Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
15310 | 1xy4 RC | 6422 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H TYR 1 1H TYR 1 -6.186 -9.147 1.858
2 2H TYR 1 2H TYR 1 -5.389 -7.998 2.793
3 3H TYR 1 3H TYR 1 -5.647 -7.498 2.496
4 HA TYR 1 HA TYR 1 -4.064 -9.360 1.172
5 1HB TYR 1 1HB TYR 1 -4.309 -7.500 -0.959
6 2HB TYR 1 2HB TYR 1 -4.954 -9.130 -0.969
7 HD1 TYR 1 HD1 TYR 1 -7.280 -9.500 -1.072
8 HD2 TYR 1 HD2 TYR 1 -5.813 -5.618 -0.037
9 HE1 TYR 1 HE1 TYR 1 -9.636 -8.559 -1.238
10 HE2 TYR 1 HE2 TYR 1 -8.174 -4.689 -0.205
11 HH TYR 1 HH TYR 1 -10.228 -5.090 -0.751
12 H CYS 2 H CYS 2 -2.443 -7.686 -0.419
13 HA CYS 2 HA CYS 2 -1.243 -6.129 1.672
14 1HB CYS 2 1HB CYS 2 -0.295 -6.385 -1.180
15 2HB CYS 2 2HB CYS 2 0.637 -5.918 0.229
16 H LYS 3 H LYS 3 -0.529 -3.811 1.179
17 HA LYS 3 HA LYS 3 -1.969 -2.430 -0.869
18 1HB LYS 3 1HB LYS 3 -3.115 -0.901 0.818
19 2HB LYS 3 2HB LYS 3 -3.829 -2.478 0.556
20 1HG LYS 3 1HG LYS 3 -2.833 -3.358 2.602
21 2HG LYS 3 2HG LYS 3 -1.851 -1.922 2.811
22 1HD LYS 3 1HD LYS 3 -3.517 -1.051 4.077
23 2HD LYS 3 2HD LYS 3 -4.481 -0.920 2.620
24 1HE LYS 3 1HE LYS 3 -5.559 -3.028 2.997
25 2HE LYS 3 2HE LYS 3 -4.350 -3.538 4.159
26 1HZ LYS 3 1HZ LYS 3 -6.097 -2.829 5.501
27 2HZ LYS 3 2HZ LYS 3 -5.187 -1.480 5.482
28 1HN DHN 4 1HN DHN 4 -0.689 -0.791 -1.568
29 HA DHN 4 HA DHN 4 1.526 -0.066 0.217
30 1HB DHN 4 1HB DHN 4 1.349 0.710 -2.739
31 2HB DHN 4 2HB DHN 4 2.777 0.499 -1.756
32 1HG DHN 4 1HG DHN 4 2.080 -2.108 -1.728
33 2HG DHN 4 2HG DHN 4 1.046 -1.694 -3.073
34 H PHE 5 H PHE 5 -1.396 0.931 0.240
35 HA PHE 5 HA PHE 5 -2.523 2.865 0.223
36 1HB PHE 5 1HB PHE 5 0.107 3.906 1.415
37 2HB PHE 5 2HB PHE 5 -1.515 4.383 1.877
38 HD1 PHE 5 HD1 PHE 5 -2.565 3.348 3.680
39 HD2 PHE 5 HD2 PHE 5 0.772 1.448 1.873
40 HE1 PHE 5 HE1 PHE 5 -2.547 1.634 5.514
41 HE2 PHE 5 HE2 PHE 5 0.789 -0.268 3.706
42 HZ PHE 5 HZ PHE 5 -0.869 -0.153 5.505
43 H DTR 6 H DTR 6 -1.267 5.592 0.404
44 HA DTR 6 HA DTR 6 -0.897 7.264 -0.960
45 1HB DTR 6 1HB DTR 6 -1.018 5.786 -3.524
46 2HB DTR 6 2HB DTR 6 -2.327 5.312 -2.459
47 HD1 DTR 6 HD1 DTR 6 -3.560 7.817 -1.325
48 HE1 DTR 6 HE1 DTR 6 -4.522 9.859 -2.692
49 HZ2 DTR 6 HZ2 DTR 6 -4.077 10.841 -5.334
50 HH2 DTR 6 HH2 DTR 6 -2.750 10.365 -7.426
51 HZ3 DTR 6 HZ3 DTR 6 -1.232 8.450 -7.494
52 HE3 DTR 6 HE3 DTR 6 -0.910 6.902 -5.565
53 H IAM 7 H IAM 7 0.416 4.486 -2.911
54 HA IAM 7 HA IAM 7 2.529 3.838 -3.228
55 HB IAM 7 1HB IAM 7 2.244 6.771 -3.989
56 HD1 IAM 7 HD1 IAM 7 1.263 7.005 -6.057
57 HE1 IAM 7 HE1 IAM 7 0.592 6.077 -8.292
58 HE2 IAM 7 HE2 IAM 7 2.684 2.488 -7.431
59 HD2 IAM 7 HD2 IAM 7 3.357 3.414 -5.199
60 1HT IAM 7 1HT IAM 7 2.065 3.426 -9.916
61 2HT IAM 7 2HT IAM 7 0.607 4.393 -9.881
62 HH IAM 7 HH IAM 7 0.593 1.591 -9.693
63 HI IAM 7 HI IAM 7 -0.953 3.448 -7.889
64 1HB IAM 7 2HB IAM 7 3.825 6.041 -4.162
65 1HK1 IAM 7 1HK1 IAM 7 -0.117 0.617 -7.232
66 2HK1 IAM 7 2HK1 IAM 7 0.531 2.059 -6.488
67 3HK1 IAM 7 3HK1 IAM 7 -1.142 1.624 -6.237
68 1HK2 IAM 7 1HK2 IAM 7 -2.259 2.385 -9.693
69 2HK2 IAM 7 2HK2 IAM 7 -1.766 0.810 -9.124
70 3HK2 IAM 7 3HK2 IAM 7 -2.789 1.815 -8.129
71 H THR 8 H THR 8 2.323 4.065 -0.518
72 HA THR 8 HA THR 8 4.910 5.266 0.180
73 HB THR 8 HB THR 8 3.035 6.789 0.876
74 HG1 THR 8 HG1 THR 8 4.334 5.141 2.931
75 1HG2 THR 8 1HG2 THR 8 1.803 5.784 3.008
76 2HG2 THR 8 2HG2 THR 8 1.131 5.478 1.389
77 3HG2 THR 8 3HG2 THR 8 2.098 4.224 2.202
78 H PHE 9 H PHE 9 3.869 4.343 3.045
79 HA PHE 9 HA PHE 9 5.460 2.198 3.342
80 1HB PHE 9 1HB PHE 9 4.314 3.343 5.199
81 2HB PHE 9 2HB PHE 9 2.736 2.950 4.541
82 HD1 PHE 9 HD1 PHE 9 5.799 1.268 5.848
83 HD2 PHE 9 HD2 PHE 9 1.580 1.146 5.413
84 HE1 PHE 9 HE1 PHE 9 5.710 -0.788 7.285
85 HE2 PHE 9 HE2 PHE 9 1.490 -0.909 6.852
86 HZ PHE 9 HZ PHE 9 3.557 -1.851 7.771
87 H LYS 10 H LYS 10 4.712 -0.145 3.953
88 HA LYS 10 HA LYS 10 2.772 -1.046 1.943
89 1HB LYS 10 1HB LYS 10 5.456 -2.288 2.611
90 2HB LYS 10 2HB LYS 10 4.230 -3.050 1.619
91 1HG LYS 10 1HG LYS 10 4.965 -0.245 0.862
92 2HG LYS 10 2HG LYS 10 6.207 -1.453 0.611
93 1HD LYS 10 1HD LYS 10 3.956 -2.744 -0.388
94 2HD LYS 10 2HD LYS 10 3.628 -1.076 -0.814
95 1HE LYS 10 1HE LYS 10 6.364 -1.436 -1.442
96 2HE LYS 10 2HE LYS 10 5.600 -2.927 -1.956
97 3HZ LYS 10 3HZ LYS 10 4.515 -1.891 -3.587
98 H SER 11 H SER 11 1.284 -2.567 2.624
99 HA SER 11 HA SER 11 1.607 -3.518 5.419
100 1HB SER 11 1HB SER 11 -0.354 -1.681 4.410
101 2HB SER 11 2HB SER 11 -1.208 -3.212 4.507
102 HG SER 11 HG SER 11 -0.505 -3.362 6.711
103 H CYS 12 H CYS 12 2.546 -4.864 3.042
104 HA CYS 12 HA CYS 12 0.612 -6.693 2.153
105 1HB CYS 12 1HB CYS 12 2.829 -6.038 1.063
106 2HB CYS 12 2HB CYS 12 3.590 -7.159 2.176
Start of MODEL 2
1 1H TYR 1 1H TYR 1 -6.263 -7.710 1.214
2 2H TYR 1 2H TYR 1 -5.385 -8.133 2.584
3 3H TYR 1 3H TYR 1 -5.256 -6.676 2.130
4 HA TYR 1 HA TYR 1 -3.869 -8.936 1.303
5 1HB TYR 1 1HB TYR 1 -4.184 -7.740 -1.251
6 2HB TYR 1 2HB TYR 1 -4.907 -9.258 -0.757
7 HD1 TYR 1 HD1 TYR 1 -7.218 -9.491 -0.891
8 HD2 TYR 1 HD2 TYR 1 -5.550 -5.566 -0.543
9 HE1 TYR 1 HE1 TYR 1 -9.531 -8.473 -1.178
10 HE2 TYR 1 HE2 TYR 1 -7.867 -4.563 -0.832
11 HH TYR 1 HH TYR 1 -9.951 -4.949 -1.274
12 H CYS 2 H CYS 2 -2.292 -7.890 -0.790
13 HA CYS 2 HA CYS 2 -0.607 -6.214 0.633
14 1HB CYS 2 1HB CYS 2 -0.668 -7.487 -1.951
15 2HB CYS 2 2HB CYS 2 -0.078 -5.845 -2.116
16 H LYS 3 H LYS 3 -0.488 -3.968 0.811
17 HA LYS 3 HA LYS 3 -1.908 -2.326 -1.082
18 1HB LYS 3 1HB LYS 3 -3.205 -1.165 0.732
19 2HB LYS 3 2HB LYS 3 -3.767 -2.773 0.322
20 1HG LYS 3 1HG LYS 3 -2.647 -3.737 2.279
21 2HG LYS 3 2HG LYS 3 -1.857 -2.215 2.636
22 1HD LYS 3 1HD LYS 3 -4.883 -2.326 2.490
23 2HD LYS 3 2HD LYS 3 -4.069 -2.894 3.932
24 1HE LYS 3 1HE LYS 3 -3.745 -0.764 4.644
