227 -1.471
17 HA PRO 6 HA PRO 6 -4.230 -6.666 2.220
18 HB3 PRO 6 HB2 PRO 6 -5.981 -8.165 2.143
19 HG3 PRO 6 HG2 PRO 6 -7.420 -8.246 0.308
20 HD3 PRO 6 HD2 PRO 6 -7.459 -5.977 0.753
21 H ARG 7 H ARG 7 -4.449 -7.185 -1.330
22 HA ARG 7 HA ARG 7 -2.016 -8.549 -1.648
23 HB3 ARG 7 HB2 ARG 7 -2.058 -7.410 -3.993
24 HG3 ARG 7 HG2 ARG 7 -4.242 -8.624 -4.608
25 HD3 ARG 7 HD2 ARG 7 -1.708 -9.490 -4.388
26 HE ARG 7 HE ARG 7 -2.787 -10.516 -2.008
27 HH11 ARG 7 HH11 ARG 7 -1.263 -11.730 -4.952
28 HH12 ARG 7 HH12 ARG 7 -0.555 -13.138 -4.151
29 HH21 ARG 7 HH21 ARG 7 -1.871 -12.334 -0.980
30 HH22 ARG 7 HH22 ARG 7 -0.898 -13.477 -1.911
31 H CYS 8 H CYS 8 -2.641 -5.025 -1.825
32 HA CYS 8 HA CYS 8 0.096 -4.328 -2.313
33 HB3 CYS 8 HB2 CYS 8 -0.847 -2.072 -1.197
34 H ASN 9 H ASN 9 -1.734 -5.050 0.584
35 HA ASN 9 HA ASN 9 0.107 -3.831 2.440
36 HB3 ASN 9 HB2 ASN 9 -1.273 -6.126 3.561
37 HD21 ASN 9 HD21 ASN 9 -1.524 -2.626 2.901
38 HD22 ASN 9 HD22 ASN 9 -1.691 -2.151 4.627
39 H TYR 10 H TYR 10 -0.375 -7.202 1.319
40 HA TYR 10 HA TYR 10 1.921 -8.163 2.815
41 HB3 TYR 10 HB2 TYR 10 0.560 -9.525 0.467
42 HD1 TYR 10 HD1 TYR 10 1.840 -10.170 3.938
43 HD2 TYR 10 HD2 TYR 10 1.660 -11.456 -0.114
44 HE1 TYR 10 HE1 TYR 10 3.216 -12.128 4.504
45 HE2 TYR 10 HE2 TYR 10 3.035 -13.417 0.441
46 HH TYR 10 HH TYR 10 3.926 -14.644 2.093
47 H ALA 11 H ALA 11 1.313 -7.023 -0.469
48 HA ALA 11 HA ALA 11 3.887 -7.911 -1.489
49 HB1 ALA 11 HB1 ALA 11 1.740 -7.447 -2.815
50 HB2 ALA 11 HB2 ALA 11 2.187 -5.728 -2.695
51 HB3 ALA 11 HB3 ALA 11 3.277 -6.878 -3.508
52 H HIS 12 H HIS 12 2.562 -4.905 -0.143
53 HA HIS 12 HA HIS 12 5.347 -3.810 -0.181
54 HB3 HIS 12 HB2 HIS 12 4.602 -1.655 -0.628
55 HD2 HIS 12 HD2 HIS 12 1.481 -1.288 -2.122
56 HE1 HIS 12 HE1 HIS 12 3.293 -3.958 -4.874
57 HE2 HIS 12 HE2 HIS 12 1.388 -2.309 -4.518
58 HA PRO 13 HA PRO 13 3.763 -4.257 4.205
59 HB3 PRO 13 HB2 PRO 13 4.569 -6.408 4.401
60 HG3 PRO 13 HG2 PRO 13 6.279 -7.185 3.016
61 HD3 PRO 13 HD2 PRO 13 4.847 -6.301 1.431
62 H ALA 14 H ALA 14 6.915 -3.395 2.806
63 HA ALA 14 HA ALA 14 7.960 -2.035 5.079
64 HB1 ALA 14 HB1 ALA 14 8.590 -2.282 2.234
65 HB2 ALA 14 HB2 ALA 14 9.005 -0.685 2.902
66 HB3 ALA 14 HB3 ALA 14 9.671 -2.161 3.642
67 H ILE 15 H ILE 15 6.119 -0.818 2.255
68 HA ILE 15 HA ILE 15 4.982 1.300 3.925
69 HB ILE 15 HB ILE 15 5.696 3.060 2.144
70 HG13 ILE 15 HG12 ILE 15 6.814 1.140 0.780
71 HG21 ILE 15 HG21 ILE 15 7.863 2.119 4.030
72 HG22 ILE 15 HG22 ILE 15 7.466 3.782 3.535
73 HG23 ILE 15 HG23 ILE 15 6.357 2.882 4.599
74 HD11 ILE 15 HD11 ILE 15 7.730 3.900 1.202
75 HD12 ILE 15 HD12 ILE 15 8.953 2.807 0.509
76 HD13 ILE 15 HD13 ILE 15 7.382 3.016 -0.302
77 H CYS 16 H CYS 16 2.944 1.593 3.342
78 HA CYS 16 HA CYS 16 2.076 0.483 0.739
79 HB3 CYS 16 HB2 CYS 16 0.816 -0.167 2.733
80 H GLY 17 H GLY 17 3.619 2.723 0.372
81 HA2 GLY 17 HA1 GLY 17 2.308 5.213 0.366
82 HA3 GLY 17 HA2 GLY 17 3.554 4.721 -0.796
83 H GLY 18 H GLY 18 1.736 2.419 -1.637
84 HA2 GLY 18 HA1 GLY 18 0.680 3.590 -3.958
85 HA3 GLY 18 HA2 GLY 18 0.113 2.064 -3.253
86 H ALA 19 H ALA 19 -0.614 3.611 -0.728
87 HA ALA 19 HA ALA 19 -3.365 3.893 -1.245
88 HB1 ALA 19 HB1 ALA 19 -3.119 5.519 0.868
89 HB2 ALA 19 HB2 ALA 19 -2.984 3.748 0.995
90 HB3 ALA 19 HB3 ALA 19 -1.514 4.751 0.924
91 H ALA 20 H ALA 20 -0.728 6.181 -1.660
92 HA ALA 20 HA ALA 20 -2.167 8.596 -1.761
93 HB1 ALA 20 HB1 ALA 20 -0.088 8.400 -3.816
94 HB2 ALA 20 HB2 ALA 20 -0.203 9.465 -2.393
95 HB3 ALA 20 HB3 ALA 20 0.438 7.812 -2.220
96 H GLY 21 H GLY 21 -1.372 6.376 -4.473
97 HA2 GLY 21 HA1 GLY 21 -2.953 7.893 -6.365
98 HA3 GLY 21 HA2 GLY 21 -2.290 6.266 -6.606
99 H GLY 22 H GLY 22 -3.557 5.029 -4.344
100 HA2 GLY 22 HA1 GLY 22 -6.452 5.404 -4.894
101 HA3 GLY 22 HA2 GLY 22 -5.744 3.827 -5.289
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -5.725 2.295 -3.660
2 HA2 GLY 1 HA1 GLY 1 -5.861 3.064 -0.894
3 HA3 GLY 1 HA2 GLY 1 -7.038 2.077 -1.781
4 H CYS 2 H CYS 2 -3.459 2.124 -1.878
5 HA CYS 2 HA CYS 2 -3.374 -0.771 -1.825
6 HB3 CYS 2 HB2 CYS 2 -0.812 -0.084 -1.313
7 H CYS 3 H CYS 3 -3.066 1.805 0.556
8 HA CYS 3 HA CYS 3 -1.837 0.328 2.640
9 HB3 CYS 3 HB2 CYS 3 -3.329 1.995 4.085
10 H SER 4 H SER 4 -5.225 0.567 1.612
11 HA SER 4 HA SER 4 -6.105 -1.106 3.869
12 HB3 SER 4 HB2 SER 4 -8.127 -0.828 1.836
13 HG SER 4 HG SER 4 -9.108 0.417 3.522
14 H ASP 5 H ASP 5 -5.798 -1.345 0.319
15 HA ASP 5 HA ASP 5 -6.894 -3.896 -0.047
16 HB3 ASP 5 HB2 ASP 5 -4.380 -3.196 -1.532
17 HA PRO 6 HA PRO 6 -4.223 -6.640 2.157
18 HB3 PRO 6 HB2 PRO 6 -5.973 -8.137 2.072
19 HG3 PRO 6 HG2 PRO 6 -7.406 -8.216 0.231
20 HD3 PRO 6 HD2 PRO 6 -7.446 -5.948 0.679
21 H ARG 7 H ARG 7 -4.426 -7.136 -1.397
22 HA ARG 7 HA ARG 7 -1.994 -8.508 -1.710
23 HB3 ARG 7 HB2 ARG 7 -2.618 -6.541 -3.836
24 HG3 ARG 7 HG2 ARG 7 -1.210 -8.638 -4.089
25 HD3 ARG 7 HD2 ARG 7 -3.209 -10.447 -4.816
26 HE ARG 7 HE ARG 7 -1.007 -10.424 -2.990
27 HH11 ARG 7 HH11 ARG 7 -4.055 -12.079 -3.646
28 HH12 ARG 7 HH12 ARG 7 -3.527 -13.601 -2.920
29 HH21 ARG 7 HH21 ARG 7 -0.330 -12.390 -2.053
30 HH22 ARG 7 HH22 ARG 7 -1.427 -13.775 -2.021
31 H CYS 8 H CYS 8 -2.611 -4.982 -1.891
32 HA CYS 8 HA CYS 8 0.133 -4.291 -2.354
33 HB3 CYS 8 HB2 CYS 8 -0.814 -2.032 -1.247
34 H ASN 9 H ASN 9 -1.722 -5.009 0.528
35 HA ASN 9 HA ASN 9 0.105 -3.795 2.399
36 HB3 ASN 9 HB2 ASN 9 -1.693 -6.167 2.981
37 HD21 ASN 9 HD21 ASN 9 -1.302 -2.826 4.147
38 HD22 ASN 9 HD22 ASN 9 -0.882 -3.289 5.832
39 H TYR 10 H TYR 10 -0.369 -7.164 1.274
40 HA TYR 10 HA TYR 10 1.914 -8.126 2.787
41 HB3 TYR 10 HB2 TYR 10 0.641 -9.524 0.420
42 HD1 TYR 10 HD1 TYR 10 1.824 -11.442 -0.024
43 HD2 TYR 10 HD2 TYR 10 1.573 -10.108 4.008
44 HE1 TYR 10 HE1 TYR 10 3.124 -13.402 0.699
45 HE2 TYR 10 HE2 TYR 10 2.873 -12.062 4.742
46 HH TYR 10 HH TYR 10 4.009 -13.862 4.127
47 H ALA 11 H ALA 11 1.331 -6.987 -0.502
48 HA ALA 11 HA ALA 11 3.910 -7.877 -1.505
49 HB1 ALA 11 HB1 ALA 11 3.314 -6.848 -3.527
50 HB2 ALA 11 HB2 ALA 11 1.769 -7.409 -2.843
51 HB3 ALA 11 HB3 ALA 11 2.225 -5.692 -2.724