25 2HE LYS 3 2HE LYS 3 -2.888 -0.364 3.169
26 1HZ LYS 3 1HZ LYS 3 -4.738 1.024 3.088
27 2HZ LYS 3 2HZ LYS 3 -5.272 -0.218 2.178
28 1HN DHN 4 1HN DHN 4 -0.371 -0.880 -1.622
29 HA DHN 4 HA DHN 4 1.553 -0.144 0.460
30 1HB DHN 4 1HB DHN 4 1.658 0.599 -2.527
31 2HB DHN 4 2HB DHN 4 2.975 0.636 -1.380
32 1HG DHN 4 1HG DHN 4 2.382 -2.093 -1.303
33 2HG DHN 4 2HG DHN 4 1.832 -1.736 -2.920
34 H PHE 5 H PHE 5 -1.236 0.830 0.511
35 HA PHE 5 HA PHE 5 -2.429 2.728 0.443
36 1HB PHE 5 1HB PHE 5 0.201 3.813 1.606
37 2HB PHE 5 2HB PHE 5 -1.417 4.329 2.041
38 HD1 PHE 5 HD1 PHE 5 -2.334 3.501 3.988
39 HD2 PHE 5 HD2 PHE 5 0.663 1.227 2.025
40 HE1 PHE 5 HE1 PHE 5 -2.355 1.845 5.874
41 HE2 PHE 5 HE2 PHE 5 0.641 -0.431 3.909
42 HZ PHE 5 HZ PHE 5 -0.866 -0.100 5.813
43 H DTR 6 H DTR 6 -1.147 5.485 0.599
44 HA DTR 6 HA DTR 6 -0.782 7.152 -0.772
45 1HB DTR 6 1HB DTR 6 -1.110 5.839 -3.363
46 2HB DTR 6 2HB DTR 6 -2.284 5.167 -2.247
47 HD1 DTR 6 HD1 DTR 6 -2.997 7.911 -0.658
48 HE1 DTR 6 HE1 DTR 6 -4.438 9.817 -1.780
49 HZ2 DTR 6 HZ2 DTR 6 -5.019 10.505 -4.488
50 HH2 DTR 6 HH2 DTR 6 -4.548 9.787 -6.857
51 HZ3 DTR 6 HZ3 DTR 6 -3.123 7.847 -7.281
52 HE3 DTR 6 HE3 DTR 6 -2.079 6.504 -5.454
53 H IAM 7 H IAM 7 0.278 4.428 -2.932
54 HA IAM 7 HA IAM 7 2.348 3.689 -3.373
55 HB IAM 7 1HB IAM 7 2.066 6.628 -4.076
56 HD1 IAM 7 HD1 IAM 7 3.704 3.713 -5.720
57 HE1 IAM 7 HE1 IAM 7 2.957 2.804 -7.937
58 HE2 IAM 7 HE2 IAM 7 -0.279 5.551 -7.972
59 HD2 IAM 7 HD2 IAM 7 0.469 6.459 -5.753
60 1HT IAM 7 1HT IAM 7 1.567 3.817 -10.182
61 2HT IAM 7 2HT IAM 7 -0.103 4.004 -9.696
62 HH IAM 7 HH IAM 7 1.374 1.490 -9.822
63 HI IAM 7 HI IAM 7 -0.677 0.570 -8.976
64 1HB IAM 7 2HB IAM 7 3.646 5.913 -4.317
65 1HK1 IAM 7 1HK1 IAM 7 -1.347 3.406 -8.165
66 2HK1 IAM 7 2HK1 IAM 7 -1.935 2.600 -9.600
67 3HK1 IAM 7 3HK1 IAM 7 -2.420 2.034 -8.019
68 1HK2 IAM 7 1HK2 IAM 7 0.894 0.656 -7.074
69 2HK2 IAM 7 2HK2 IAM 7 0.324 2.257 -6.674
70 3HK2 IAM 7 3HK2 IAM 7 -0.748 0.887 -6.528
71 H THR 8 H THR 8 2.248 4.026 -0.601
72 HA THR 8 HA THR 8 4.968 5.014 -0.084
73 HB THR 8 HB THR 8 3.252 6.684 0.687
74 HG1 THR 8 HG1 THR 8 4.548 4.978 2.697
75 1HG2 THR 8 1HG2 THR 8 2.078 5.804 2.907
76 2HG2 THR 8 2HG2 THR 8 1.292 5.522 1.336
77 3HG2 THR 8 3HG2 THR 8 2.213 4.213 2.116
78 H PHE 9 H PHE 9 4.048 4.218 2.854
79 HA PHE 9 HA PHE 9 5.485 1.954 3.080
80 1HB PHE 9 1HB PHE 9 4.558 3.270 4.970
81 2HB PHE 9 2HB PHE 9 2.916 2.903 4.475
82 HD1 PHE 9 HD1 PHE 9 6.031 1.096 5.473
83 HD2 PHE 9 HD2 PHE 9 1.792 1.255 5.626
84 HE1 PHE 9 HE1 PHE 9 6.011 -0.893 7.005
85 HE2 PHE 9 HE2 PHE 9 1.773 -0.733 7.158
86 HZ PHE 9 HZ PHE 9 3.883 -1.784 7.828
87 H LYS 10 H LYS 10 4.547 -0.296 3.853
88 HA LYS 10 HA LYS 10 2.367 -1.061 2.048
89 1HB LYS 10 1HB LYS 10 5.136 -2.208 2.234
90 2HB LYS 10 2HB LYS 10 3.796 -3.268 1.849
91 1HG LYS 10 1HG LYS 10 3.977 -2.570 -0.302
92 2HG LYS 10 2HG LYS 10 3.343 -1.022 0.216
93 1HD LYS 10 1HD LYS 10 5.394 0.009 0.115
94 2HD LYS 10 2HD LYS 10 6.240 -1.376 0.775
95 1HE LYS 10 1HE LYS 10 7.046 -1.403 -1.418
96 2HE LYS 10 2HE LYS 10 5.683 -2.493 -1.572
97 3HZ LYS 10 3HZ LYS 10 4.585 -1.054 -2.849
98 H SER 11 H SER 11 1.032 -2.784 2.809
99 HA SER 11 HA SER 11 1.606 -3.773 5.521
100 1HB SER 11 1HB SER 11 -0.482 -1.763 4.784
101 2HB SER 11 2HB SER 11 -1.178 -3.177 5.556
102 HG SER 11 HG SER 11 0.329 -2.859 7.290
103 H CYS 12 H CYS 12 2.134 -5.452 3.645
104 HA CYS 12 HA CYS 12 -0.131 -6.709 2.509
105 1HB CYS 12 1HB CYS 12 2.488 -6.718 1.915
106 2HB CYS 12 2HB CYS 12 2.413 -8.211 2.831
Start of MODEL 3
1 1H TYR 1 1H TYR 1 -5.234 -9.294 2.233
2 2H TYR 1 2H TYR 1 -4.264 -8.129 2.958
3 3H TYR 1 3H TYR 1 -4.501 -7.780 2.864
4 HA TYR 1 HA TYR 1 -3.570 -9.422 0.827
5 1HB TYR 1 1HB TYR 1 -4.141 -7.075 -0.713
6 2HB TYR 1 2HB TYR 1 -4.873 -8.652 -0.936
7 HD1 TYR 1 HD1 TYR 1 -7.187 -8.821 -0.809
8 HD2 TYR 1 HD2 TYR 1 -5.234 -5.617 1.247
9 HE1 TYR 1 HE1 TYR 1 -9.446 -7.857 -0.147
10 HE2 TYR 1 HE2 TYR 1 -7.498 -4.665 1.901
11 HH TYR 1 HH TYR 1 -9.643 -4.812 1.668
12 H CYS 2 H CYS 2 -2.113 -7.707 -0.772
13 HA CYS 2 HA CYS 2 -0.401 -6.497 1.228
14 1HB CYS 2 1HB CYS 2 0.128 -6.863 -1.723
15 2HB CYS 2 2HB CYS 2 1.292 -6.446 -0.481
16 H LYS 3 H LYS 3 -0.879 -4.380 1.721
17 HA LYS 3 HA LYS 3 -1.906 -2.708 -0.458
18 1HB LYS 3 1HB LYS 3 -2.142 -2.359 2.546
19 2HB LYS 3 2HB LYS 3 -2.789 -1.265 1.340
20 1HG LYS 3 1HG LYS 3 -3.716 -3.832 0.561
21 2HG LYS 3 2HG LYS 3 -3.880 -3.808 2.305
22 1HD LYS 3 1HD LYS 3 -5.612 -2.331 2.227
23 2HD LYS 3 2HD LYS 3 -4.759 -1.264 1.131
24 1HE LYS 3 1HE LYS 3 -5.358 -2.787 -0.785
25 2HE LYS 3 2HE LYS 3 -6.254 -3.805 0.325
26 1HZ LYS 3 1HZ LYS 3 -7.875 -2.366 -0.485
27 2HZ LYS 3 2HZ LYS 3 -7.476 -1.598 0.893
28 1HN DHN 4 1HN DHN 4 -0.680 -1.062 -1.245
29 HA DHN 4 HA DHN 4 1.838 -0.572 0.191
30 1HB DHN 4 1HB DHN 4 1.406 0.392 -2.654
31 2HB DHN 4 2HB DHN 4 2.873 -0.173 -1.895
32 1HG DHN 4 1HG DHN 4 0.600 -1.873 -3.109
33 2HG DHN 4 2HG DHN 4 2.266 -1.804 -3.628
34 H PHE 5 H PHE 5 -1.098 0.610 0.414
35 HA PHE 5 HA PHE 5 -2.060 2.609 0.597
36 1HB PHE 5 1HB PHE 5 0.765 3.196 1.674
37 2HB PHE 5 2HB PHE 5 -0.670 4.107 2.103
38 HD1 PHE 5 HD1 PHE 5 0.812 0.707 2.294
39 HD2 PHE 5 HD2 PHE 5 -1.992 3.449 3.916
40 HE1 PHE 5 HE1 PHE 5 0.392 -0.858 4.213
41 HE2 PHE 5 HE2 PHE 5 -2.411 1.885 5.835
42 HZ PHE 5 HZ PHE 5 -1.214 -0.249 5.959
43 H DTR 6 H DTR 6 -0.982 5.271 0.687
44 HA DTR 6 HA DTR 6 -0.553 6.960 -0.633
45 1HB DTR 6 1HB DTR 6 -0.736 5.850 -3.271
46 2HB DTR 6 2HB DTR 6 -1.792 4.857 -2.283
47 HD1 DTR 6 HD1 DTR 6 -3.714 6.434 -0.800
48 HE1 DTR 6 HE1 DTR 6 -5.169 8.492 -1.582
49 HZ2 DTR 6 HZ2 DTR 6 -4.928 10.373 -3.714
50 HH2 DTR 6 HH2 DTR 6 -3.447 10.978 -5.663
51 HZ3 DTR 6 HZ3 DTR 6 -1.444 9.655 -6.124
52 HE3 DTR 6 HE3 DTR 6 -0.762 7.693 -4.741
53 H IAM 7 H IAM 7 0.661 4.427 -2.917
54 HA IAM 7 HA IAM 7 2.770 3.727 -3.277
55 HB IAM 7 1HB IAM 7 2.471 6.706 -3.806
56 HD1 IAM 7 HD1 IAM 7 1.391 7.040 -5.805
57 HE1 IAM 7 HE1 IAM 7 0.709 6.276 -8.098
58 HE2 IAM 7 HE2 IAM 7 3.007 2.742 -7.605
59 HD2 IAM 7 HD2 IAM 7 3.688 3.506 -5.311
60 1HT IAM 7 1HT IAM 7 1.746 2.998 -9.538
61 2HT IAM 7 2HT IAM 7 1.834 4.648 -10.114
62 HH IAM 7 HH IAM 7 -0.530 4.842 -9.953
63 HI IAM 7 HI IAM 7 -0.863 2.107 -9.617
64 1HB IAM 7 2HB IAM 7 4.059 6.011 -4.048
65 1HK1 IAM 7 1HK1 IAM 7 -2.369 4.242 -8.093
66 2HK1 IAM 7 2HK1 IAM 7 -2.737 3.710 -9.716
67 3HK1 IAM 7 3HK1 IAM 7 -2.934 2.612 -8.371
68 1HK2 IAM 7 1HK2 IAM 7 0.691 2.179 -7.701
69 2HK2 IAM 7 2HK2 IAM 7 -0.343 3.337 -6.904
70 3HK2 IAM 7 3HK2 IAM 7 -0.908 1.709 -7.180
71 H THR 8 H THR 8 2.651 3.720 -0.561
72 HA THR 8 HA THR 8 5.285 4.796 0.153
73 HB THR 8 HB THR 8 3.465 6.360 0.959
74 HG1 THR 8 HG1 THR 8 4.824 4.614 2.891
75 1HG2 THR 8 1HG2 THR 8 2.316 5.312 3.117
76 2HG2 THR 8 2HG2 THR 8 1.556 5.077 1.525
77 3HG2 THR 8 3HG2 THR 8 2.531 3.774 2.247
78 H PHE 9 H PHE 9 4.777 3.859 2.968
79 HA PHE 9 HA PHE 9 6.034 1.487 2.897
80 1HB PHE 9 1HB PHE 9 4.501 1.150 5.101
81 2HB PHE 9 2HB PHE 9 5.707 2.422 5.050
82 HD1 PHE 9 HD1 PHE 9 5.072 4.726 5.024
83 HD2 PHE 9 HD2 PHE 9 2.107 1.703 4.757
84 HE1 PHE 9 HE1 PHE 9 3.288 6.438 5.459
85 HE2 PHE 9 HE2 PHE 9 0.322 3.414 5.190
86 HZ PHE 9 HZ PHE 9 0.935 5.760 5.537
87 H LYS 10 H LYS 10 5.340 -0.771 3.294
88 HA LYS 10 HA LYS 10 2.795 -1.298 1.929
89 1HB LYS 10 1HB LYS 10 5.191 -3.142 2.106
90 2HB LYS 10 2HB LYS 10 3.757 -3.349 1.123
91 1HG LYS 10 1HG LYS 10 5.091 -0.745 0.669
92 2HG LYS 10 2HG LYS 10 6.127 -2.111 0.309
93 1HD LYS 10 1HD LYS 10 3.283 -1.829 -0.769
94 2HD LYS 10 2HD LYS 10 4.705 -1.301 -1.647
95 1HE LYS 10 1HE LYS 10 5.496 -3.501 -1.975
96 2HE LYS 10 2HE LYS 10 4.630 -4.134 -0.589
97 3HZ LYS 10 3HZ LYS 10 2.803 -4.469 -1.797
98 H SER 11 H SER 11 1.457 -3.039 2.747
99 HA SER 11 HA SER 11 1.918 -3.489 5.645
100 1HB SER 11 1HB SER 11 -0.404 -2.616 4.056
101 2HB SER 11 2HB SER 11 -0.795 -4.141 4.836
102 HG SER 11 HG SER 11 -0.139 -3.179 6.840
103 H CYS 12 H CYS 12 -0.164 -5.214 3.252
104 HA CYS 12 HA CYS 12 -0.449 -7.393 2.998
105 1HB CYS 12 1HB CYS 12 1.579 -6.736 1.570
106 2HB CYS 12 2HB CYS 12 2.551 -7.569 2.767
Start of MODEL 4
1 1H TYR 1 1H TYR 1 -6.237 -7.960 2.072
2 2H TYR 1 2H TYR 1 -5.080 -7.718 3.269
3 3H TYR 1 3H TYR 1 -5.158 -6.601 2.669
4 HA TYR 1 HA TYR 1 -3.915 -8.942 1.835
5 1HB TYR 1 1HB TYR 1 -4.337 -7.815 -0.734
6 2HB TYR 1 2HB TYR 1 -5.090 -9.285 -0.146
7 HD1 TYR 1 HD1 TYR 1 -5.568 -5.564 -0.031
8 HD2 TYR 1 HD2 TYR 1 -7.413 -9.423 -0.122
9 HE1 TYR 1 HE1 TYR 1 -7.858 -4.473 -0.217
10 HE2 TYR 1 HE2 TYR 1 -9.696 -8.320 -0.308
11 HH TYR 1 HH TYR 1 -10.801 -6.459 -0.272
12 H CYS 2 H CYS 2 -2.431 -8.028 -0.384
13 HA CYS 2 HA CYS 2 -0.617 -6.351 0.892
14 1HB CYS 2 1HB CYS 2 -0.772 -7.838 -1.534
15 2HB CYS 2 2HB CYS 2 -0.264 -6.211 -1.941
16 H LYS 3 H LYS 3 -0.564 -4.125 1.079
17 HA LYS 3 HA LYS 3 -2.030 -2.557 -0.886
18 1HB LYS 3 1HB LYS 3 -3.078 -1.214 0.947
19 2HB LYS 3 2HB LYS 3 -3.715 -2.836 0.772
20 1HG LYS 3 1HG LYS 3 -2.345 -3.634 2.659
21 2HG LYS 3 2HG LYS 3 -1.539 -2.082 2.778
22 1HD LYS 3 1HD LYS 3 -3.160 -1.379 4.194
23 2HD LYS 3 2HD LYS 3 -4.322 -1.494 2.888
24 1HE LYS 3 1HE LYS 3 -3.663 -4.126 4.078
25 2HE LYS 3 2HE LYS 3 -4.361 -3.010 5.234
26 1HZ LYS 3 1HZ LYS 3 -6.222 -3.959 4.241
27 2HZ LYS 3 2HZ LYS 3 -6.084 -2.603 3.351
28 1HN DHN 4 1HN DHN 4 -0.479 -1.274 -1.729
29 HA DHN 4 HA DHN 4 1.768 -0.550 -0.039
30 1HB DHN 4 1HB DHN 4 1.391 0.468 -2.891
31 2HB DHN 4 2HB DHN 4 2.874 0.065 -2.061
32 1HG DHN 4 1HG DHN 4 2.075 -2.470 -2.226
33 2HG DHN 4 2HG DHN 4 0.856 -1.906 -3.340
34 H PHE 5 H PHE 5 -1.225 0.530 0.044
35 HA PHE 5 HA PHE 5 -2.258 2.485 0.280
36 1HB PHE 5 1HB PHE 5 0.484 3.168 1.505
37 2HB PHE 5 2HB PHE 5 -1.029 3.943 1.931
38 HD1 PHE 5 HD1 PHE 5 -2.791 2.618 3.127
39 HD2 PHE 5 HD2 PHE 5 1.130 1.118 2.510
40 HE1 PHE 5 HE1 PHE 5 -3.159 0.914 4.934
41 HE2 PHE 5 HE2 PHE 5 0.764 -0.587 4.316
42 HZ PHE 5 HZ PHE 5 -1.376 -0.667 5.508
43 H DTR 6 H DTR 6 -1.203 5.175 0.557
44 HA DTR 6 HA DTR 6 -0.775 6.932 -0.674
45 1HB DTR 6 1HB DTR 6 -0.853 5.883 -3.362
46 2HB DTR 6 2HB DTR 6 -1.976 4.916 -2.426
47 HD1 DTR 6 HD1 DTR 6 -4.104 6.310 -1.290
48 HE1 DTR 6 HE1 DTR 6 -5.389 8.504 -1.993
49 HZ2 DTR 6 HZ2 DTR 6 -4.762 10.678 -3.733
50 HH2 DTR 6 HH2 DTR 6 -2.951 11.524 -5.270
51 HZ3 DTR 6 HZ3 DTR 6 -0.901 10.227 -5.566
52 HE3 DTR 6 HE3 DTR 6 -0.485 8.058 -4.401
53 H IAM 7 H IAM 7 0.556 4.476 -2.986
54 HA IAM 7 HA IAM 7 2.695 3.825 -3.275
55 HB IAM 7 1HB IAM 7 2.301 6.780 -3.847
56 HD1 IAM 7 HD1 IAM 7 4.330 4.237 -5.618
57 HE1 IAM 7 HE1 IAM 7 3.780 3.413 -7.926
58 HE2 IAM 7 HE2 IAM 7 0.147 5.605 -7.841
59 HD2 IAM 7 HD2 IAM 7 0.698 6.429 -5.535
60 1HT IAM 7 1HT IAM 7 2.069 3.013 -9.584
61 2HT IAM 7 2HT IAM 7 1.950 4.666 -10.148
62 HH IAM 7 HH IAM 7 -0.437 4.602 -9.894
63 HI IAM 7 HI IAM 7 -0.732 1.981 -10.084
64 1HB IAM 7 2HB IAM 7 3.930 6.159 -4.013
65 1HK1 IAM 7 1HK1 IAM 7 -1.619 3.375 -7.549
66 2HK1 IAM 7 2HK1 IAM 7 -2.485 3.390 -9.067
67 3HK1 IAM 7 3HK1 IAM 7 -2.303 1.896 -8.179
68 1HK2 IAM 7 1HK2 IAM 7 1.335 1.519 -8.815
69 2HK2 IAM 7 2HK2 IAM 7 0.638 2.269 -7.401
70 3HK2 IAM 7 3HK2 IAM 7 -0.045 0.791 -8.030
71 H THR 8 H THR 8 2.579 3.741 -0.601
72 HA THR 8 HA THR 8 5.101 5.014 0.195
73 HB THR 8 HB THR 8 3.159 6.362 1.061
74 HG1 THR 8 HG1 THR 8 4.584 4.593 2.924
75 1HG2 THR 8 1HG2 THR 8 2.024 5.086 3.101
76 2HG2 THR 8 2HG2 THR 8 1.336 4.904 1.471
77 3HG2 THR 8 3HG2 THR 8 2.386 3.631 2.141
78 H PHE 9 H PHE 9 4.393 3.827 2.973