52 H HIS 12 H HIS 12 2.580 -4.877 -0.157
53 HA HIS 12 HA HIS 12 5.365 -3.779 -0.182
54 HB3 HIS 12 HB2 HIS 12 4.621 -1.621 -0.625
55 HD2 HIS 12 HD2 HIS 12 1.518 -1.251 -2.150
56 HE1 HIS 12 HE1 HIS 12 3.356 -3.917 -4.889
57 HE2 HIS 12 HE2 HIS 12 1.448 -2.266 -4.549
58 HA PRO 13 HA PRO 13 3.760 -4.232 4.195
59 HB3 PRO 13 HB2 PRO 13 4.568 -6.381 4.392
60 HG3 PRO 13 HG2 PRO 13 6.285 -7.156 3.016
61 HD3 PRO 13 HD2 PRO 13 4.860 -6.271 1.425
62 H ALA 14 H ALA 14 6.917 -3.365 2.813
63 HA ALA 14 HA ALA 14 7.948 -2.005 5.094
64 HB1 ALA 14 HB1 ALA 14 8.486 -1.359 2.181
65 HB2 ALA 14 HB2 ALA 14 9.527 -0.994 3.578
66 HB3 ALA 14 HB3 ALA 14 9.259 -2.684 3.086
67 H ILE 15 H ILE 15 6.125 -0.790 2.258
68 HA ILE 15 HA ILE 15 4.977 1.328 3.919
69 HB ILE 15 HB ILE 15 5.701 3.089 2.144
70 HG13 ILE 15 HG12 ILE 15 6.828 1.167 0.785
71 HG21 ILE 15 HG21 ILE 15 8.032 2.364 3.844
72 HG22 ILE 15 HG22 ILE 15 7.164 3.908 3.680
73 HG23 ILE 15 HG23 ILE 15 6.471 2.597 4.667
74 HD11 ILE 15 HD11 ILE 15 7.142 3.366 -0.018
75 HD12 ILE 15 HD12 ILE 15 8.198 3.796 1.349
76 HD13 ILE 15 HD13 ILE 15 8.764 2.648 0.114
77 H CYS 16 H CYS 16 2.942 1.620 3.324
78 HA CYS 16 HA CYS 16 2.091 0.511 0.715
79 HB3 CYS 16 HB2 CYS 16 0.819 -0.141 2.699
80 H GLY 17 H GLY 17 3.635 2.749 0.354
81 HA2 GLY 17 HA1 GLY 17 2.325 5.239 0.340
82 HA3 GLY 17 HA2 GLY 17 3.575 4.746 -0.817
83 H GLY 18 H GLY 18 1.760 2.445 -1.663
84 HA2 GLY 18 HA1 GLY 18 0.717 3.613 -3.990
85 HA3 GLY 18 HA2 GLY 18 0.144 2.089 -3.287
86 H ALA 19 H ALA 19 -0.594 3.638 -0.767
87 HA ALA 19 HA ALA 19 -3.340 3.924 -1.299
88 HB1 ALA 19 HB1 ALA 19 -3.011 5.606 0.812
89 HB2 ALA 19 HB2 ALA 19 -3.069 3.831 0.939
90 HB3 ALA 19 HB3 ALA 19 -1.499 4.671 0.887
91 H ALA 20 H ALA 20 -0.698 6.206 -1.707
92 HA ALA 20 HA ALA 20 -2.131 8.625 -1.812
93 HB1 ALA 20 HB1 ALA 20 0.397 7.621 -3.057
94 HB2 ALA 20 HB2 ALA 20 -0.274 9.173 -3.616
95 HB3 ALA 20 HB3 ALA 20 0.139 8.947 -1.899
96 H GLY 21 H GLY 21 -1.339 6.398 -4.521
97 HA2 GLY 21 HA1 GLY 21 -2.910 7.920 -6.418
98 HA3 GLY 21 HA2 GLY 21 -2.255 6.289 -6.655
99 H GLY 22 H GLY 22 -3.533 5.067 -4.387
100 HA2 GLY 22 HA1 GLY 22 -6.425 5.455 -4.935
101 HA3 GLY 22 HA2 GLY 22 -5.726 3.875 -5.342
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -5.824 2.238 -3.516
2 HA2 GLY 1 HA1 GLY 1 -5.881 3.071 -0.766
3 HA3 GLY 1 HA2 GLY 1 -7.090 2.077 -1.601
4 H CYS 2 H CYS 2 -3.516 2.084 -1.794
5 HA CYS 2 HA CYS 2 -3.455 -0.809 -1.677
6 HB3 CYS 2 HB2 CYS 2 -0.876 -0.136 -1.241
7 H CYS 3 H CYS 3 -3.075 1.813 0.640
8 HA CYS 3 HA CYS 3 -1.805 0.373 2.725
9 HB3 CYS 3 HB2 CYS 3 -3.256 2.077 4.170
10 H SER 4 H SER 4 -5.217 0.616 1.780
11 HA SER 4 HA SER 4 -6.049 -1.013 4.086
12 HB3 SER 4 HB2 SER 4 -7.375 0.924 2.927
13 HG SER 4 HG SER 4 -8.807 0.109 1.304
14 H ASP 5 H ASP 5 -5.794 -1.317 0.541
15 HA ASP 5 HA ASP 5 -6.931 -3.862 0.240
16 HB3 ASP 5 HB2 ASP 5 -4.443 -3.212 -1.307
17 HA PRO 6 HA PRO 6 -4.243 -6.592 2.437
18 HB3 PRO 6 HB2 PRO 6 -6.005 -8.076 2.412
19 HG3 PRO 6 HG2 PRO 6 -7.474 -8.174 0.602
20 HD3 PRO 6 HD2 PRO 6 -7.488 -5.898 1.011
21 H ARG 7 H ARG 7 -4.524 -7.167 -1.101
22 HA ARG 7 HA ARG 7 -2.106 -8.558 -1.434
23 HB3 ARG 7 HB2 ARG 7 -2.730 -6.650 -3.602
24 HG3 ARG 7 HG2 ARG 7 -1.412 -8.801 -3.821
25 HD3 ARG 7 HD2 ARG 7 -3.849 -10.356 -4.276
26 HE ARG 7 HE ARG 7 -1.850 -11.392 -2.443
27 HH11 ARG 7 HH11 ARG 7 -2.576 -10.661 -5.820
28 HH12 ARG 7 HH12 ARG 7 -1.448 -11.868 -6.450
29 HH21 ARG 7 HH21 ARG 7 -0.399 -12.947 -3.263
30 HH22 ARG 7 HH22 ARG 7 -0.221 -13.157 -5.007
31 H CYS 8 H CYS 8 -2.707 -5.033 -1.670
32 HA CYS 8 HA CYS 8 0.030 -4.368 -2.210
33 HB3 CYS 8 HB2 CYS 8 -0.880 -2.081 -1.129
34 H ASN 9 H ASN 9 -1.767 -5.015 0.726
35 HA ASN 9 HA ASN 9 0.105 -3.770 2.532
36 HB3 ASN 9 HB2 ASN 9 -1.771 -6.093 3.118
37 HD21 ASN 9 HD21 ASN 9 -0.648 -2.933 4.364
38 HD22 ASN 9 HD22 ASN 9 -0.359 -3.520 6.038
39 H TYR 10 H TYR 10 -0.410 -7.163 1.494
40 HA TYR 10 HA TYR 10 1.902 -8.102 2.975
41 HB3 TYR 10 HB2 TYR 10 0.596 -9.561 0.667
42 HD1 TYR 10 HD1 TYR 10 0.233 -11.030 3.867
43 HD2 TYR 10 HD2 TYR 10 3.039 -10.497 0.715
44 HE1 TYR 10 HE1 TYR 10 1.504 -12.973 4.679
45 HE2 TYR 10 HE2 TYR 10 4.317 -12.438 1.516
46 HH TYR 10 HH TYR 10 4.402 -14.134 2.948
47 H ALA 11 H ALA 11 1.250 -7.033 -0.323
48 HA ALA 11 HA ALA 11 3.800 -7.960 -1.366
49 HB1 ALA 11 HB1 ALA 11 3.167 -6.953 -3.394
50 HB2 ALA 11 HB2 ALA 11 1.641 -7.516 -2.671
51 HB3 ALA 11 HB3 ALA 11 2.085 -5.794 -2.585
52 H HIS 12 H HIS 12 2.520 -4.921 -0.056
53 HA HIS 12 HA HIS 12 5.312 -3.847 -0.162
54 HB3 HIS 12 HB2 HIS 12 4.579 -1.695 -0.644
55 HD2 HIS 12 HD2 HIS 12 1.440 -1.334 -2.104
56 HE1 HIS 12 HE1 HIS 12 3.195 -4.081 -4.820
57 HE2 HIS 12 HE2 HIS 12 1.309 -2.407 -4.476
58 HA PRO 13 HA PRO 13 3.792 -4.184 4.254
59 HB3 PRO 13 HB2 PRO 13 4.588 -6.335 4.486
60 HG3 PRO 13 HG2 PRO 13 6.272 -7.154 3.094
61 HD3 PRO 13 HD2 PRO 13 4.822 -6.297 1.511
62 H ALA 14 H ALA 14 6.928 -3.375 2.792
63 HA ALA 14 HA ALA 14 8.014 -1.971 5.017
64 HB1 ALA 14 HB1 ALA 14 9.693 -1.299 3.589
65 HB2 ALA 14 HB2 ALA 14 9.061 -2.718 2.723
66 HB3 ALA 14 HB3 ALA 14 8.587 -1.080 2.212
67 H ILE 15 H ILE 15 6.138 -0.806 2.195
68 HA ILE 15 HA ILE 15 5.041 1.358 3.833
69 HB ILE 15 HB ILE 15 5.736 3.073 2.005
70 HG13 ILE 15 HG12 ILE 15 6.934 0.909 0.857
71 HG21 ILE 15 HG21 ILE 15 7.228 3.916 3.494
72 HG22 ILE 15 HG22 ILE 15 6.566 2.621 4.520
73 HG23 ILE 15 HG23 ILE 15 8.105 2.376 3.660
74 HD11 ILE 15 HD11 ILE 15 6.874 3.655 0.358
75 HD12 ILE 15 HD12 ILE 15 8.598 3.212 0.329
76 HD13 ILE 15 HD13 ILE 15 7.444 2.369 -0.731
77 H CYS 16 H CYS 16 2.995 1.650 3.276
78 HA CYS 16 HA CYS 16 2.079 0.488 0.714
79 HB3 CYS 16 HB2 CYS 16 0.846 -0.111 2.740
80 H GLY 17 H GLY 17 3.627 2.701 0.260
81 HA2 GLY 17 HA1 GLY 17 2.334 5.203 0.224
82 HA3 GLY 17 HA2 GLY 17 3.554 4.675 -0.951
83 H GLY 18 H GLY 18 1.702 2.367 -1.702
84 HA2 GLY 18 HA1 GLY 18 0.613 3.491 -4.030
85 HA3 GLY 18 HA2 GLY 18 0.046 1.988 -3.278
86 H ALA 19 H ALA 19 -0.621 3.600 -0.777
87 HA ALA 19 HA ALA 19 -3.378 3.895 -1.251
88 HB1 ALA 19 HB1 ALA 19 -2.969 3.802 0.981