79 HA PHE 9 HA PHE 9 5.971 1.606 2.801
80 1HB PHE 9 1HB PHE 9 4.548 1.021 4.978
81 2HB PHE 9 2HB PHE 9 5.490 2.499 4.970
82 HD1 PHE 9 HD1 PHE 9 4.450 4.591 5.234
83 HD2 PHE 9 HD2 PHE 9 2.073 1.170 4.421
84 HE1 PHE 9 HE1 PHE 9 2.374 5.918 5.718
85 HE2 PHE 9 HE2 PHE 9 -0.003 2.497 4.902
86 HZ PHE 9 HZ PHE 9 0.172 4.855 5.546
87 H LYS 10 H LYS 10 5.142 -0.708 3.580
88 HA LYS 10 HA LYS 10 2.839 -1.393 1.887
89 1HB LYS 10 1HB LYS 10 5.401 -2.970 2.264
90 2HB LYS 10 2HB LYS 10 3.995 -3.517 1.372
91 1HG LYS 10 1HG LYS 10 5.004 -0.818 0.589
92 2HG LYS 10 2HG LYS 10 6.103 -2.142 0.253
93 1HD LYS 10 1HD LYS 10 3.723 -3.221 -0.632
94 2HD LYS 10 2HD LYS 10 3.450 -1.525 -0.968
95 1HE LYS 10 1HE LYS 10 6.054 -1.855 -1.877
96 2HE LYS 10 2HE LYS 10 5.354 -3.419 -2.244
97 3HZ LYS 10 3HZ LYS 10 4.061 -2.547 -3.819
98 H SER 11 H SER 11 1.310 -2.789 2.758
99 HA SER 11 HA SER 11 1.893 -3.841 5.464
100 1HB SER 11 1HB SER 11 -0.450 -2.082 4.540
101 2HB SER 11 2HB SER 11 -0.670 -3.205 5.872
102 HG SER 11 HG SER 11 1.091 -2.143 6.941
103 H CYS 12 H CYS 12 2.382 -5.685 3.863
104 HA CYS 12 HA CYS 12 0.056 -6.874 2.695
105 1HB CYS 12 1HB CYS 12 2.686 -6.977 2.084
106 2HB CYS 12 2HB CYS 12 2.543 -8.457 3.012
Start of MODEL 5
1 1H TYR 1 1H TYR 1 -5.115 -7.307 2.437
2 2H TYR 1 2H TYR 1 -5.018 -8.951 2.773
3 3H TYR 1 3H TYR 1 -4.194 -7.374 3.257
4 HA TYR 1 HA TYR 1 -3.209 -9.293 1.507
5 1HB TYR 1 1HB TYR 1 -3.876 -7.312 -0.423
6 2HB TYR 1 2HB TYR 1 -4.616 -8.897 -0.305
7 HD1 TYR 1 HD1 TYR 1 -4.914 -5.698 1.653
8 HD2 TYR 1 HD2 TYR 1 -6.918 -8.810 -0.488
9 HE1 TYR 1 HE1 TYR 1 -7.157 -4.617 2.167
10 HE2 TYR 1 HE2 TYR 1 -9.154 -7.720 0.033
11 HH TYR 1 HH TYR 1 -10.181 -6.156 1.118
12 H CYS 2 H CYS 2 -1.939 -7.696 -0.433
13 HA CYS 2 HA CYS 2 -0.112 -6.290 1.288
14 1HB CYS 2 1HB CYS 2 0.091 -6.590 -1.707
15 2HB CYS 2 2HB CYS 2 1.374 -6.246 -0.563
16 H LYS 3 H LYS 3 -1.055 -4.319 1.918
17 HA LYS 3 HA LYS 3 -2.207 -2.677 -0.207
18 1HB LYS 3 1HB LYS 3 -2.375 -2.461 2.813
19 2HB LYS 3 2HB LYS 3 -3.099 -1.328 1.690
20 1HG LYS 3 1HG LYS 3 -3.910 -3.900 0.784
21 2HG LYS 3 2HG LYS 3 -4.061 -3.957 2.530
22 1HD LYS 3 1HD LYS 3 -5.217 -1.720 0.801
23 2HD LYS 3 2HD LYS 3 -6.136 -3.117 1.324
24 1HE LYS 3 1HE LYS 3 -4.700 -1.283 3.293
25 2HE LYS 3 2HE LYS 3 -6.351 -0.994 2.776
26 1HZ LYS 3 1HZ LYS 3 -6.618 -2.309 4.662
27 2HZ LYS 3 2HZ LYS 3 -6.691 -3.451 3.504
28 1HN DHN 4 1HN DHN 4 -0.669 -1.529 -1.277
29 HA DHN 4 HA DHN 4 1.650 -0.616 0.207
30 1HB DHN 4 1HB DHN 4 1.079 0.162 -2.688
31 2HB DHN 4 2HB DHN 4 2.618 -0.157 -1.924
32 1HG DHN 4 1HG DHN 4 1.714 -2.717 -1.813
33 2HG DHN 4 2HG DHN 4 0.589 -2.192 -3.039
34 H PHE 5 H PHE 5 -1.382 0.418 0.324
35 HA PHE 5 HA PHE 5 -2.439 2.381 0.405
36 1HB PHE 5 1HB PHE 5 0.271 3.206 1.603
37 2HB PHE 5 2HB PHE 5 -1.285 3.895 2.023
38 HD1 PHE 5 HD1 PHE 5 -2.485 3.040 3.824
39 HD2 PHE 5 HD2 PHE 5 0.596 0.685 2.103
40 HE1 PHE 5 HE1 PHE 5 -2.726 1.368 5.682
41 HE2 PHE 5 HE2 PHE 5 0.356 -0.988 3.959
42 HZ PHE 5 HZ PHE 5 -1.302 -0.625 5.727
43 H DTR 6 H DTR 6 -1.221 5.078 0.604
44 HA DTR 6 HA DTR 6 -0.780 6.771 -0.711
45 1HB DTR 6 1HB DTR 6 -0.987 5.551 -3.345
46 2HB DTR 6 2HB DTR 6 -2.173 4.783 -2.311
47 HD1 DTR 6 HD1 DTR 6 -3.946 6.646 -1.043
48 HE1 DTR 6 HE1 DTR 6 -5.085 8.835 -1.977
49 HZ2 DTR 6 HZ2 DTR 6 -4.501 10.577 -4.160
50 HH2 DTR 6 HH2 DTR 6 -2.861 10.904 -6.048
51 HZ3 DTR 6 HZ3 DTR 6 -1.025 9.320 -6.353
52 HE3 DTR 6 HE3 DTR 6 -0.669 7.349 -4.864
53 H IAM 7 H IAM 7 0.384 4.117 -2.901
54 HA IAM 7 HA IAM 7 2.485 3.379 -3.228
55 HB IAM 7 1HB IAM 7 2.139 6.286 -3.994
56 HD1 IAM 7 HD1 IAM 7 0.567 3.907 -4.828
57 HE1 IAM 7 HE1 IAM 7 0.026 2.923 -7.074
58 HE2 IAM 7 HE2 IAM 7 3.614 4.550 -8.650
59 HD2 IAM 7 HD2 IAM 7 4.155 5.534 -6.404
60 1HT IAM 7 1HT IAM 7 1.202 2.048 -9.244
61 2HT IAM 7 2HT IAM 7 2.313 3.167 -10.004
62 HH IAM 7 HH IAM 7 -0.486 3.293 -10.328
63 HI IAM 7 HI IAM 7 1.346 5.639 -9.905
64 1HB IAM 7 2HB IAM 7 3.770 5.659 -4.112
65 1HK1 IAM 7 1HK1 IAM 7 -1.527 5.511 -8.967
66 2HK1 IAM 7 2HK1 IAM 7 -0.124 5.532 -7.924
67 3HK1 IAM 7 3HK1 IAM 7 -0.506 6.929 -8.903
68 1HK2 IAM 7 1HK2 IAM 7 0.368 5.365 -12.155
69 2HK2 IAM 7 2HK2 IAM 7 -1.236 5.413 -11.465
70 3HK2 IAM 7 3HK2 IAM 7 -0.215 6.829 -11.401
71 H THR 8 H THR 8 2.450 3.463 -0.550
72 HA THR 8 HA THR 8 5.026 4.722 0.099
73 HB THR 8 HB THR 8 3.110 6.107 0.975
74 HG1 THR 8 HG1 THR 8 4.618 4.424 2.853
75 1HG2 THR 8 1HG2 THR 8 2.065 4.919 3.114
76 2HG2 THR 8 2HG2 THR 8 1.311 4.665 1.522
77 3HG2 THR 8 3HG2 THR 8 2.392 3.423 2.204
78 H PHE 9 H PHE 9 4.217 3.587 2.945
79 HA PHE 9 HA PHE 9 5.825 1.334 2.761
80 1HB PHE 9 1HB PHE 9 4.606 0.907 5.068
81 2HB PHE 9 2HB PHE 9 5.518 2.394 4.901
82 HD1 PHE 9 HD1 PHE 9 4.477 4.470 5.198
83 HD2 PHE 9 HD2 PHE 9 2.083 1.009 4.651
84 HE1 PHE 9 HE1 PHE 9 2.427 5.797 5.779
85 HE2 PHE 9 HE2 PHE 9 0.032 2.336 5.231
86 HZ PHE 9 HZ PHE 9 0.229 4.713 5.789
87 H LYS 10 H LYS 10 5.211 -0.955 3.300
88 HA LYS 10 HA LYS 10 2.680 -1.604 1.962
89 1HB LYS 10 1HB LYS 10 5.148 -3.341 2.238
90 2HB LYS 10 2HB LYS 10 3.707 -3.702 1.311
91 1HG LYS 10 1HG LYS 10 4.872 -1.073 0.619
92 2HG LYS 10 2HG LYS 10 5.988 -2.397 0.350
93 1HD LYS 10 1HD LYS 10 3.668 -3.464 -0.698
94 2HD LYS 10 2HD LYS 10 3.428 -1.763 -1.045
95 1HE LYS 10 1HE LYS 10 5.972 -1.910 -1.885
96 2HE LYS 10 2HE LYS 10 5.597 -3.615 -2.042
97 3HZ LYS 10 3HZ LYS 10 4.270 -3.236 -3.776
98 H SER 11 H SER 11 1.173 -2.903 2.989
99 HA SER 11 HA SER 11 1.897 -3.765 5.738
100 1HB SER 11 1HB SER 11 0.405 -1.788 5.849
101 2HB SER 11 2HB SER 11 -0.717 -2.479 4.687
102 HG SER 11 HG SER 11 -1.125 -4.169 6.223
103 H CYS 12 H CYS 12 2.366 -5.397 3.486
104 HA CYS 12 HA CYS 12 0.083 -7.065 3.111
105 1HB CYS 12 1HB CYS 12 1.851 -6.657 1.388
106 2HB CYS 12 2HB CYS 12 2.964 -7.597 2.365
Start of MODEL 6
1 1H TYR 1 1H TYR 1 -6.530 -7.575 1.995
2 2H TYR 1 2H TYR 1 -5.490 -7.681 3.312
3 3H TYR 1 3H TYR 1 -5.395 -6.405 2.713
4 HA TYR 1 HA TYR 1 -4.223 -8.808 1.960
5 1HB TYR 1 1HB TYR 1 -4.552 -7.727 -0.643
6 2HB TYR 1 2HB TYR 1 -5.368 -9.156 -0.038
7 HD1 TYR 1 HD1 TYR 1 -5.726 -5.418 0.057
8 HD2 TYR 1 HD2 TYR 1 -7.687 -9.214 -0.130
9 HE1 TYR 1 HE1 TYR 1 -7.971 -4.252 -0.202
10 HE2 TYR 1 HE2 TYR 1 -9.926 -8.037 -0.389
11 HH TYR 1 HH TYR 1 -10.972 -6.144 -0.378
12 H CYS 2 H CYS 2 -2.660 -8.000 -0.246
13 HA CYS 2 HA CYS 2 -0.807 -6.368 1.025
14 1HB CYS 2 1HB CYS 2 -1.075 -7.737 -1.534
15 2HB CYS 2 2HB CYS 2 -0.232 -6.210 -1.694
16 H LYS 3 H LYS 3 -0.468 -4.128 0.976
17 HA LYS 3 HA LYS 3 -1.805 -2.523 -0.988
18 1HB LYS 3 1HB LYS 3 -3.010 -1.150 0.739
19 2HB LYS 3 2HB LYS 3 -3.692 -2.734 0.430
20 1HG LYS 3 1HG LYS 3 -2.647 -3.652 2.450
21 2HG LYS 3 2HG LYS 3 -1.747 -2.173 2.715
22 1HD LYS 3 1HD LYS 3 -3.474 -1.472 4.013
23 2HD LYS 3 2HD LYS 3 -4.402 -1.277 2.540
24 1HE LYS 3 1HE LYS 3 -4.339 -4.089 3.415
25 2HE LYS 3 2HE LYS 3 -4.984 -3.039 4.662
26 1HZ LYS 3 1HZ LYS 3 -6.839 -3.494 3.356
27 2HZ LYS 3 2HZ LYS 3 -6.377 -2.072 2.711
28 1HN DHN 4 1HN DHN 4 -0.140 -1.265 -1.624
29 HA DHN 4 HA DHN 4 1.886 -0.595 0.359
30 1HB DHN 4 1HB DHN 4 1.921 0.303 -2.570
31 2HB DHN 4 2HB DHN 4 3.277 -0.001 -1.514
32 1HG DHN 4 1HG DHN 4 2.568 -2.566 -1.624
33 2HG DHN 4 2HG DHN 4 1.509 -2.110 -2.934
34 H PHE 5 H PHE 5 -0.973 0.551 0.271
35 HA PHE 5 HA PHE 5 -2.001 2.531 0.316
36 1HB PHE 5 1HB PHE 5 0.678 3.312 1.615
37 2HB PHE 5 2HB PHE 5 -0.882 4.025 1.978
38 HD1 PHE 5 HD1 PHE 5 -2.015 3.283 3.846
39 HD2 PHE 5 HD2 PHE 5 0.797 0.689 2.010
40 HE1 PHE 5 HE1 PHE 5 -2.349 1.615 5.691
41 HE2 PHE 5 HE2 PHE 5 0.462 -0.981 3.854
42 HZ PHE 5 HZ PHE 5 -1.106 -0.497 5.673
43 H DTR 6 H DTR 6 -0.945 5.218 0.491
44 HA DTR 6 HA DTR 6 -0.359 6.901 -0.778
45 1HB DTR 6 1HB DTR 6 -0.649 6.304 -3.385
46 2HB DTR 6 2HB DTR 6 -1.240 4.772 -2.770
47 HD1 DTR 6 HD1 DTR 6 -2.219 7.816 -0.702
48 HE1 DTR 6 HE1 DTR 6 -4.782 8.394 -0.954
49 HZ2 DTR 6 HZ2 DTR 6 -6.844 7.470 -2.697
50 HH2 DTR 6 HH2 DTR 6 -7.254 5.878 -4.609
51 HZ3 DTR 6 HZ3 DTR 6 -5.416 4.520 -5.477
52 HE3 DTR 6 HE3 DTR 6 -3.099 4.622 -4.557
53 H IAM 7 H IAM 7 0.808 4.403 -3.113
54 HA IAM 7 HA IAM 7 2.916 3.585 -3.350
55 HB IAM 7 1HB IAM 7 2.648 6.529 -4.038
56 HD1 IAM 7 HD1 IAM 7 0.808 4.642 -5.041
57 HE1 IAM 7 HE1 IAM 7 0.207 3.750 -7.310
58 HE2 IAM 7 HE2 IAM 7 4.171 4.476 -8.642
59 HD2 IAM 7 HD2 IAM 7 4.771 5.367 -6.373
60 1HT IAM 7 1HT IAM 7 1.548 2.478 -9.412
61 2HT IAM 7 2HT IAM 7 2.621 3.644 -10.154
62 HH IAM 7 HH IAM 7 -0.209 3.748 -10.339
63 HI IAM 7 HI IAM 7 1.658 6.080 -9.934
64 1HB IAM 7 2HB IAM 7 4.249 5.837 -4.186
65 1HK1 IAM 7 1HK1 IAM 7 -1.251 5.974 -9.106
66 2HK1 IAM 7 2HK1 IAM 7 0.111 5.991 -8.011
67 3HK1 IAM 7 3HK1 IAM 7 -0.224 7.384 -9.010
68 1HK2 IAM 7 1HK2 IAM 7 0.767 5.803 -12.218
69 2HK2 IAM 7 2HK2 IAM 7 -0.862 5.864 -11.592
70 3HK2 IAM 7 3HK2 IAM 7 0.163 7.274 -11.495
71 H THR 8 H THR 8 2.828 3.617 -0.673
72 HA THR 8 HA THR 8 5.422 4.786 0.045
73 HB THR 8 HB THR 8 3.563 6.276 0.864
74 HG1 THR 8 HG1 THR 8 4.920 4.525 2.794
75 1HG2 THR 8 1HG2 THR 8 2.391 5.159 2.975
76 2HG2 THR 8 2HG2 THR 8 1.673 4.937 1.363
77 3HG2 THR 8 3HG2 THR 8 2.663 3.644 2.081
78 H PHE 9 H PHE 9 4.581 3.743 2.881
79 HA PHE 9 HA PHE 9 6.040 1.398 2.740
80 1HB PHE 9 1HB PHE 9 4.802 1.068 5.046
81 2HB PHE 9 2HB PHE 9 5.770 2.518 4.859
82 HD1 PHE 9 HD1 PHE 9 4.780 4.670 4.944
83 HD2 PHE 9 HD2 PHE 9 2.310 1.222 4.793
84 HE1 PHE 9 HE1 PHE 9 2.778 6.081 5.496
85 HE2 PHE 9 HE2 PHE 9 0.307 2.632 5.345
86 HZ PHE 9 HZ PHE 9 0.567 5.044 5.691
87 H LYS 10 H LYS 10 5.272 -0.844 3.354
88 HA LYS 10 HA LYS 10 2.730 -1.375 1.985
89 1HB LYS 10 1HB LYS 10 5.349 -2.843 2.075
90 2HB LYS 10 2HB LYS 10 3.867 -3.743 1.823
91 1HG LYS 10 1HG LYS 10 3.992 -3.174 -0.370
92 2HG LYS 10 2HG LYS 10 3.598 -1.532 0.101
93 1HD LYS 10 1HD LYS 10 5.765 -0.789 -0.143
94 2HD LYS 10 2HD LYS 10 6.459 -2.268 0.491
95 1HE LYS 10 1HE LYS 10 7.089 -2.383 -1.772
96 2HE LYS 10 2HE LYS 10 5.633 -3.358 -1.761
97 3HZ LYS 10 3HZ LYS 10 4.545 -1.872 -2.993
98 H SER 11 H SER 11 1.319 -3.012 2.893
99 HA SER 11 HA SER 11 1.938 -3.918 5.607
100 1HB SER 11 1HB SER 11 0.849 -1.567 5.762
101 2HB SER 11 2HB SER 11 -0.597 -2.238 5.027
102 HG SER 11 HG SER 11 -0.691 -3.737 6.793
103 H CYS 12 H CYS 12 2.076 -5.803 3.994
104 HA CYS 12 HA CYS 12 -0.400 -6.719 2.946
105 1HB CYS 12 1HB CYS 12 2.158 -7.213 2.311
106 2HB CYS 12 2HB CYS 12 1.869 -8.598 3.346
Start of MODEL 7
1 1H TYR 1 1H TYR 1 -6.033 -8.450 1.696
2 2H TYR 1 2H TYR 1 -6.521 -7.123 0.784
3 3H TYR 1 3H TYR 1 -6.210 -7.451 1.507
4 HA TYR 1 HA TYR 1 -4.495 -9.123 0.101
5 1HB TYR 1 1HB TYR 1 -4.462 -6.961 -1.729
6 2HB TYR 1 2HB TYR 1 -5.135 -8.544 -2.063
7 HD1 TYR 1 HD1 TYR 1 -5.988 -5.136 -0.841
8 HD2 TYR 1 HD2 TYR 1 -7.479 -8.853 -2.344
9 HE1 TYR 1 HE1 TYR 1 -8.294 -4.102 -1.134
10 HE2 TYR 1 HE2 TYR 1 -9.778 -7.809 -2.631
11 HH TYR 1 HH TYR 1 -11.019 -6.071 -2.282
12 H CYS 2 H CYS 2 -2.681 -7.267 -1.002
13 HA CYS 2 HA CYS 2 -1.844 -5.965 1.445
14 1HB CYS 2 1HB CYS 2 -0.280 -6.120 -1.125
15 2HB CYS 2 2HB CYS 2 0.317 -5.835 0.498
16 H LYS 3 H LYS 3 -0.786 -3.687 1.105
17 HA LYS 3 HA LYS 3 -1.960 -2.180 -1.062
18 1HB LYS 3 1HB LYS 3 -2.859 -0.495 0.686
19 2HB LYS 3 2HB LYS 3 -3.816 -1.907 0.293
20 1HG LYS 3 1HG LYS 3 -3.123 -3.060 2.308
21 2HG LYS 3 2HG LYS 3 -1.857 -1.892 2.626
22 1HD LYS 3 1HD LYS 3 -3.294 -0.414 3.617
23 2HD LYS 3 2HD LYS 3 -4.521 -0.634 2.386
24 1HE LYS 3 1HE LYS 3 -5.194 -2.803 3.445
25 2HE LYS 3 2HE LYS 3 -3.969 -2.580 4.677