89 HB2 ALA 19 HB2 ALA 19 -1.481 4.771 0.866
90 HB3 ALA 19 HB3 ALA 19 -3.071 5.572 0.819
91 H ALA 20 H ALA 20 -0.729 6.148 -1.769
92 HA ALA 20 HA ALA 20 -2.147 8.574 -1.895
93 HB1 ALA 20 HB1 ALA 20 0.031 9.071 -2.139
94 HB2 ALA 20 HB2 ALA 20 0.397 7.526 -2.944
95 HB3 ALA 20 HB3 ALA 20 -0.287 8.876 -3.880
96 H GLY 21 H GLY 21 -1.429 6.283 -4.572
97 HA2 GLY 21 HA1 GLY 21 -3.032 7.773 -6.468
98 HA3 GLY 21 HA2 GLY 21 -2.392 6.133 -6.683
99 H GLY 22 H GLY 22 -3.630 4.977 -4.355
100 HA2 GLY 22 HA1 GLY 22 -6.530 5.369 -4.853
101 HA3 GLY 22 HA2 GLY 22 -5.851 3.776 -5.236
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -5.664 2.235 -3.792
2 HA2 GLY 1 HA1 GLY 1 -5.862 2.988 -1.026
3 HA3 GLY 1 HA2 GLY 1 -7.009 1.989 -1.940
4 H CYS 2 H CYS 2 -3.431 2.088 -1.966
5 HA CYS 2 HA CYS 2 -3.305 -0.807 -1.923
6 HB3 CYS 2 HB2 CYS 2 -0.764 -0.085 -1.362
7 H CYS 3 H CYS 3 -3.071 1.767 0.472
8 HA CYS 3 HA CYS 3 -1.863 0.297 2.571
9 HB3 CYS 3 HB2 CYS 3 -3.410 1.940 3.991
10 H SER 4 H SER 4 -5.234 0.495 1.483
11 HA SER 4 HA SER 4 -6.133 -1.196 3.719
12 HB3 SER 4 HB2 SER 4 -8.021 -0.814 1.495
13 HG SER 4 HG SER 4 -9.262 0.040 3.248
14 H ASP 5 H ASP 5 -5.734 -1.423 0.179
15 HA ASP 5 HA ASP 5 -6.795 -3.988 -0.214
16 HB3 ASP 5 HB2 ASP 5 -4.265 -3.248 -1.652
17 HA PRO 6 HA PRO 6 -4.126 -6.698 2.032
18 HB3 PRO 6 HB2 PRO 6 -5.851 -8.223 1.909
19 HG3 PRO 6 HG2 PRO 6 -7.245 -8.319 0.040
20 HD3 PRO 6 HD2 PRO 6 -7.330 -6.052 0.493
21 H ARG 7 H ARG 7 -4.250 -7.172 -1.529
22 HA ARG 7 HA ARG 7 -1.798 -8.516 -1.806
23 HB3 ARG 7 HB2 ARG 7 -1.947 -6.910 -4.073
24 HG3 ARG 7 HG2 ARG 7 -1.783 -9.333 -4.147
25 HD3 ARG 7 HD2 ARG 7 -4.420 -10.227 -4.026
26 HE ARG 7 HE ARG 7 -1.984 -10.742 -2.550
27 HH11 ARG 7 HH11 ARG 7 -5.469 -11.302 -2.628
28 HH12 ARG 7 HH12 ARG 7 -5.369 -12.812 -1.715
29 HH21 ARG 7 HH21 ARG 7 -1.863 -12.691 -1.372
30 HH22 ARG 7 HH22 ARG 7 -3.336 -13.594 -1.006
31 H CYS 8 H CYS 8 -2.433 -4.991 -2.018
32 HA CYS 8 HA CYS 8 0.308 -4.275 -2.394
33 HB3 CYS 8 HB2 CYS 8 -0.660 -2.029 -1.309
34 H ASN 9 H ASN 9 -1.598 -5.038 0.443
35 HA ASN 9 HA ASN 9 0.173 -3.821 2.363
36 HB3 ASN 9 HB2 ASN 9 -1.627 -6.217 2.852
37 HD21 ASN 9 HD21 ASN 9 -1.144 -2.927 4.141
38 HD22 ASN 9 HD22 ASN 9 -0.780 -3.464 5.818
39 H TYR 10 H TYR 10 -0.222 -7.180 1.181
40 HA TYR 10 HA TYR 10 2.037 -8.131 2.737
41 HB3 TYR 10 HB2 TYR 10 0.718 -9.452 0.338
42 HD1 TYR 10 HD1 TYR 10 2.969 -10.456 -0.152
43 HD2 TYR 10 HD2 TYR 10 0.974 -11.079 3.553
44 HE1 TYR 10 HE1 TYR 10 4.411 -12.399 0.292
45 HE2 TYR 10 HE2 TYR 10 2.410 -13.022 4.008
46 HH TYR 10 HH TYR 10 4.234 -14.160 3.375
47 H ALA 11 H ALA 11 1.519 -6.955 -0.550
48 HA ALA 11 HA ALA 11 4.140 -7.786 -1.495
49 HB1 ALA 11 HB1 ALA 11 3.555 -6.825 -3.524
50 HB2 ALA 11 HB2 ALA 11 1.972 -7.275 -2.845
51 HB3 ALA 11 HB3 ALA 11 2.529 -5.586 -2.763
52 H HIS 12 H HIS 12 2.726 -4.834 -0.130
53 HA HIS 12 HA HIS 12 5.491 -3.687 -0.069
54 HB3 HIS 12 HB2 HIS 12 4.727 -1.541 -0.512
55 HD2 HIS 12 HD2 HIS 12 1.638 -1.201 -2.085
56 HE1 HIS 12 HE1 HIS 12 3.570 -3.799 -4.825
57 HE2 HIS 12 HE2 HIS 12 1.629 -2.187 -4.497
58 HA PRO 13 HA PRO 13 3.777 -4.231 4.256
59 HB3 PRO 13 HB2 PRO 13 4.619 -6.367 4.445
60 HG3 PRO 13 HG2 PRO 13 6.388 -7.091 3.105
61 HD3 PRO 13 HD2 PRO 13 4.989 -6.209 1.487
62 H ALA 14 H ALA 14 6.941 -3.272 2.961
63 HA ALA 14 HA ALA 14 7.880 -1.924 5.294
64 HB1 ALA 14 HB1 ALA 14 9.435 -2.452 3.573
65 HB2 ALA 14 HB2 ALA 14 8.495 -1.558 2.353
66 HB3 ALA 14 HB3 ALA 14 9.340 -0.676 3.648
67 H ILE 15 H ILE 15 6.133 -0.718 2.409
68 HA ILE 15 HA ILE 15 4.897 1.369 4.048
69 HB ILE 15 HB ILE 15 5.643 3.155 2.312
70 HG13 ILE 15 HG12 ILE 15 6.828 1.293 0.948
71 HG21 ILE 15 HG21 ILE 15 6.228 2.962 4.785
72 HG22 ILE 15 HG22 ILE 15 7.760 2.227 4.260
73 HG23 ILE 15 HG23 ILE 15 7.357 3.890 3.768
74 HD11 ILE 15 HD11 ILE 15 8.999 3.007 0.920
75 HD12 ILE 15 HD12 ILE 15 7.535 3.132 -0.086
76 HD13 ILE 15 HD13 ILE 15 7.649 4.042 1.438
77 H CYS 16 H CYS 16 2.876 1.635 3.391
78 HA CYS 16 HA CYS 16 2.124 0.526 0.753
79 HB3 CYS 16 HB2 CYS 16 0.798 -0.156 2.690
80 H GLY 17 H GLY 17 3.639 2.769 0.415
81 HA2 GLY 17 HA1 GLY 17 2.305 5.250 0.386
82 HA3 GLY 17 HA2 GLY 17 3.586 4.772 -0.746
83 H GLY 18 H GLY 18 1.810 2.453 -1.632
84 HA2 GLY 18 HA1 GLY 18 0.807 3.616 -3.981
85 HA3 GLY 18 HA2 GLY 18 0.234 2.085 -3.291
86 H ALA 19 H ALA 19 -0.574 3.624 -0.787
87 HA ALA 19 HA ALA 19 -3.311 3.887 -1.378
88 HB1 ALA 19 HB1 ALA 19 -1.526 4.605 0.851
89 HB2 ALA 19 HB2 ALA 19 -3.009 5.586 0.743
90 HB3 ALA 19 HB3 ALA 19 -3.120 3.813 0.861
91 H ALA 20 H ALA 20 -0.680 6.186 -1.739
92 HA ALA 20 HA ALA 20 -2.127 8.597 -1.864
93 HB1 ALA 20 HB1 ALA 20 0.468 7.943 -2.137
94 HB2 ALA 20 HB2 ALA 20 0.060 8.239 -3.845
95 HB3 ALA 20 HB3 ALA 20 -0.199 9.517 -2.634
96 H GLY 21 H GLY 21 -1.276 6.378 -4.562
97 HA2 GLY 21 HA1 GLY 21 -2.826 7.890 -6.483
98 HA3 GLY 21 HA2 GLY 21 -2.157 6.264 -6.709
99 H GLY 22 H GLY 22 -3.469 5.047 -4.449
100 HA2 GLY 22 HA1 GLY 22 -6.352 5.416 -5.037
101 HA3 GLY 22 HA2 GLY 22 -5.644 3.846 -5.454
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -5.518 2.876 -2.876
2 HA2 GLY 1 HA1 GLY 1 -7.714 1.933 -1.280
3 HA3 GLY 1 HA2 GLY 1 -7.419 1.586 -2.995
4 H CYS 2 H CYS 2 -4.476 1.544 -2.598
5 HA CYS 2 HA CYS 2 -4.117 -1.218 -2.291
6 HB3 CYS 2 HB2 CYS 2 -1.678 -0.318 -1.532
7 H CYS 3 H CYS 3 -3.798 1.371 0.150
8 HA CYS 3 HA CYS 3 -2.872 -0.272 2.271
9 HB3 CYS 3 HB2 CYS 3 -4.253 1.596 3.633
10 H SER 4 H SER 4 -6.111 0.325 0.998
11 HA SER 4 HA SER 4 -7.468 -0.932 3.236
12 HB3 SER 4 HB2 SER 4 -8.586 -0.606 0.434
13 HG SER 4 HG SER 4 -10.512 -0.243 1.662
14 H ASP 5 H ASP 5 -6.181 -1.983 0.124
15 HA ASP 5 HA ASP 5 -7.395 -4.653 0.423
16 HB3 ASP 5 HB2 ASP 5 -5.302 -4.052 -1.642
17 HA PRO 6 HA PRO 6 -3.989 -6.387 2.635
18 HB3 PRO 6 HB2 PRO 6 -5.450 -8.066 3.234
19 HG3 PRO 6 HG2 PRO 6 -7.118 -8.791 1.772
20 HD3 PRO 6 HD2 PRO 6 -7.473 -6.507 1.689
21 H ARG 7 H ARG 7 -4.584 -7.055 -0.774
22 HA ARG 7 HA ARG 7 -2.251 -8.555 -1.347
23 HB3 ARG 7 HB2 ARG 7 -3.708 -6.542 -3.101