26 1HZ LYS 3 1HZ LYS 3 -5.865 -1.688 5.661
27 2HZ LYS 3 2HZ LYS 3 -5.191 -0.334 5.060
28 1HN DHN 4 1HN DHN 4 -0.703 -0.405 -1.613
29 HA DHN 4 HA DHN 4 1.721 -0.126 0.031
30 1HB DHN 4 1HB DHN 4 1.413 0.959 -2.818
31 2HB DHN 4 2HB DHN 4 2.882 0.532 -1.972
32 1HG DHN 4 1HG DHN 4 1.969 -1.995 -2.131
33 2HG DHN 4 2HG DHN 4 0.863 -1.374 -3.330
34 H PHE 5 H PHE 5 -1.158 1.162 0.187
35 HA PHE 5 HA PHE 5 -2.049 3.169 0.523
36 1HB PHE 5 1HB PHE 5 0.781 3.736 1.587
37 2HB PHE 5 2HB PHE 5 -0.692 4.506 2.144
38 HD1 PHE 5 HD1 PHE 5 0.892 1.143 1.884
39 HD2 PHE 5 HD2 PHE 5 -1.787 3.660 4.006
40 HE1 PHE 5 HE1 PHE 5 0.640 -0.618 3.656
41 HE2 PHE 5 HE2 PHE 5 -2.037 1.900 5.779
42 HZ PHE 5 HZ PHE 5 -0.821 -0.218 5.581
43 H DTR 6 H DTR 6 -0.593 5.758 0.814
44 HA DTR 6 HA DTR 6 -0.174 7.508 -0.436
45 1HB DTR 6 1HB DTR 6 -1.259 7.578 -2.539
46 2HB DTR 6 2HB DTR 6 -0.650 6.003 -3.014
47 HD1 DTR 6 HD1 DTR 6 -3.136 7.154 -0.202
48 HE1 DTR 6 HE1 DTR 6 -5.262 5.588 -0.165
49 HZ2 DTR 6 HZ2 DTR 6 -6.061 3.324 -1.707
50 HH2 DTR 6 HH2 DTR 6 -5.298 1.853 -3.608
51 HZ3 DTR 6 HZ3 DTR 6 -3.157 2.293 -4.702
52 HE3 DTR 6 HE3 DTR 6 -1.644 4.161 -4.030
53 H IAM 7 H IAM 7 0.818 4.732 -2.580
54 HA IAM 7 HA IAM 7 2.847 3.987 -3.110
55 HB IAM 7 1HB IAM 7 2.699 6.964 -3.682
56 HD1 IAM 7 HD1 IAM 7 4.170 4.010 -5.420
57 HE1 IAM 7 HE1 IAM 7 3.393 3.236 -7.678
58 HE2 IAM 7 HE2 IAM 7 0.371 6.214 -7.658
59 HD2 IAM 7 HD2 IAM 7 1.147 6.988 -5.399
60 1HT IAM 7 1HT IAM 7 2.190 4.217 -9.858
61 2HT IAM 7 2HT IAM 7 0.598 4.867 -9.533
62 HH IAM 7 HH IAM 7 1.138 2.107 -9.718
63 HI IAM 7 HI IAM 7 0.228 2.789 -7.055
64 1HB IAM 7 2HB IAM 7 4.246 6.189 -3.949
65 1HK1 IAM 7 1HK1 IAM 7 -0.854 0.729 -8.989
66 2HK1 IAM 7 2HK1 IAM 7 0.443 0.462 -7.848
67 3HK1 IAM 7 3HK1 IAM 7 -1.176 0.771 -7.271
68 1HK2 IAM 7 1HK2 IAM 7 -1.259 4.345 -8.263
69 2HK2 IAM 7 2HK2 IAM 7 -1.860 3.023 -9.232
70 3HK2 IAM 7 3HK2 IAM 7 -2.183 3.064 -7.516
71 H THR 8 H THR 8 2.833 4.015 -0.394
72 HA THR 8 HA THR 8 5.520 5.040 0.228
73 HB THR 8 HB THR 8 3.740 6.531 1.201
74 HG1 THR 8 HG1 THR 8 5.129 4.656 2.984
75 1HG2 THR 8 1HG2 THR 8 2.629 5.343 3.305
76 2HG2 THR 8 2HG2 THR 8 1.838 5.218 1.716
77 3HG2 THR 8 3HG2 THR 8 2.822 3.866 2.329
78 H PHE 9 H PHE 9 4.756 3.879 3.052
79 HA PHE 9 HA PHE 9 6.174 1.525 2.758
80 1HB PHE 9 1HB PHE 9 4.927 1.098 5.068
81 2HB PHE 9 2HB PHE 9 5.991 2.486 4.945
82 HD1 PHE 9 HD1 PHE 9 5.170 4.663 5.281
83 HD2 PHE 9 HD2 PHE 9 2.432 1.465 4.746
84 HE1 PHE 9 HE1 PHE 9 3.276 6.174 5.943
85 HE2 PHE 9 HE2 PHE 9 0.539 2.976 5.405
86 HZ PHE 9 HZ PHE 9 0.984 5.311 5.997
87 H LYS 10 H LYS 10 5.501 -0.732 3.014
88 HA LYS 10 HA LYS 10 2.878 -1.163 1.783
89 1HB LYS 10 1HB LYS 10 5.221 -3.078 1.928
90 2HB LYS 10 2HB LYS 10 3.757 -3.262 0.985
91 1HG LYS 10 1HG LYS 10 5.103 -0.692 0.451
92 2HG LYS 10 2HG LYS 10 6.143 -2.062 0.121
93 1HD LYS 10 1HD LYS 10 3.760 -2.918 -1.000
94 2HD LYS 10 2HD LYS 10 3.665 -1.190 -1.278
95 1HE LYS 10 1HE LYS 10 6.241 -1.574 -2.043
96 2HE LYS 10 2HE LYS 10 5.630 -3.184 -2.371
97 3HZ LYS 10 3HZ LYS 10 4.427 -2.457 -4.083
98 H SER 11 H SER 11 1.344 -2.524 2.733
99 HA SER 11 HA SER 11 1.888 -3.129 5.576
100 1HB SER 11 1HB SER 11 -0.131 -2.049 5.730
101 2HB SER 11 2HB SER 11 -0.467 -2.159 4.009
102 HG SER 11 HG SER 11 -1.138 -4.350 4.371
103 H CYS 12 H CYS 12 0.241 -4.606 2.678
104 HA CYS 12 HA CYS 12 -0.224 -6.734 2.271
105 1HB CYS 12 1HB CYS 12 2.360 -6.294 1.845
106 2HB CYS 12 2HB CYS 12 2.538 -7.513 3.092
Start of MODEL 8
1 1H TYR 1 1H TYR 1 -6.093 -8.051 2.213
2 2H TYR 1 2H TYR 1 -4.851 -7.357 3.110
3 3H TYR 1 3H TYR 1 -5.045 -6.532 2.562
4 HA TYR 1 HA TYR 1 -3.934 -8.901 1.630
5 1HB TYR 1 1HB TYR 1 -4.401 -7.694 -0.895
6 2HB TYR 1 2HB TYR 1 -5.193 -9.146 -0.314
7 HD1 TYR 1 HD1 TYR 1 -7.505 -9.179 -0.405
8 HD2 TYR 1 HD2 TYR 1 -5.522 -5.424 0.103
9 HE1 TYR 1 HE1 TYR 1 -9.746 -7.977 -0.477
10 HE2 TYR 1 HE2 TYR 1 -7.768 -4.234 0.029
11 HH TYR 1 HH TYR 1 -9.896 -4.433 -0.305
12 H CYS 2 H CYS 2 -2.493 -7.997 -0.618
13 HA CYS 2 HA CYS 2 -0.590 -6.385 0.643
14 1HB CYS 2 1HB CYS 2 -0.838 -7.873 -1.793
15 2HB CYS 2 2HB CYS 2 -0.216 -6.279 -2.171
16 H LYS 3 H LYS 3 -0.402 -4.154 0.738
17 HA LYS 3 HA LYS 3 -1.673 -2.532 -1.264
18 1HB LYS 3 1HB LYS 3 -3.007 -1.237 0.409
19 2HB LYS 3 2HB LYS 3 -3.609 -2.851 0.087
20 1HG LYS 3 1HG LYS 3 -2.586 -3.709 2.150
21 2HG LYS 3 2HG LYS 3 -1.779 -2.180 2.439
22 1HD LYS 3 1HD LYS 3 -3.593 -1.465 3.590
23 2HD LYS 3 2HD LYS 3 -4.537 -1.537 2.115
24 1HE LYS 3 1HE LYS 3 -4.456 -4.212 2.834
25 2HE LYS 3 2HE LYS 3 -4.460 -3.437 4.406
26 1HZ LYS 3 1HZ LYS 3 -6.712 -3.572 3.887
27 2HZ LYS 3 2HZ LYS 3 -6.394 -2.057 3.386
28 1HN DHN 4 1HN DHN 4 -0.043 -1.184 -1.790
29 HA DHN 4 HA DHN 4 1.907 -0.545 0.272
30 1HB DHN 4 1HB DHN 4 1.927 0.408 -2.654
31 2HB DHN 4 2HB DHN 4 3.287 0.281 -1.566
32 1HG DHN 4 1HG DHN 4 2.712 -2.387 -1.649
33 2HG DHN 4 2HG DHN 4 1.869 -1.967 -3.118
34 H PHE 5 H PHE 5 -1.008 0.528 0.078
35 HA PHE 5 HA PHE 5 -2.088 2.463 0.236
36 1HB PHE 5 1HB PHE 5 0.559 3.242 1.601
37 2HB PHE 5 2HB PHE 5 -1.004 3.961 1.941
38 HD1 PHE 5 HD1 PHE 5 1.003 0.885 2.282
39 HD2 PHE 5 HD2 PHE 5 -2.542 2.918 3.432
40 HE1 PHE 5 HE1 PHE 5 0.611 -0.817 4.084
41 HE2 PHE 5 HE2 PHE 5 -2.932 1.217 5.236
42 HZ PHE 5 HZ PHE 5 -1.352 -0.632 5.539
43 H DTR 6 H DTR 6 -1.067 5.177 0.544
44 HA DTR 6 HA DTR 6 -0.563 6.924 -0.673
45 1HB DTR 6 1HB DTR 6 -0.616 6.005 -3.362
46 2HB DTR 6 2HB DTR 6 -1.648 4.868 -2.513
47 HD1 DTR 6 HD1 DTR 6 -3.113 6.920 -0.506
48 HE1 DTR 6 HE1 DTR 6 -4.887 8.681 -1.354
49 HZ2 DTR 6 HZ2 DTR 6 -5.421 9.865 -3.894
50 HH2 DTR 6 HH2 DTR 6 -4.623 9.866 -6.286
51 HZ3 DTR 6 HZ3 DTR 6 -2.745 8.444 -6.942
52 HE3 DTR 6 HE3 DTR 6 -1.541 6.958 -5.339
53 H IAM 7 H IAM 7 0.773 4.539 -3.037
54 HA IAM 7 HA IAM 7 2.916 3.834 -3.264
55 HB IAM 7 1HB IAM 7 2.711 6.854 -3.715
56 HD1 IAM 7 HD1 IAM 7 1.309 7.206 -5.497
57 HE1 IAM 7 HE1 IAM 7 0.423 6.590 -7.765
58 HE2 IAM 7 HE2 IAM 7 2.899 3.142 -7.792
59 HD2 IAM 7 HD2 IAM 7 3.783 3.760 -5.525
60 1HT IAM 7 1HT IAM 7 1.888 4.318 -9.966
61 2HT IAM 7 2HT IAM 7 0.431 5.234 -9.649
62 HH IAM 7 HH IAM 7 0.686 2.321 -9.572
63 HI IAM 7 HI IAM 7 -1.400 4.195 -8.480
64 1HB IAM 7 2HB IAM 7 4.212 6.026 -4.077
65 1HK1 IAM 7 1HK1 IAM 7 -0.540 1.603 -7.181
66 2HK1 IAM 7 2HK1 IAM 7 -0.233 3.201 -6.546
67 3HK1 IAM 7 3HK1 IAM 7 -1.872 2.604 -6.652
68 1HK2 IAM 7 1HK2 IAM 7 -2.088 2.745 -10.354
69 2HK2 IAM 7 2HK2 IAM 7 -1.637 1.333 -9.429
70 3HK2 IAM 7 3HK2 IAM 7 -2.968 2.334 -8.902
71 H THR 8 H THR 8 2.740 3.733 -0.589
72 HA THR 8 HA THR 8 5.273 4.942 0.262
73 HB THR 8 HB THR 8 3.351 6.349 1.081
74 HG1 THR 8 HG1 THR 8 4.692 4.555 2.980
75 1HG2 THR 8 1HG2 THR 8 2.144 5.117 3.106
76 2HG2 THR 8 2HG2 THR 8 1.482 4.944 1.464
77 3HG2 THR 8 3HG2 THR 8 2.483 3.647 2.160
78 H PHE 9 H PHE 9 4.421 3.774 3.028
79 HA PHE 9 HA PHE 9 5.945 1.497 2.882
80 1HB PHE 9 1HB PHE 9 4.513 0.988 5.057
81 2HB PHE 9 2HB PHE 9 5.478 2.451 5.034
82 HD1 PHE 9 HD1 PHE 9 2.044 1.167 4.506
83 HD2 PHE 9 HD2 PHE 9 4.470 4.566 5.258
84 HE1 PHE 9 HE1 PHE 9 -0.014 2.532 4.968
85 HE2 PHE 9 HE2 PHE 9 2.415 5.931 5.721
86 HZ PHE 9 HZ PHE 9 0.198 4.898 5.568
87 H LYS 10 H LYS 10 4.980 -0.764 3.713
88 HA LYS 10 HA LYS 10 2.669 -1.367 2.002
89 1HB LYS 10 1HB LYS 10 5.342 -2.715 2.191
90 2HB LYS 10 2HB LYS 10 3.924 -3.685 1.850
91 1HG LYS 10 1HG LYS 10 4.052 -3.037 -0.316
92 2HG LYS 10 2HG LYS 10 3.668 -1.401 0.182
93 1HD LYS 10 1HD LYS 10 5.770 -0.706 -0.302
94 2HD LYS 10 2HD LYS 10 6.457 -1.900 0.780
95 1HE LYS 10 1HE LYS 10 7.156 -2.062 -1.700
96 2HE LYS 10 2HE LYS 10 6.628 -3.551 -0.938
97 3HZ LYS 10 3HZ LYS 10 4.836 -3.661 -2.236
98 H SER 11 H SER 11 1.219 -2.989 2.791
99 HA SER 11 HA SER 11 1.711 -3.904 5.551
100 1HB SER 11 1HB SER 11 -0.658 -2.217 4.547
101 2HB SER 11 2HB SER 11 -0.840 -3.281 5.932
102 HG SER 11 HG SER 11 0.896 -2.120 6.940
103 H CYS 12 H CYS 12 2.200 -5.563 3.511
104 HA CYS 12 HA CYS 12 -0.098 -6.850 2.525
105 1HB CYS 12 1HB CYS 12 2.454 -6.867 1.780
106 2HB CYS 12 2HB CYS 12 2.497 -8.303 2.782
Start of MODEL 9
1 1H TYR 1 1H TYR 1 -5.562 -6.955 3.139
2 2H TYR 1 2H TYR 1 -5.773 -5.859 1.881
3 3H TYR 1 3H TYR 1 -5.532 -5.923 2.403
4 HA TYR 1 HA TYR 1 -4.451 -8.435 1.917
5 1HB TYR 1 1HB TYR 1 -4.696 -7.600 -0.787
6 2HB TYR 1 2HB TYR 1 -5.573 -8.933 -0.063
7 HD1 TYR 1 HD1 TYR 1 -5.790 -5.198 -0.370
8 HD2 TYR 1 HD2 TYR 1 -7.895 -8.916 -0.156
9 HE1 TYR 1 HE1 TYR 1 -7.987 -3.986 -0.781
10 HE2 TYR 1 HE2 TYR 1 -10.085 -7.691 -0.567
11 HH TYR 1 HH TYR 1 -11.058 -5.771 -0.778
12 H CYS 2 H CYS 2 -2.821 -7.919 -0.326
13 HA CYS 2 HA CYS 2 -0.887 -6.305 0.794
14 1HB CYS 2 1HB CYS 2 -1.319 -7.626 -1.817
15 2HB CYS 2 2HB CYS 2 -0.196 -6.281 -1.827
16 H LYS 3 H LYS 3 -0.553 -4.087 0.777
17 HA LYS 3 HA LYS 3 -1.752 -2.489 -1.293
18 1HB LYS 3 1HB LYS 3 -2.960 -1.025 0.334
19 2HB LYS 3 2HB LYS 3 -3.671 -2.610 0.113
20 1HG LYS 3 1HG LYS 3 -2.652 -3.425 2.198
21 2HG LYS 3 2HG LYS 3 -1.750 -1.933 2.388
22 1HD LYS 3 1HD LYS 3 -3.538 -0.829 3.281
23 2HD LYS 3 2HD LYS 3 -4.639 -1.439 2.064
24 1HE LYS 3 1HE LYS 3 -5.207 -3.333 3.314
25 2HE LYS 3 2HE LYS 3 -3.656 -3.399 4.128
26 1HZ LYS 3 1HZ LYS 3 -5.071 -2.585 5.768
27 2HZ LYS 3 2HZ LYS 3 -4.461 -1.188 5.197
28 1HN DHN 4 1HN DHN 4 -0.395 -0.827 -1.783
29 HA DHN 4 HA DHN 4 1.789 -0.389 0.130
30 1HB DHN 4 1HB DHN 4 1.679 0.489 -2.823
31 2HB DHN 4 2HB DHN 4 3.090 0.429 -1.796
32 1HG DHN 4 1HG DHN 4 2.529 -2.253 -1.738
33 2HG DHN 4 2HG DHN 4 1.645 -1.895 -3.201
34 H PHE 5 H PHE 5 -1.102 0.771 0.040
35 HA PHE 5 HA PHE 5 -2.110 2.740 0.236
36 1HB PHE 5 1HB PHE 5 0.622 3.463 1.455
37 2HB PHE 5 2HB PHE 5 -0.904 4.225 1.865
38 HD1 PHE 5 HD1 PHE 5 -1.985 3.520 3.774
39 HD2 PHE 5 HD2 PHE 5 0.638 0.821 1.812
40 HE1 PHE 5 HE1 PHE 5 -2.326 1.849 5.616
41 HE2 PHE 5 HE2 PHE 5 0.294 -0.851 3.653
42 HZ PHE 5 HZ PHE 5 -1.182 -0.316 5.533
43 H DTR 6 H DTR 6 -0.782 5.410 0.515
44 HA DTR 6 HA DTR 6 -0.350 7.130 -0.767
45 1HB DTR 6 1HB DTR 6 -1.370 7.106 -2.895
46 2HB DTR 6 2HB DTR 6 -0.668 5.557 -3.322
47 HD1 DTR 6 HD1 DTR 6 -3.378 6.696 -0.722
48 HE1 DTR 6 HE1 DTR 6 -5.397 4.999 -0.706
49 HZ2 DTR 6 HZ2 DTR 6 -5.948 2.584 -2.123
50 HH2 DTR 6 HH2 DTR 6 -4.967 1.039 -3.856
51 HZ3 DTR 6 HZ3 DTR 6 -2.786 1.542 -4.840
52 HE3 DTR 6 HE3 DTR 6 -1.442 3.549 -4.212
53 H IAM 7 H IAM 7 0.805 4.343 -2.812
54 HA IAM 7 HA IAM 7 2.871 3.642 -3.252
55 HB IAM 7 1HB IAM 7 2.721 6.629 -3.831
56 HD1 IAM 7 HD1 IAM 7 0.758 4.707 -4.754
57 HE1 IAM 7 HE1 IAM 7 -0.020 3.956 -7.021
58 HE2 IAM 7 HE2 IAM 7 3.795 4.878 -8.634
59 HD2 IAM 7 HD2 IAM 7 4.572 5.629 -6.367
60 1HT IAM 7 1HT IAM 7 1.080 2.886 -9.292
61 2HT IAM 7 2HT IAM 7 2.165 4.032 -10.046
62 HH IAM 7 HH IAM 7 -0.545 4.315 -10.310
63 HI IAM 7 HI IAM 7 1.068 6.455 -8.916
64 1HB IAM 7 2HB IAM 7 4.256 5.827 -4.089
65 1HK1 IAM 7 1HK1 IAM 7 -1.935 6.098 -8.860
66 2HK1 IAM 7 2HK1 IAM 7 -0.856 5.793 -7.519
67 3HK1 IAM 7 3HK1 IAM 7 -1.062 7.421 -8.123
68 1HK2 IAM 7 1HK2 IAM 7 0.730 6.866 -11.327
69 2HK2 IAM 7 2HK2 IAM 7 -0.998 6.730 -11.108
70 3HK2 IAM 7 3HK2 IAM 7 -0.124 8.053 -10.373
71 H THR 8 H THR 8 2.705 3.755 -0.518
72 HA THR 8 HA THR 8 5.367 4.786 0.191
73 HB THR 8 HB THR 8 3.557 6.332 1.018
74 HG1 THR 8 HG1 THR 8 4.849 4.524 2.938
75 1HG2 THR 8 1HG2 THR 8 2.343 5.242 3.119
76 2HG2 THR 8 2HG2 THR 8 1.622 5.054 1.504
77 3HG2 THR 8 3HG2 THR 8 2.566 3.724 2.217
78 H PHE 9 H PHE 9 4.505 3.757 3.022
79 HA PHE 9 HA PHE 9 5.887 1.373 2.881