24 HG3 ARG 7 HG2 ARG 7 -1.332 -7.657 -3.742
25 HD3 ARG 7 HD2 ARG 7 -2.296 -9.443 -5.511
26 HE ARG 7 HE ARG 7 -1.750 -10.705 -2.941
27 HH11 ARG 7 HH11 ARG 7 -0.392 -8.926 -5.671
28 HH12 ARG 7 HH12 ARG 7 1.242 -9.554 -5.425
29 HH21 ARG 7 HH21 ARG 7 0.361 -11.511 -2.628
30 HH22 ARG 7 HH22 ARG 7 1.665 -11.012 -3.708
31 H CYS 8 H CYS 8 -2.797 -5.018 -1.654
32 HA CYS 8 HA CYS 8 -0.056 -4.462 -2.318
33 HB3 CYS 8 HB2 CYS 8 -0.812 -2.078 -1.483
34 H ASN 9 H ASN 9 -1.826 -4.785 0.703
35 HA ASN 9 HA ASN 9 0.143 -3.506 2.367
36 HB3 ASN 9 HB2 ASN 9 -1.583 -5.734 3.412
37 HD21 ASN 9 HD21 ASN 9 -1.027 -2.204 3.597
38 HD22 ASN 9 HD22 ASN 9 -0.761 -2.183 5.376
39 H TYR 10 H TYR 10 -0.517 -6.933 1.561
40 HA TYR 10 HA TYR 10 1.770 -7.871 3.086
41 HB3 TYR 10 HB2 TYR 10 0.346 -9.391 0.883
42 HD1 TYR 10 HD1 TYR 10 0.718 -10.192 4.472
43 HD2 TYR 10 HD2 TYR 10 2.132 -10.942 0.531
44 HE1 TYR 10 HE1 TYR 10 1.966 -12.143 5.298
45 HE2 TYR 10 HE2 TYR 10 3.384 -12.896 1.345
46 HH TYR 10 HH TYR 10 3.917 -14.156 3.081
47 H ALA 11 H ALA 11 1.154 -6.913 -0.242
48 HA ALA 11 HA ALA 11 3.636 -8.035 -1.263
49 HB1 ALA 11 HB1 ALA 11 1.968 -5.854 -2.534
50 HB2 ALA 11 HB2 ALA 11 3.061 -7.013 -3.330
51 HB3 ALA 11 HB3 ALA 11 1.536 -7.579 -2.605
52 H HIS 12 H HIS 12 2.521 -4.848 -0.146
53 HA HIS 12 HA HIS 12 5.372 -3.942 -0.296
54 HB3 HIS 12 HB2 HIS 12 4.764 -1.819 -0.952
55 HD2 HIS 12 HD2 HIS 12 1.483 -1.380 -2.156
56 HE1 HIS 12 HE1 HIS 12 2.944 -4.287 -4.877
57 HE2 HIS 12 HE2 HIS 12 1.130 -2.550 -4.458
58 HA PRO 13 HA PRO 13 3.835 -3.977 4.139
59 HB3 PRO 13 HB2 PRO 13 4.438 -6.176 4.470
60 HG3 PRO 13 HG2 PRO 13 6.039 -7.204 3.118
61 HD3 PRO 13 HD2 PRO 13 4.664 -6.296 1.496
62 H ALA 14 H ALA 14 7.054 -3.554 2.675
63 HA ALA 14 HA ALA 14 8.315 -2.187 4.790
64 HB1 ALA 14 HB1 ALA 14 9.504 -0.986 2.753
65 HB2 ALA 14 HB2 ALA 14 9.773 -2.711 3.101
66 HB3 ALA 14 HB3 ALA 14 8.638 -2.229 1.818
67 H ILE 15 H ILE 15 6.330 -0.885 2.110
68 HA ILE 15 HA ILE 15 5.544 1.364 3.819
69 HB ILE 15 HB ILE 15 6.173 3.018 1.937
70 HG13 ILE 15 HG12 ILE 15 6.862 1.138 0.370
71 HG21 ILE 15 HG21 ILE 15 8.574 1.957 3.407
72 HG22 ILE 15 HG22 ILE 15 8.091 3.642 3.096
73 HG23 ILE 15 HG23 ILE 15 7.207 2.667 4.296
74 HD11 ILE 15 HD11 ILE 15 9.136 3.059 0.857
75 HD12 ILE 15 HD12 ILE 15 8.637 2.295 -0.671
76 HD13 ILE 15 HD13 ILE 15 7.607 3.536 0.081
77 H CYS 16 H CYS 16 3.493 1.862 3.441
78 HA CYS 16 HA CYS 16 2.111 0.560 1.228
79 HB3 CYS 16 HB2 CYS 16 1.038 2.622 3.191
80 H GLY 17 H GLY 17 3.785 1.892 -0.189
81 HA2 GLY 17 HA1 GLY 17 3.335 4.638 -0.702
82 HA3 GLY 17 HA2 GLY 17 3.959 3.465 -1.880
83 H GLY 18 H GLY 18 1.546 1.787 -1.776
84 HA2 GLY 18 HA1 GLY 18 0.134 2.943 -3.936
85 HA3 GLY 18 HA2 GLY 18 -0.471 1.635 -2.904
86 H ALA 19 H ALA 19 -0.167 3.506 -0.517
87 HA ALA 19 HA ALA 19 -2.858 4.316 -0.338
88 HB1 ALA 19 HB1 ALA 19 -0.868 5.944 1.149
89 HB2 ALA 19 HB2 ALA 19 -2.314 5.083 1.727
90 HB3 ALA 19 HB3 ALA 19 -0.812 4.184 1.404
91 H ALA 20 H ALA 20 -0.049 5.989 -1.661
92 HA ALA 20 HA ALA 20 -1.042 8.621 -1.729
93 HB1 ALA 20 HB1 ALA 20 0.576 7.384 -3.962
94 HB2 ALA 20 HB2 ALA 20 0.590 9.068 -3.382
95 HB3 ALA 20 HB3 ALA 20 1.270 7.772 -2.370
96 H GLY 21 H GLY 21 -1.321 6.078 -4.253
97 HA2 GLY 21 HA1 GLY 21 -3.034 7.713 -5.916
98 HA3 GLY 21 HA2 GLY 21 -2.740 5.972 -6.089
99 H GLY 22 H GLY 22 -3.623 5.114 -3.541
100 HA2 GLY 22 HA1 GLY 22 -5.769 5.551 -2.246
101 HA3 GLY 22 HA2 GLY 22 -6.545 5.727 -3.832
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -5.875 2.692 -3.490
2 HA2 GLY 1 HA1 GLY 1 -7.127 2.556 -0.907
3 HA3 GLY 1 HA2 GLY 1 -7.722 1.838 -2.416
4 H CYS 2 H CYS 2 -4.289 2.034 -1.777
5 HA CYS 2 HA CYS 2 -4.057 -0.849 -2.003
6 HB3 CYS 2 HB2 CYS 2 -1.594 -0.083 -1.166
7 H CYS 3 H CYS 3 -3.723 1.525 0.638
8 HA CYS 3 HA CYS 3 -2.825 -0.282 2.630
9 HB3 CYS 3 HB2 CYS 3 -4.212 1.467 4.126
10 H SER 4 H SER 4 -6.049 0.414 1.376
11 HA SER 4 HA SER 4 -7.438 -1.002 3.489
12 HB3 SER 4 HB2 SER 4 -9.283 -0.159 2.496
13 HG SER 4 HG SER 4 -8.886 1.443 0.875
14 H ASP 5 H ASP 5 -6.092 -1.842 0.337
15 HA ASP 5 HA ASP 5 -7.290 -4.534 0.453
16 HB3 ASP 5 HB2 ASP 5 -5.191 -3.784 -1.558
17 HA PRO 6 HA PRO 6 -3.878 -6.373 2.572
18 HB3 PRO 6 HB2 PRO 6 -5.328 -8.098 3.059
19 HG3 PRO 6 HG2 PRO 6 -6.983 -8.745 1.547
20 HD3 PRO 6 HD2 PRO 6 -7.357 -6.464 1.603
21 H ARG 7 H ARG 7 -4.463 -6.876 -0.873
22 HA ARG 7 HA ARG 7 -2.113 -8.306 -1.527
23 HB3 ARG 7 HB2 ARG 7 -2.382 -7.121 -3.794
24 HG3 ARG 7 HG2 ARG 7 -4.874 -8.048 -4.001
25 HD3 ARG 7 HD2 ARG 7 -2.634 -8.967 -4.878
26 HE ARG 7 HE ARG 7 -2.642 -10.232 -2.253
27 HH11 ARG 7 HH11 ARG 7 -1.673 -10.525 -5.634
28 HH12 ARG 7 HH12 ARG 7 -0.348 -11.641 -5.286
29 HH21 ARG 7 HH21 ARG 7 -0.930 -11.673 -1.808
30 HH22 ARG 7 HH22 ARG 7 0.069 -12.290 -3.129
31 H CYS 8 H CYS 8 -2.678 -4.758 -1.618
32 HA CYS 8 HA CYS 8 0.059 -4.145 -2.237
33 HB3 CYS 8 HB2 CYS 8 -0.725 -1.830 -1.216
34 H ASN 9 H ASN 9 -1.699 -4.701 0.753
35 HA ASN 9 HA ASN 9 0.254 -3.515 2.503
36 HB3 ASN 9 HB2 ASN 9 -1.187 -5.759 3.692
37 HD21 ASN 9 HD21 ASN 9 -1.994 -2.326 3.163
38 HD22 ASN 9 HD22 ASN 9 -1.742 -1.838 4.876
39 H TYR 10 H TYR 10 -0.367 -6.891 1.472
40 HA TYR 10 HA TYR 10 1.943 -7.894 2.917
41 HB3 TYR 10 HB2 TYR 10 0.332 -9.192 0.687
42 HD1 TYR 10 HD1 TYR 10 0.967 -10.874 3.813
43 HD2 TYR 10 HD2 TYR 10 2.491 -10.233 -0.108
44 HE1 TYR 10 HE1 TYR 10 2.396 -12.863 4.049
45 HE2 TYR 10 HE2 TYR 10 3.923 -12.220 0.118
46 HH TYR 10 HH TYR 10 4.399 -14.025 1.347
47 H ALA 11 H ALA 11 1.286 -6.730 -0.336
48 HA ALA 11 HA ALA 11 3.771 -7.753 -1.451
49 HB1 ALA 11 HB1 ALA 11 3.165 -6.607 -3.439
50 HB2 ALA 11 HB2 ALA 11 1.652 -7.230 -2.740
51 HB3 ALA 11 HB3 ALA 11 2.073 -5.510 -2.562
52 H HIS 12 H HIS 12 2.628 -4.642 -0.150
53 HA HIS 12 HA HIS 12 5.473 -3.713 -0.230
54 HB3 HIS 12 HB2 HIS 12 4.860 -1.564 -0.783
55 HD2 HIS 12 HD2 HIS 12 1.589 -1.066 -1.987
56 HE1 HIS 12 HE1 HIS 12 3.066 -3.840 -4.836
57 HE2 HIS 12 HE2 HIS 12 1.251 -2.124 -4.345
58 HA PRO 13 HA PRO 13 3.896 -3.986 4.182