80 1HB PHE 9 1HB PHE 9 4.537 1.059 5.155
81 2HB PHE 9 2HB PHE 9 5.636 2.419 5.021
82 HD1 PHE 9 HD1 PHE 9 4.847 4.641 5.158
83 HD2 PHE 9 HD2 PHE 9 2.072 1.450 4.793
84 HE1 PHE 9 HE1 PHE 9 2.964 6.218 5.681
85 HE2 PHE 9 HE2 PHE 9 0.190 3.027 5.313
86 HZ PHE 9 HZ PHE 9 0.659 5.392 5.753
87 H LYS 10 H LYS 10 5.193 -0.861 3.155
88 HA LYS 10 HA LYS 10 2.608 -1.310 1.862
89 1HB LYS 10 1HB LYS 10 5.200 -2.829 1.939
90 2HB LYS 10 2HB LYS 10 3.703 -3.683 1.619
91 1HG LYS 10 1HG LYS 10 3.916 -3.033 -0.547
92 2HG LYS 10 2HG LYS 10 3.501 -1.415 -0.021
93 1HD LYS 10 1HD LYS 10 5.651 -0.649 -0.242
94 2HD LYS 10 2HD LYS 10 6.344 -2.096 0.465
95 1HE LYS 10 1HE LYS 10 7.095 -2.277 -1.748
96 2HE LYS 10 2HE LYS 10 5.637 -3.250 -1.809
97 3HZ LYS 10 3HZ LYS 10 4.630 -1.784 -3.131
98 H SER 11 H SER 11 1.094 -2.808 2.744
99 HA SER 11 HA SER 11 1.683 -3.712 5.500
100 1HB SER 11 1HB SER 11 0.391 -1.554 5.634
101 2HB SER 11 2HB SER 11 -0.851 -2.188 4.565
102 HG SER 11 HG SER 11 -1.263 -3.821 6.160
103 H CYS 12 H CYS 12 2.106 -5.458 3.543
104 HA CYS 12 HA CYS 12 -0.233 -6.737 2.629
105 1HB CYS 12 1HB CYS 12 2.670 -7.518 2.752
106 2HB CYS 12 2HB CYS 12 1.448 -8.657 2.223
Start of MODEL 10
1 1H TYR 1 1H TYR 1 -4.272 -8.895 1.413
2 2H TYR 1 2H TYR 1 -4.736 -9.966 0.203
3 3H TYR 1 3H TYR 1 -3.249 -9.366 1.148
4 HA TYR 1 HA TYR 1 -3.885 -8.697 -1.471
5 1HB TYR 1 1HB TYR 1 -4.721 -6.270 -0.272
6 2HB TYR 1 2HB TYR 1 -5.787 -7.417 -1.059
7 HD1 TYR 1 HD1 TYR 1 -4.856 -5.880 2.062
8 HD2 TYR 1 HD2 TYR 1 -6.874 -9.244 0.358
9 HE1 TYR 1 HE1 TYR 1 -6.063 -6.280 4.264
10 HE2 TYR 1 HE2 TYR 1 -8.076 -9.633 2.565
11 HH TYR 1 HH TYR 1 -8.252 -9.051 4.643
12 H CYS 2 H CYS 2 -3.259 -5.946 -1.514
13 HA CYS 2 HA CYS 2 -0.886 -5.667 0.120
14 1HB CYS 2 1HB CYS 2 -0.828 -6.331 -2.728
15 2HB CYS 2 2HB CYS 2 0.045 -4.857 -2.358
16 H LYS 3 H LYS 3 -0.959 -3.595 0.920
17 HA LYS 3 HA LYS 3 -2.285 -1.581 -0.756
18 1HB LYS 3 1HB LYS 3 -2.435 -1.685 2.264
19 2HB LYS 3 2HB LYS 3 -3.307 -0.617 1.184
20 1HG LYS 3 1HG LYS 3 -3.962 -3.156 0.202
21 2HG LYS 3 2HG LYS 3 -3.894 -3.417 1.933
22 1HD LYS 3 1HD LYS 3 -5.392 -1.027 0.807
23 2HD LYS 3 2HD LYS 3 -6.152 -2.604 0.847
24 1HE LYS 3 1HE LYS 3 -6.216 -2.678 3.192
25 2HE LYS 3 2HE LYS 3 -4.822 -1.630 3.373
26 1HZ LYS 3 1HZ LYS 3 -6.593 -0.238 3.903
27 2HZ LYS 3 2HZ LYS 3 -6.393 0.139 2.331
28 1HN DHN 4 1HN DHN 4 -0.474 -0.608 -1.626
29 HA DHN 4 HA DHN 4 1.696 0.044 0.214
30 1HB DHN 4 1HB DHN 4 1.538 0.667 -2.799
31 2HB DHN 4 2HB DHN 4 2.974 0.595 -1.807
32 1HG DHN 4 1HG DHN 4 2.099 -2.046 -1.538
33 2HG DHN 4 2HG DHN 4 1.416 -1.683 -3.104
34 H PHE 5 H PHE 5 -1.165 1.321 0.040
35 HA PHE 5 HA PHE 5 -2.077 3.362 -0.056
36 1HB PHE 5 1HB PHE 5 0.542 4.054 1.393
37 2HB PHE 5 2HB PHE 5 -1.022 4.794 1.673
38 HD1 PHE 5 HD1 PHE 5 -2.300 4.055 3.452
39 HD2 PHE 5 HD2 PHE 5 0.634 1.452 1.830
40 HE1 PHE 5 HE1 PHE 5 -2.758 2.397 5.281
41 HE2 PHE 5 HE2 PHE 5 0.174 -0.206 3.658
42 HZ PHE 5 HZ PHE 5 -1.515 0.288 5.362
43 H DTR 6 H DTR 6 -0.759 5.972 0.195
44 HA DTR 6 HA DTR 6 0.019 7.587 -1.060
45 1HB DTR 6 1HB DTR 6 -0.248 7.084 -3.650
46 2HB DTR 6 2HB DTR 6 -0.888 5.535 -3.137
47 HD1 DTR 6 HD1 DTR 6 -1.820 8.727 -1.181
48 HE1 DTR 6 HE1 DTR 6 -4.391 9.275 -1.418
49 HZ2 DTR 6 HZ2 DTR 6 -6.493 8.186 -3.011
50 HH2 DTR 6 HH2 DTR 6 -6.947 6.419 -4.751
51 HZ3 DTR 6 HZ3 DTR 6 -5.127 4.986 -5.534
52 HE3 DTR 6 HE3 DTR 6 -2.786 5.180 -4.689
53 H IAM 7 H IAM 7 1.049 4.887 -3.245
54 HA IAM 7 HA IAM 7 3.079 3.912 -3.421
55 HB IAM 7 1HB IAM 7 3.221 6.891 -4.057
56 HD1 IAM 7 HD1 IAM 7 1.446 6.769 -5.637
57 HE1 IAM 7 HE1 IAM 7 0.671 6.060 -7.917
58 HE2 IAM 7 HE2 IAM 7 3.922 3.345 -8.177
59 HD2 IAM 7 HD2 IAM 7 4.696 4.055 -5.896
60 1HT IAM 7 1HT IAM 7 2.491 4.545 -10.299
61 2HT IAM 7 2HT IAM 7 0.827 4.675 -9.775
62 HH IAM 7 HH IAM 7 2.270 2.201 -10.215
63 HI IAM 7 HI IAM 7 0.623 1.034 -9.001
64 1HB IAM 7 2HB IAM 7 4.674 5.932 -4.254
65 1HK1 IAM 7 1HK1 IAM 7 -0.746 3.728 -8.838
66 2HK1 IAM 7 2HK1 IAM 7 -0.992 2.544 -10.099
67 3HK1 IAM 7 3HK1 IAM 7 -1.491 2.190 -8.463
68 1HK2 IAM 7 1HK2 IAM 7 1.939 1.858 -7.081
69 2HK2 IAM 7 2HK2 IAM 7 0.985 3.321 -7.055
70 3HK2 IAM 7 3HK2 IAM 7 0.240 1.786 -6.680
71 H THR 8 H THR 8 2.832 4.007 -0.734
72 HA THR 8 HA THR 8 5.521 4.817 0.098
73 HB THR 8 HB THR 8 3.852 6.626 0.715
74 HG1 THR 8 HG1 THR 8 4.921 4.857 2.801
75 1HG2 THR 8 1HG2 THR 8 2.502 5.841 2.868
76 2HG2 THR 8 2HG2 THR 8 1.787 5.598 1.256
77 3HG2 THR 8 3HG2 THR 8 2.577 4.240 2.093
78 H PHE 9 H PHE 9 4.333 4.091 2.923
79 HA PHE 9 HA PHE 9 5.473 1.675 3.212
80 1HB PHE 9 1HB PHE 9 4.560 3.064 5.053
81 2HB PHE 9 2HB PHE 9 2.930 2.901 4.429
82 HD1 PHE 9 HD1 PHE 9 5.718 0.684 5.565
83 HD2 PHE 9 HD2 PHE 9 1.541 1.427 5.515
84 HE1 PHE 9 HE1 PHE 9 5.347 -1.307 7.050
85 HE2 PHE 9 HE2 PHE 9 1.169 -0.563 7.000
86 HZ PHE 9 HZ PHE 9 3.077 -1.907 7.747
87 H LYS 10 H LYS 10 4.305 -0.482 3.811
88 HA LYS 10 HA LYS 10 2.204 -0.981 1.823
89 1HB LYS 10 1HB LYS 10 4.806 -2.374 2.261
90 2HB LYS 10 2HB LYS 10 3.415 -3.369 1.886
91 1HG LYS 10 1HG LYS 10 3.622 -2.813 -0.299
92 2HG LYS 10 2HG LYS 10 3.280 -1.142 0.104
93 1HD LYS 10 1HD LYS 10 5.495 -0.515 0.000
94 2HD LYS 10 2HD LYS 10 6.063 -2.004 0.726
95 1HE LYS 10 1HE LYS 10 6.855 -2.164 -1.498
96 2HE LYS 10 2HE LYS 10 5.407 -3.149 -1.527
97 3HZ LYS 10 3HZ LYS 10 4.381 -1.725 -2.883
98 H SER 11 H SER 11 0.627 -2.590 2.411
99 HA SER 11 HA SER 11 0.748 -3.556 5.187
100 1HB SER 11 1HB SER 11 -0.432 -1.415 5.440
101 2HB SER 11 2HB SER 11 -1.442 -1.701 4.032
102 HG SER 11 HG SER 11 -2.380 -3.486 5.178
103 H CYS 12 H CYS 12 1.317 -5.200 3.163
104 HA CYS 12 HA CYS 12 -1.023 -6.296 1.985
105 1HB CYS 12 1HB CYS 12 1.673 -7.629 2.225
106 2HB CYS 12 2HB CYS 12 0.413 -7.950 1.049