59 HB3 PRO 13 HB2 PRO 13 4.499 -6.199 4.403
60 HG3 PRO 13 HG2 PRO 13 6.114 -7.153 3.014
61 HD3 PRO 13 HD2 PRO 13 4.752 -6.162 1.429
62 H ALA 14 H ALA 14 7.114 -3.465 2.758
63 HA ALA 14 HA ALA 14 8.368 -2.221 4.951
64 HB1 ALA 14 HB1 ALA 14 9.190 -0.865 2.588
65 HB2 ALA 14 HB2 ALA 14 10.015 -2.180 3.457
66 HB3 ALA 14 HB3 ALA 14 8.863 -2.560 2.155
67 H ILE 15 H ILE 15 6.368 -0.774 2.359
68 HA ILE 15 HA ILE 15 5.580 1.367 4.203
69 HB ILE 15 HB ILE 15 6.187 3.133 2.420
70 HG13 ILE 15 HG12 ILE 15 6.861 1.399 0.714
71 HG21 ILE 15 HG21 ILE 15 8.659 2.067 3.727
72 HG22 ILE 15 HG22 ILE 15 8.025 3.729 3.659
73 HG23 ILE 15 HG23 ILE 15 7.282 2.536 4.753
74 HD11 ILE 15 HD11 ILE 15 8.575 3.694 1.488
75 HD12 ILE 15 HD12 ILE 15 9.258 2.519 0.338
76 HD13 ILE 15 HD13 ILE 15 7.730 3.348 -0.039
77 H CYS 16 H CYS 16 3.524 1.883 3.863
78 HA CYS 16 HA CYS 16 2.135 0.700 1.590
79 HB3 CYS 16 HB2 CYS 16 1.062 2.644 3.668
80 H GLY 17 H GLY 17 3.819 2.142 0.267
81 HA2 GLY 17 HA1 GLY 17 3.050 4.913 -0.092
82 HA3 GLY 17 HA2 GLY 17 4.119 3.966 -1.144
83 H GLY 18 H GLY 18 2.138 1.853 -1.614
84 HA2 GLY 18 HA1 GLY 18 0.991 2.842 -3.989
85 HA3 GLY 18 HA2 GLY 18 0.440 1.397 -3.120
86 H ALA 19 H ALA 19 -0.116 3.154 -0.702
87 HA ALA 19 HA ALA 19 -2.887 3.477 -1.110
88 HB1 ALA 19 HB1 ALA 19 -2.743 3.728 1.094
89 HB2 ALA 19 HB2 ALA 19 -0.985 3.979 0.977
90 HB3 ALA 19 HB3 ALA 19 -2.093 5.366 0.849
91 H ALA 20 H ALA 20 -0.205 5.706 -1.675
92 HA ALA 20 HA ALA 20 -1.647 8.116 -1.920
93 HB1 ALA 20 HB1 ALA 20 0.974 7.264 -2.348
94 HB2 ALA 20 HB2 ALA 20 0.449 7.897 -3.926
95 HB3 ALA 20 HB3 ALA 20 0.354 8.928 -2.478
96 H GLY 21 H GLY 21 -1.262 5.425 -4.186
97 HA2 GLY 21 HA1 GLY 21 -2.355 6.836 -6.461
98 HA3 GLY 21 HA2 GLY 21 -2.183 5.080 -6.291
99 H GLY 22 H GLY 22 -3.764 4.330 -4.298
100 HA2 GLY 22 HA1 GLY 22 -6.212 5.454 -3.798
101 HA3 GLY 22 HA2 GLY 22 -6.419 4.827 -5.446
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -5.789 2.535 -3.660
2 HA2 GLY 1 HA1 GLY 1 -7.014 2.516 -1.062
3 HA3 GLY 1 HA2 GLY 1 -7.630 1.738 -2.533
4 H CYS 2 H CYS 2 -4.192 1.950 -1.874
5 HA CYS 2 HA CYS 2 -3.958 -0.936 -2.026
6 HB3 CYS 2 HB2 CYS 2 -1.508 -0.156 -1.169
7 H CYS 3 H CYS 3 -3.668 1.498 0.563
8 HA CYS 3 HA CYS 3 -2.804 -0.263 2.611
9 HB3 CYS 3 HB2 CYS 3 -4.216 1.522 4.044
10 H SER 4 H SER 4 -6.003 0.398 1.279
11 HA SER 4 HA SER 4 -7.434 -0.961 3.403
12 HB3 SER 4 HB2 SER 4 -8.188 -0.083 0.595
13 HG SER 4 HG SER 4 -10.348 -0.624 1.216
14 H ASP 5 H ASP 5 -6.024 -1.887 0.303
15 HA ASP 5 HA ASP 5 -7.218 -4.580 0.479
16 HB3 ASP 5 HB2 ASP 5 -5.100 -3.876 -1.528
17 HA PRO 6 HA PRO 6 -3.824 -6.339 2.690
18 HB3 PRO 6 HB2 PRO 6 -5.272 -8.056 3.211
19 HG3 PRO 6 HG2 PRO 6 -6.907 -8.755 1.699
20 HD3 PRO 6 HD2 PRO 6 -7.290 -6.475 1.684
21 H ARG 7 H ARG 7 -4.367 -6.952 -0.745
22 HA ARG 7 HA ARG 7 -2.005 -8.388 -1.330
23 HB3 ARG 7 HB2 ARG 7 -2.264 -7.467 -3.635
24 HG3 ARG 7 HG2 ARG 7 -4.478 -8.307 -4.130
25 HD3 ARG 7 HD2 ARG 7 -4.302 -10.507 -3.238
26 HE ARG 7 HE ARG 7 -1.450 -9.991 -3.023
27 HH11 ARG 7 HH11 ARG 7 -4.225 -10.087 -5.204
28 HH12 ARG 7 HH12 ARG 7 -3.240 -10.395 -6.639
29 HH21 ARG 7 HH21 ARG 7 -0.186 -10.388 -4.879
30 HH22 ARG 7 HH22 ARG 7 -0.963 -10.565 -6.456
31 H CYS 8 H CYS 8 -2.580 -4.848 -1.531
32 HA CYS 8 HA CYS 8 0.158 -4.237 -2.141
33 HB3 CYS 8 HB2 CYS 8 -0.648 -1.902 -1.169
34 H ASN 9 H ASN 9 -1.614 -4.737 0.850
35 HA ASN 9 HA ASN 9 0.325 -3.502 2.583
36 HB3 ASN 9 HB2 ASN 9 -0.913 -5.464 4.111
37 HD21 ASN 9 HD21 ASN 9 0.156 -3.375 4.985
38 HD22 ASN 9 HD22 ASN 9 -1.009 -2.077 5.421
39 H TYR 10 H TYR 10 -0.283 -6.902 1.633
40 HA TYR 10 HA TYR 10 2.024 -7.865 3.112
41 HB3 TYR 10 HB2 TYR 10 0.408 -9.214 0.914
42 HD1 TYR 10 HD1 TYR 10 1.839 -10.277 4.195
43 HD2 TYR 10 HD2 TYR 10 1.814 -10.819 -0.026
44 HE1 TYR 10 HE1 TYR 10 3.282 -12.253 4.446
45 HE2 TYR 10 HE2 TYR 10 3.256 -12.797 0.215
46 HH TYR 10 HH TYR 10 4.263 -14.191 1.613
47 H ALA 11 H ALA 11 1.377 -6.784 -0.173
48 HA ALA 11 HA ALA 11 3.872 -7.827 -1.250
49 HB1 ALA 11 HB1 ALA 11 1.750 -7.343 -2.555
50 HB2 ALA 11 HB2 ALA 11 2.175 -5.618 -2.431
51 HB3 ALA 11 HB3 ALA 11 3.266 -6.747 -3.272
52 H HIS 12 H HIS 12 2.706 -4.684 -0.045
53 HA HIS 12 HA HIS 12 5.549 -3.748 -0.131
54 HB3 HIS 12 HB2 HIS 12 4.936 -1.620 -0.756
55 HD2 HIS 12 HD2 HIS 12 1.675 -1.166 -2.000
56 HE1 HIS 12 HE1 HIS 12 3.179 -4.026 -4.750
57 HE2 HIS 12 HE2 HIS 12 1.356 -2.299 -4.326
58 HA PRO 13 HA PRO 13 3.925 -3.889 4.274
59 HB3 PRO 13 HB2 PRO 13 4.522 -6.096 4.568
60 HG3 PRO 13 HG2 PRO 13 6.148 -7.095 3.226
61 HD3 PRO 13 HD2 PRO 13 4.805 -6.150 1.597
62 H ALA 14 H ALA 14 7.143 -3.396 2.846
63 HA ALA 14 HA ALA 14 8.398 -2.105 5.013
64 HB1 ALA 14 HB1 ALA 14 9.520 -2.803 2.921
65 HB2 ALA 14 HB2 ALA 14 8.727 -1.455 2.069
66 HB3 ALA 14 HB3 ALA 14 9.892 -1.122 3.373
67 H ILE 15 H ILE 15 6.394 -0.712 2.395
68 HA ILE 15 HA ILE 15 5.594 1.458 4.196
69 HB ILE 15 HB ILE 15 6.202 3.195 2.383
70 HG13 ILE 15 HG12 ILE 15 6.890 1.468 0.698
71 HG21 ILE 15 HG21 ILE 15 8.603 2.077 3.819
72 HG22 ILE 15 HG22 ILE 15 8.142 3.774 3.545
73 HG23 ILE 15 HG23 ILE 15 7.239 2.784 4.719
74 HD11 ILE 15 HD11 ILE 15 7.953 3.916 0.977
75 HD12 ILE 15 HD12 ILE 15 9.424 2.932 1.166
76 HD13 ILE 15 HD13 ILE 15 8.432 2.778 -0.303
77 H CYS 16 H CYS 16 3.537 1.959 3.843
78 HA CYS 16 HA CYS 16 2.165 0.740 1.575
79 HB3 CYS 16 HB2 CYS 16 1.066 2.690 3.635
80 H GLY 17 H GLY 17 3.844 2.188 0.250
81 HA2 GLY 17 HA1 GLY 17 3.052 4.950 -0.133
82 HA3 GLY 17 HA2 GLY 17 4.131 4.003 -1.175
83 H GLY 18 H GLY 18 2.180 1.872 -1.648
84 HA2 GLY 18 HA1 GLY 18 1.023 2.846 -4.026
85 HA3 GLY 18 HA2 GLY 18 0.490 1.392 -3.159
86 H ALA 19 H ALA 19 -0.096 3.138 -0.739
87 HA ALA 19 HA ALA 19 -2.870 3.422 -1.155
88 HB1 ALA 19 HB1 ALA 19 -2.073 5.322 0.808
89 HB2 ALA 19 HB2 ALA 19 -2.757 3.697 1.048
90 HB3 ALA 19 HB3 ALA 19 -0.994 3.914 0.943
91 H ALA 20 H ALA 20 -0.215 5.674 -1.737
92 HA ALA 20 HA ALA 20 -1.669 8.076 -1.963
93 HB1 ALA 20 HB1 ALA 20 0.858 7.688 -2.067
94 HB2 ALA 20 HB2 ALA 20 0.617 7.358 -3.801
95 HB3 ALA 20 HB3 ALA 20 0.180 8.947 -3.127
96 H GLY 21 H GLY 21 -1.340 5.376 -4.218
97 HA2 GLY 21 HA1 GLY 21 -2.417 6.755 -6.505
98 HA3 GLY 21 HA2 GLY 21 -2.335 4.997 -6.280
99 H GLY 22 H GLY 22 -3.931 4.397 -4.248
100 HA2 GLY 22 HA1 GLY 22 -6.284 5.573 -3.661
101 HA3 GLY 22 HA2 GLY 22 -6.575 5.131 -5.355
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -6.531 2.025 -3.845
2 HA2 GLY 1 HA1 GLY 1 -6.895 2.550 -1.044
3 HA3 GLY 1 HA2 GLY 1 -7.916 1.530 -2.075
4 H CYS 2 H CYS 2 -4.361 1.939 -1.894
5 HA CYS 2 HA CYS 2 -3.974 -0.927 -2.088
6 HB3 CYS 2 HB2 CYS 2 -1.544 -0.025 -1.301
7 H CYS 3 H CYS 3 -3.676 1.490 0.525
8 HA CYS 3 HA CYS 3 -2.684 -0.277 2.511
9 HB3 CYS 3 HB2 CYS 3 -4.075 1.458 4.024
10 H SER 4 H SER 4 -5.956 0.349 1.341
11 HA SER 4 HA SER 4 -7.241 -1.110 3.499
12 HB3 SER 4 HB2 SER 4 -8.797 -0.967 1.031
13 HG SER 4 HG SER 4 -10.133 0.299 2.430
14 H ASP 5 H ASP 5 -6.019 -1.868 0.277
15 HA ASP 5 HA ASP 5 -7.199 -4.564 0.350
16 HB3 ASP 5 HB2 ASP 5 -5.105 -3.773 -1.651
17 HA PRO 6 HA PRO 6 -3.786 -6.474 2.402
18 HB3 PRO 6 HB2 PRO 6 -5.240 -8.209 2.840
19 HG3 PRO 6 HG2 PRO 6 -6.898 -8.808 1.312
20 HD3 PRO 6 HD2 PRO 6 -7.267 -6.528 1.436
21 H ARG 7 H ARG 7 -4.370 -6.836 -1.055
22 HA ARG 7 HA ARG 7 -2.020 -8.260 -1.752
23 HB3 ARG 7 HB2 ARG 7 -2.891 -6.121 -3.619
24 HG3 ARG 7 HG2 ARG 7 -1.505 -8.281 -4.097
25 HD3 ARG 7 HD2 ARG 7 -3.487 -9.862 -5.107
26 HE ARG 7 HE ARG 7 -1.558 -10.153 -3.065
27 HH11 ARG 7 HH11 ARG 7 -4.724 -11.426 -3.967
28 HH12 ARG 7 HH12 ARG 7 -4.443 -12.999 -3.212
29 HH21 ARG 7 HH21 ARG 7 -1.200 -12.184 -2.093
30 HH22 ARG 7 HH22 ARG 7 -2.455 -13.426 -2.155
31 H CYS 8 H CYS 8 -2.606 -4.715 -1.749
32 HA CYS 8 HA CYS 8 0.144 -4.089 -2.339
33 HB3 CYS 8 HB2 CYS 8 -0.678 -1.780 -1.325
34 H ASN 9 H ASN 9 -1.673 -4.667 0.608
35 HA ASN 9 HA ASN 9 0.231 -3.471 2.404
36 HB3 ASN 9 HB2 ASN 9 -1.190 -5.707 3.594
37 HD21 ASN 9 HD21 ASN 9 -1.813 -2.258 2.874
38 HD22 ASN 9 HD22 ASN 9 -1.759 -1.731 4.593
39 H TYR 10 H TYR 10 -0.336 -6.844 1.339
40 HA TYR 10 HA TYR 10 1.944 -7.838 2.837
41 HB3 TYR 10 HB2 TYR 10 0.355 -9.110 0.575
42 HD1 TYR 10 HD1 TYR 10 2.045 -10.164 3.750
43 HD2 TYR 10 HD2 TYR 10 1.557 -10.805 -0.427
44 HE1 TYR 10 HE1 TYR 10 3.516 -12.132 3.885
45 HE2 TYR 10 HE2 TYR 10 3.025 -12.774 -0.303
46 HH TYR 10 HH TYR 10 4.084 -14.207 1.055
47 H ALA 11 H ALA 11 1.365 -6.656 -0.425
48 HA ALA 11 HA ALA 11 3.891 -7.647 -1.477
49 HB1 ALA 11 HB1 ALA 11 1.809 -7.153 -2.826
50 HB2 ALA 11 HB2 ALA 11 2.183 -5.424 -2.620
51 HB3 ALA 11 HB3 ALA 11 3.326 -6.488 -3.476
52 H HIS 12 H HIS 12 2.672 -4.554 -0.197
53 HA HIS 12 HA HIS 12 5.508 -3.594 -0.189
54 HB3 HIS 12 HB2 HIS 12 4.893 -1.454 -0.765
55 HD2 HIS 12 HD2 HIS 12 1.656 -0.980 -2.062
56 HE1 HIS 12 HE1 HIS 12 3.228 -3.748 -4.864
57 HE2 HIS 12 HE2 HIS 12 1.389 -2.042 -4.425
58 HA PRO 13 HA PRO 13 3.782 -3.885 4.168
59 HB3 PRO 13 HB2 PRO 13 4.383 -6.097 4.407
60 HG3 PRO 13 HG2 PRO 13 6.045 -7.046 3.072
61 HD3 PRO 13 HD2 PRO 13 4.736 -6.056 1.444
62 H ALA 14 H ALA 14 7.120 -3.476 2.956
63 HA ALA 14 HA ALA 14 8.203 -2.147 5.193
64 HB1 ALA 14 HB1 ALA 14 8.804 -2.162 2.260
65 HB2 ALA 14 HB2 ALA 14 9.616 -0.967 3.301
66 HB3 ALA 14 HB3 ALA 14 9.796 -2.706 3.634
67 H ILE 15 H ILE 15 6.508 -0.790 2.347
68 HA ILE 15 HA ILE 15 5.737 1.527 4.011
69 HB ILE 15 HB ILE 15 7.097 1.937 1.328
70 HG13 ILE 15 HG12 ILE 15 8.708 1.186 3.050
71 HG21 ILE 15 HG21 ILE 15 6.382 4.050 1.419
72 HG22 ILE 15 HG22 ILE 15 5.294 3.536 2.729
73 HG23 ILE 15 HG23 ILE 15 6.890 4.224 3.116
74 HD11 ILE 15 HD11 ILE 15 9.541 2.834 1.480
75 HD12 ILE 15 HD12 ILE 15 8.905 4.153 2.492
76 HD13 ILE 15 HD13 ILE 15 10.221 3.121 3.098
77 H CYS 16 H CYS 16 3.686 2.056 3.666
78 HA CYS 16 HA CYS 16 2.256 0.729 1.473
79 HB3 CYS 16 HB2 CYS 16 1.170 2.697 3.520
80 H GLY 17 H GLY 17 3.950 2.241 0.164
81 HA2 GLY 17 HA1 GLY 17 3.122 4.968 -0.248
82 HA3 GLY 17 HA2 GLY 17 4.154 4.008 -1.325
83 H GLY 18 H GLY 18 2.210 1.889 -1.752
84 HA2 GLY 18 HA1 GLY 18 0.957 2.849 -4.072
85 HA3 GLY 18 HA2 GLY 18 0.442 1.411 -3.171
86 H ALA 19 H ALA 19 -0.087 3.094 -0.739
87 HA ALA 19 HA ALA 19 -2.858 3.459 -1.115
88 HB1 ALA 19 HB1 ALA 19 -2.743 3.680 1.095
89 HB2 ALA 19 HB2 ALA 19 -0.969 3.783 0.987
90 HB3 ALA 19 HB3 ALA 19 -1.951 5.265 0.910
91 H ALA 20 H ALA 20 -0.155 5.645 -1.679
92 HA ALA 20 HA ALA 20 -1.521 8.104 -1.772
93 HB1 ALA 20 HB1 ALA 20 0.394 8.944 -2.651
94 HB2 ALA 20 HB2 ALA 20 1.032 7.353 -2.166
95 HB3 ALA 20 HB3 ALA 20 0.547 7.641 -3.855
96 H GLY 21 H GLY 21 -1.122 5.615 -4.305
97 HA2 GLY 21 HA1 GLY 21 -2.481 7.169 -6.332
98 HA3 GLY 21 HA2 GLY 21 -2.139 5.430 -6.386
99 H GLY 22 H GLY 22 -3.511 4.522 -4.150
100 HA2 GLY 22 HA1 GLY 22 -6.234 5.541 -4.161
101 HA3 GLY 22 HA2 GLY 22 -6.072 4.069 -5.137
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -6.574 1.878 -3.762
2 HA2 GLY 1 HA1 GLY 1 -6.877 2.463 -0.964
3 HA3 GLY 1 HA2 GLY 1 -7.926 1.433 -1.955
4 H CYS 2 H CYS 2 -4.366 1.808 -1.876
5 HA CYS 2 HA CYS 2 -4.013 -1.065 -2.001
6 HB3 CYS 2 HB2 CYS 2 -1.552 -0.170 -1.308
7 H CYS 3 H CYS 3 -3.618 1.417 0.536
8 HA CYS 3 HA CYS 3 -2.585 -0.305 2.541
9 HB3 CYS 3 HB2 CYS 3 -3.918 1.483 4.044
10 H SER 4 H SER 4 -5.883 0.319 1.445
11 HA SER 4 HA SER 4 -7.122 -1.067 3.677
12 HB3 SER 4 HB2 SER 4 -8.099 -0.081 0.983
13 HG SER 4 HG SER 4 -10.202 -0.730 1.689
14 H ASP 5 H ASP 5 -5.987 -1.932 0.450
15 HA ASP 5 HA ASP 5 -7.182 -4.615 0.639
16 HB3 ASP 5 HB2 ASP 5 -5.146 -3.899 -1.447
17 HA PRO 6 HA PRO 6 -3.719 -6.481 2.647
18 HB3 PRO 6 HB2 PRO 6 -5.167 -8.193 3.185
19 HG3 PRO 6 HG2 PRO 6 -6.875 -8.829 1.728
20 HD3 PRO 6 HD2 PRO 6 -7.228 -6.544 1.791
21 H ARG 7 H ARG 7 -4.411 -6.951 -0.777
22 HA ARG 7 HA ARG 7 -2.092 -8.412 -1.498
23 HB3 ARG 7 HB2 ARG 7 -3.762 -6.386 -3.022
24 HG3 ARG 7 HG2 ARG 7 -1.610 -6.448 -4.131
25 HD3 ARG 7 HD2 ARG 7 -0.601 -8.446 -3.354
26 HE ARG 7 HE ARG 7 -2.029 -10.210 -2.951
27 HH11 ARG 7 HH11 ARG 7 -2.510 -9.002 -6.233
28 HH12 ARG 7 HH12 ARG 7 -3.619 -10.302 -6.680
29 HH21 ARG 7 HH21 ARG 7 -3.460 -11.886 -3.534
30 HH22 ARG 7 HH22 ARG 7 -4.157 -11.927 -5.157
31 H CYS 8 H CYS 8 -2.658 -4.864 -1.595
32 HA CYS 8 HA CYS 8 0.071 -4.272 -2.294
33 HB3 CYS 8 HB2 CYS 8 -0.704 -1.930 -1.311
34 H ASN 9 H ASN 9 -1.644 -4.753 0.733
35 HA ASN 9 HA ASN 9 0.332 -3.520 2.424
36 HB3 ASN 9 HB2 ASN 9 -1.049 -5.698 3.744
37 HD21 ASN 9 HD21 ASN 9 -1.701 -2.287 2.886
38 HD22 ASN 9 HD22 ASN 9 -1.604 -1.682 4.576
39 H TYR 10 H TYR 10 -0.298 -6.916 1.477
40 HA TYR 10 HA TYR 10 2.027 -7.890 2.922
41 HB3 TYR 10 HB2 TYR 10 0.622 -9.353 0.674
42 HD1 TYR 10 HD1 TYR 10 1.454 -11.478 0.382
43 HD2 TYR 10 HD2 TYR 10 1.901 -9.637 4.190
44 HE1 TYR 10 HE1 TYR 10 2.703 -13.441 1.178
45 HE2 TYR 10 HE2 TYR 10 3.152 -11.594 4.998
46 HH TYR 10 HH TYR 10 4.166 -13.507 4.418
47 H ALA 11 H ALA 11 1.339 -6.797 -0.349
48 HA ALA 11 HA ALA 11 3.819 -7.840 -1.462
49 HB1 ALA 11 HB1 ALA 11 2.092 -5.635 -2.608
50 HB2 ALA 11 HB2 ALA 11 3.193 -6.736 -3.472
51 HB3 ALA 11 HB3 ALA 11 1.693 -7.364 -2.749
52 H HIS 12 H HIS 12 2.671 -4.701 -0.230
53 HA HIS 12 HA HIS 12 5.513 -3.764 -0.351
54 HB3 HIS 12 HB2 HIS 12 4.892 -1.636 -0.965
55 HD2 HIS 12 HD2 HIS 12 1.615 -1.172 -2.160
56 HE1 HIS 12 HE1 HIS 12 3.066 -4.033 -4.935
57 HE2 HIS 12 HE2 HIS 12 1.259 -2.300 -4.483
58 HA PRO 13 HA PRO 13 3.944 -3.915 4.072
59 HB3 PRO 13 HB2 PRO 13 4.535 -6.125 4.354
60 HG3 PRO 13 HG2 PRO 13 6.141 -7.126 2.987
61 HD3 PRO 13 HD2 PRO 13 4.782 -6.171 1.379
62 H ALA 14 H ALA 14 7.227 -3.552 2.715
63 HA ALA 14 HA ALA 14 8.413 -2.184 4.872
64 HB1 ALA 14 HB1 ALA 14 9.995 -1.293 3.228
65 HB2 ALA 14 HB2 ALA 14 9.657 -3.015 2.930
66 HB3 ALA 14 HB3 ALA 14 8.901 -1.770 1.907
67 H ILE 15 H ILE 15 6.594 -0.876 2.081
68 HA ILE 15 HA ILE 15 5.889 1.467 3.732
69 HB ILE 15 HB ILE 15 7.352 1.722 1.083
70 HG13 ILE 15 HG12 ILE 15 8.992 2.988 2.365
71 HG21 ILE 15 HG21 ILE 15 7.035 4.266 1.845
72 HG22 ILE 15 HG22 ILE 15 5.856 3.420 0.815
73 HG23 ILE 15 HG23 ILE 15 5.556 3.584 2.562
74 HD11 ILE 15 HD11 ILE 15 8.467 4.006 4.261
75 HD12 ILE 15 HD12 ILE 15 6.917 3.134 4.354
76 HD13 ILE 15 HD13 ILE 15 8.390 2.411 5.045
77 H CYS 16 H CYS 16 3.831 1.998 3.441
78 HA CYS 16 HA CYS 16 2.329 0.641 1.319
79 HB3 CYS 16 HB2 CYS 16 1.320 2.658 3.358
80 H GLY 17 H GLY 17 3.983 2.107 -0.083
81 HA2 GLY 17 HA1 GLY 17 3.160 4.832 -0.524
82 HA3 GLY 17 HA2 GLY 17 4.154 3.842 -1.610
83 H GLY 18 H GLY 18 2.190 1.727 -1.935
84 HA2 GLY 18 HA1 GLY 18 0.870 2.645 -4.237
85 HA3 GLY 18 HA2 GLY 18 0.377 1.229 -3.290
86 H ALA 19 H ALA 19 -0.069 2.967 -0.878
87 HA ALA 19 HA ALA 19 -2.849 3.336 -1.176
88 HB1 ALA 19 HB1 ALA 19 -0.889 3.706 0.855
89 HB2 ALA 19 HB2 ALA 19 -1.882 5.183 0.778
90 HB3 ALA 19 HB3 ALA 19 -2.658 3.599 1.023
91 H ALA 20 H ALA 20 -0.156 5.502 -1.862
92 HA ALA 20 HA ALA 20 -1.523 7.960 -1.974
93 HB1 ALA 20 HB1 ALA 20 0.815 8.034 -2.158
94 HB2 ALA 20 HB2 ALA 20 0.838 6.871 -3.505
95 HB3 ALA 20 HB3 ALA 20 0.231 8.524 -3.766
96 H GLY 21 H GLY 21 -1.224 5.394 -4.434
97 HA2 GLY 21 HA1 GLY 21 -2.599 6.902 -6.484
98 HA3 GLY 21 HA2 GLY 21 -2.295 5.155 -6.483
99 H GLY 22 H GLY 22 -3.632 4.341 -4.201
100 HA2 GLY 22 HA1 GLY 22 -6.336 5.425 -4.187
101 HA3 GLY 22 HA2 GLY 22 -6.222 3.908 -5.100
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -6.788 1.914 -3.618
2 HA2 GLY 1 HA1 GLY 1 -6.989 2.543 -0.821
3 HA3 GLY 1 HA2 GLY 1 -8.089 1.518 -1.761
4 H CYS 2 H CYS 2 -4.520 1.838 -1.769
5 HA CYS 2 HA CYS 2 -4.212 -1.040 -1.892
6 HB3 CYS 2 HB2 CYS 2 -1.726 -0.179 -1.249
7 H CYS 3 H CYS 3 -3.729 1.445 0.628
8 HA CYS 3 HA CYS 3 -2.687 -0.289 2.619
9 HB3 CYS 3 HB2 CYS 3 -3.957 1.528 4.142
10 H SER 4 H SER 4 -5.995 0.392 1.588
11 HA SER 4 HA SER 4 -7.210 -0.970 3.847
12 HB3 SER 4 HB2 SER 4 -8.549 -0.512 1.170
13 HG SER 4 HG SER 4 -10.337 -0.109 2.579
14 H ASP 5 H ASP 5 -6.160 -1.855 0.598
15 HA ASP 5 HA ASP 5 -7.404 -4.516 0.810
16 HB3 ASP 5 HB2 ASP 5 -5.392 -3.840 -1.312
17 HA PRO 6 HA PRO 6 -3.945 -6.454 2.755
18 HB3 PRO 6 HB2 PRO 6 -5.416 -8.137 3.314
19 HG3 PRO 6 HG2 PRO 6 -7.163 -8.736 1.885
20 HD3 PRO 6 HD2 PRO 6 -7.468 -6.445 1.958
21 H ARG 7 H ARG 7 -4.704 -6.906 -0.658
22 HA ARG 7 HA ARG 7 -2.427 -8.409 -1.421
23 HB3 ARG 7 HB2 ARG 7 -3.364 -6.291 -3.293
24 HG3 ARG 7 HG2 ARG 7 -3.807 -8.382 -4.699
25 HD3 ARG 7 HD2 ARG 7 -1.420 -6.952 -4.098
26 HE ARG 7 HE ARG 7 -0.848 -9.565 -3.507
27 HH11 ARG 7 HH11 ARG 7 -0.012 -7.411 -6.175
28 HH12 ARG 7 HH12 ARG 7 1.546 -8.189 -6.477
29 HH21 ARG 7 HH21 ARG 7 1.163 -10.566 -3.901
30 HH22 ARG 7 HH22 ARG 7 2.208 -9.969 -5.195
31 H CYS 8 H CYS 8 -2.923 -4.852 -1.501
32 HA CYS 8 HA CYS 8 -0.191 -4.316 -2.240
33 HB3 CYS 8 HB2 CYS 8 -0.912 -1.956 -1.251
34 H ASN 9 H ASN 9 -1.878 -4.758 0.806
35 HA ASN 9 HA ASN 9 0.138 -3.557 2.474
36 HB3 ASN 9 HB2 ASN 9 -1.375 -5.782 3.678
37 HD21 ASN 9 HD21 ASN 9 -1.344 -2.228 3.271
38 HD22 ASN 9 HD22 ASN 9 -1.197 -1.873 5.028
39 H TYR 10 H TYR 10 -0.559 -6.946 1.541
40 HA TYR 10 HA TYR 10 1.768 -7.951 2.960
41 HB3 TYR 10 HB2 TYR 10 0.373 -9.433 0.727
42 HD1 TYR 10 HD1 TYR 10 2.426 -10.804 0.622
43 HD2 TYR 10 HD2 TYR 10 0.219 -10.399 4.236
44 HE1 TYR 10 HE1 TYR 10 3.590 -12.764 1.546
45 HE2 TYR 10 HE2 TYR 10 1.377 -12.356 5.170
46 HH TYR 10 HH TYR 10 3.064 -13.806 4.904
47 H ALA 11 H ALA 11 1.058 -6.853 -0.306
48 HA ALA 11 HA ALA 11 3.504 -7.939 -1.448
49 HB1 ALA 11 HB1 ALA 11 1.797 -5.709 -2.573
50 HB2 ALA 11 HB2 ALA 11 2.873 -6.824 -3.451
51 HB3 ALA 11 HB3 ALA 11 1.372 -7.432 -2.710
52 H HIS 12 H HIS 12 2.425 -4.777 -0.211
53 HA HIS 12 HA HIS 12 5.281 -3.892 -0.365
54 HB3 HIS 12 HB2 HIS 12 4.692 -1.755 -0.981
55 HD2 HIS 12 HD2 HIS 12 1.415 -1.233 -2.146
56 HE1 HIS 12 HE1 HIS 12 2.781 -4.135 -4.922
57 HE2 HIS 12 HE2 HIS 12 1.013 -2.365 -4.459
58 HA PRO 13 HA PRO 13 3.754 -4.000 4.075
59 HB3 PRO 13 HB2 PRO 13 4.310 -6.219 4.357
60 HG3 PRO 13 HG2 PRO 13 5.883 -7.253 2.979
61 HD3 PRO 13 HD2 PRO 13 4.524 -6.280 1.380
62 H ALA 14 H ALA 14 7.044 -3.723 2.703
63 HA ALA 14 HA ALA 14 8.259 -2.352 4.843
64 HB1 ALA 14 HB1 ALA 14 9.673 -3.111 3.135
65 HB2 ALA 14 HB2 ALA 14 8.722 -2.305 1.863
66 HB3 ALA 14 HB3 ALA 14 9.713 -1.338 2.981
67 H ILE 15 H ILE 15 6.473 -1.043 2.031
68 HA ILE 15 HA ILE 15 5.842 1.350 3.649
69 HB ILE 15 HB ILE 15 7.057 1.640 0.883
70 HG13 ILE 15 HG12 ILE 15 8.746 0.865 2.520
71 HG21 ILE 15 HG21 ILE 15 5.358 3.320 2.178
72 HG22 ILE 15 HG22 ILE 15 6.929 3.919 2.762
73 HG23 ILE 15 HG23 ILE 15 6.598 3.847 1.015
74 HD11 ILE 15 HD11 ILE 15 10.166 2.165 1.426
75 HD12 ILE 15 HD12 ILE 15 8.891 3.362 1.098
76 HD13 ILE 15 HD13 ILE 15 9.833 3.453 2.606
77 H CYS 16 H CYS 16 3.791 1.923 3.386
78 HA CYS 16 HA CYS 16 2.222 0.563 1.311
79 HB3 CYS 16 HB2 CYS 16 1.284 2.617 3.345
80 H GLY 17 H GLY 17 3.888 2.001 -0.119
81 HA2 GLY 17 HA1 GLY 17 3.100 4.732 -0.573
82 HA3 GLY 17 HA2 GLY 17 4.056 3.717 -1.671
83 H GLY 18 H GLY 18 2.047 1.633 -1.938
84 HA2 GLY 18 HA1 GLY 18 0.702 2.554 -4.224
85 HA3 GLY 18 HA2 GLY 18 0.199 1.157 -3.255
86 H ALA 19 H ALA 19 -0.170 2.923 -0.852
87 HA ALA 19 HA ALA 19 -2.948 3.344 -1.105
88 HB1 ALA 19 HB1 ALA 19 -1.887 5.188 0.815
89 HB2 ALA 19 HB2 ALA 19 -2.727 3.642 1.087
90 HB3 ALA 19 HB3 ALA 19 -0.957 3.672 0.894
91 H ALA 20 H ALA 20 -0.225 5.448 -1.860
92 HA ALA 20 HA ALA 20 -1.540 7.935 -1.966
93 HB1 ALA 20 HB1 ALA 20 0.896 7.608 -2.205
94 HB2 ALA 20 HB2 ALA 20 0.632 6.939 -3.834
95 HB3 ALA 20 HB3 ALA 20 0.218 8.636 -3.491
96 H GLY 21 H GLY 21 -1.291 5.379 -4.454
97 HA2 GLY 21 HA1 GLY 21 -2.726 6.906 -6.449
98 HA3 GLY 21 HA2 GLY 21 -2.404 5.162 -6.482
99 H GLY 22 H GLY 22 -3.681 4.340 -4.144
100 HA2 GLY 22 HA1 GLY 22 -6.391 5.380 -4.060
101 HA3 GLY 22 HA2 GLY 22 -6.289 3.886 -5.011
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -6.367 1.964 -4.030
2 HA2 GLY 1 HA1 GLY 1 -6.832 2.469 -1.238
3 HA3 GLY 1 HA2 GLY 1 -7.813 1.453 -2.312
4 H CYS 2 H CYS 2 -4.267 1.868 -2.021
5 HA CYS 2 HA CYS 2 -3.869 -0.996 -2.206
6 HB3 CYS 2 HB2 CYS 2 -1.464 -0.093 -1.349
7 H CYS 3 H CYS 3 -3.652 1.418 0.418
8 HA CYS 3 HA CYS 3 -2.715 -0.352 2.429
9 HB3 CYS 3 HB2 CYS 3 -4.151 1.379 3.904
10 H SER 4 H SER 4 -5.951 0.270 1.163
11 HA SER 4 HA SER 4 -7.302 -1.187 3.281
12 HB3 SER 4 HB2 SER 4 -8.556 -0.856 0.576
13 HG SER 4 HG SER 4 -10.300 -0.182 1.934
14 H ASP 5 H ASP 5 -5.967 -1.959 0.107
15 HA ASP 5 HA ASP 5 -7.133 -4.664 0.170
16 HB3 ASP 5 HB2 ASP 5 -5.010 -3.868 -1.796
17 HA PRO 6 HA PRO 6 -3.743 -6.524 2.302
18 HB3 PRO 6 HB2 PRO 6 -5.185 -8.273 2.723
19 HG3 PRO 6 HG2 PRO 6 -6.807 -8.899 1.166
20 HD3 PRO 6 HD2 PRO 6 -7.202 -6.624 1.267
21 H ARG 7 H ARG 7 -4.255 -6.927 -1.164
22 HA ARG 7 HA ARG 7 -1.881 -8.329 -1.806
23 HB3 ARG 7 HB2 ARG 7 -2.142 -7.343 -4.064
24 HG3 ARG 7 HG2 ARG 7 -4.717 -7.795 -4.301
25 HD3 ARG 7 HD2 ARG 7 -2.670 -9.301 -4.810
26 HE ARG 7 HE ARG 7 -1.920 -10.425 -2.944
27 HH11 ARG 7 HH11 ARG 7 -5.448 -10.411 -3.002
28 HH12 ARG 7 HH12 ARG 7 -5.597 -11.504 -1.622
29 HH21 ARG 7 HH21 ARG 7 -2.117 -11.835 -1.163
30 HH22 ARG 7 HH22 ARG 7 -3.718 -12.307 -0.585
31 H CYS 8 H CYS 8 -2.484 -4.789 -1.823
32 HA CYS 8 HA CYS 8 0.272 -4.147 -2.359
33 HB3 CYS 8 HB2 CYS 8 -0.597 -1.844 -1.341
34 H ASN 9 H ASN 9 -1.591 -4.754 0.550
35 HA ASN 9 HA ASN 9 0.262 -3.538 2.387
36 HB3 ASN 9 HB2 ASN 9 -1.005 -5.597 3.784
37 HD21 ASN 9 HD21 ASN 9 0.176 -3.282 4.431
38 HD22 ASN 9 HD22 ASN 9 -1.042 -2.119 5.063
39 H TYR 10 H TYR 10 -0.246 -6.918 1.313
40 HA TYR 10 HA TYR 10 2.025 -7.883 2.845
41 HB3 TYR 10 HB2 TYR 10 0.347 -9.120 0.635
42 HD1 TYR 10 HD1 TYR 10 2.204 -10.092 -0.645
43 HD2 TYR 10 HD2 TYR 10 1.725 -10.914 3.503
44 HE1 TYR 10 HE1 TYR 10 3.747 -11.996 -0.850
45 HE2 TYR 10 HE2 TYR 10 3.268 -12.820 3.309
46 HH TYR 10 HH TYR 10 4.752 -13.870 1.998
47 H ALA 11 H ALA 11 1.476 -6.709 -0.425
48 HA ALA 11 HA ALA 11 4.026 -7.674 -1.443
49 HB1 ALA 11 HB1 ALA 11 3.478 -6.524 -3.450
50 HB2 ALA 11 HB2 ALA 11 1.956 -7.200 -2.821
51 HB3 ALA 11 HB3 ALA 11 2.315 -5.469 -2.611
52 H HIS 12 H HIS 12 2.756 -4.585 -0.201
53 HA HIS 12 HA HIS 12 5.584 -3.604 -0.136
54 HB3 HIS 12 HB2 HIS 12 4.968 -1.472 -0.744
55 HD2 HIS 12 HD2 HIS 12 1.768 -1.023 -2.127
56 HE1 HIS 12 HE1 HIS 12 3.413 -3.818 -4.861
57 HE2 HIS 12 HE2 HIS 12 1.563 -2.111 -4.486
58 HA PRO 13 HA PRO 13 3.751 -3.867 4.180
59 HB3 PRO 13 HB2 PRO 13 4.351 -6.077 4.452
60 HG3 PRO 13 HG2 PRO 13 6.049 -7.032 3.167
61 HD3 PRO 13 HD2 PRO 13 4.776 -6.058 1.499
62 H ALA 14 H ALA 14 7.108 -3.445 3.036
63 HA ALA 14 HA ALA 14 8.143 -2.107 5.289
64 HB1 ALA 14 HB1 ALA 14 9.616 -0.940 3.472
65 HB2 ALA 14 HB2 ALA 14 9.736 -2.699 3.718
66 HB3 ALA 14 HB3 ALA 14 8.789 -2.053 2.356
67 H ILE 15 H ILE 15 6.487 -0.765 2.413
68 HA ILE 15 HA ILE 15 5.676 1.551 4.062
69 HB ILE 15 HB ILE 15 7.052 1.972 1.390
70 HG13 ILE 15 HG12 ILE 15 8.659 1.205 3.109
71 HG21 ILE 15 HG21 ILE 15 6.309 4.072 1.490
72 HG22 ILE 15 HG22 ILE 15 5.262 3.564 2.834
73 HG23 ILE 15 HG23 ILE 15 6.867 4.256 3.170
74 HD11 ILE 15 HD11 ILE 15 9.089 3.266 1.497
75 HD12 ILE 15 HD12 ILE 15 9.183 4.134 3.048
76 HD13 ILE 15 HD13 ILE 15 10.270 2.762 2.728
77 H CYS 16 H CYS 16 3.627 2.068 3.687
78 HA CYS 16 HA CYS 16 2.242 0.732 1.468
79 HB3 CYS 16 HB2 CYS 16 1.094 2.660 3.519
80 H GLY 17 H GLY 17 3.949 2.310 0.225
81 HA2 GLY 17 HA1 GLY 17 3.068 5.019 -0.172
82 HA3 GLY 17 HA2 GLY 17 4.141 4.096 -1.240
83 H GLY 18 H GLY 18 2.247 1.942 -1.730
84 HA2 GLY 18 HA1 GLY 18 1.025 2.906 -4.067
85 HA3 GLY 18 HA2 GLY 18 0.517 1.449 -3.191
86 H ALA 19 H ALA 19 -0.097 3.088 -0.752
87 HA ALA 19 HA ALA 19 -2.864 3.414 -1.188
88 HB1 ALA 19 HB1 ALA 19 -1.039 3.718 0.962
89 HB2 ALA 19 HB2 ALA 19 -2.015 5.204 0.883
90 HB3 ALA 19 HB3 ALA 19 -2.816 3.620 1.025
91 H ALA 20 H ALA 20 -0.184 5.661 -1.633
92 HA ALA 20 HA ALA 20 -1.601 8.091 -1.734
93 HB1 ALA 20 HB1 ALA 20 0.235 8.870 -3.233
94 HB2 ALA 20 HB2 ALA 20 0.807 8.043 -1.765
95 HB3 ALA 20 HB3 ALA 20 0.815 7.189 -3.327
96 H GLY 21 H GLY 21 -1.095 5.630 -4.266
97 HA2 GLY 21 HA1 GLY 21 -2.378 7.189 -6.338
98 HA3 GLY 21 HA2 GLY 21 -2.036 5.448 -6.383
99 H GLY 22 H GLY 22 -3.487 4.492 -4.250
100 HA2 GLY 22 HA1 GLY 22 -6.217 5.529 -4.377
101 HA3 GLY 22 HA2 GLY 22 -5.996 4.030 -5.299