Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
610758 | 2ndl RC | 26064 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -8.518 -2.291 0.041
2 HA2 GLY 1 HA2 GLY 1 -7.984 -4.809 -1.153
3 HA3 GLY 1 HA1 GLY 1 -7.026 -3.558 -1.931
4 HA PRO 2 HA PRO 2 -5.072 -5.164 2.098
5 HB2 PRO 2 HB2 PRO 2 -3.094 -6.664 0.999
6 HB3 PRO 2 HB1 PRO 2 -4.681 -7.321 1.411
7 HG2 PRO 2 HG2 PRO 2 -3.635 -6.425 -1.246
8 HG3 PRO 2 HG1 PRO 2 -4.594 -7.863 -0.849
9 HD2 PRO 2 HD2 PRO 2 -5.690 -5.633 -1.926
10 HD3 PRO 2 HD1 PRO 2 -6.574 -6.684 -0.800
11 H CYS 3 H CYS 3 -2.365 -5.320 2.167
12 HA CYS 3 HA CYS 3 -1.564 -2.643 1.265
13 HB2 CYS 3 HB2 CYS 3 0.002 -4.256 3.246
14 HB3 CYS 3 HB1 CYS 3 -0.137 -2.508 3.097
15 H PHE 4 H PHE 4 0.460 -2.298 0.289
16 HA PHE 4 HA PHE 4 1.939 -4.664 -0.591
17 HB2 PHE 4 HB2 PHE 4 0.572 -2.671 -2.366
18 HB3 PHE 4 HB1 PHE 4 2.050 -3.458 -2.908
19 HD1 PHE 4 HD2 PHE 4 2.107 -5.907 -3.208
20 HD2 PHE 4 HD1 PHE 4 -1.494 -3.831 -2.293
21 HE1 PHE 4 HE2 PHE 4 0.800 -7.860 -3.937
22 HE2 PHE 4 HE1 PHE 4 -2.808 -5.781 -3.019
23 HZ PHE 4 HZ PHE 4 -1.661 -7.799 -3.844
24 HA PRO 5 HA PRO 5 5.387 -2.110 0.417
25 HB2 PRO 5 HB2 PRO 5 7.315 -3.510 -0.886
26 HB3 PRO 5 HB1 PRO 5 6.575 -4.066 0.619
27 HG2 PRO 5 HG2 PRO 5 5.975 -4.878 -2.199
28 HG3 PRO 5 HG1 PRO 5 6.127 -5.891 -0.752
29 HD2 PRO 5 HD2 PRO 5 3.729 -5.155 -1.770
30 HD3 PRO 5 HD1 PRO 5 3.992 -5.400 -0.032
31 H MET 6 H MET 6 4.460 -0.362 -0.954
32 HA MET 6 HA MET 6 6.307 0.264 -3.102
33 HB2 MET 6 HB2 MET 6 3.424 -0.320 -3.525
34 HB3 MET 6 HB1 MET 6 4.098 1.051 -4.397
35 HG2 MET 6 HG2 MET 6 5.769 -0.374 -5.410
36 HG3 MET 6 HG1 MET 6 5.187 -1.753 -4.480
37 HE1 MET 6 HE1 MET 6 2.132 -2.933 -5.823
38 HE2 MET 6 HE2 MET 6 3.631 -3.577 -6.492
39 HE3 MET 6 HE3 MET 6 3.563 -3.078 -4.801
40 H GLY 7 H GLY 7 5.559 2.546 -4.046
41 HA2 GLY 7 HA2 GLY 7 4.983 4.758 -3.636
42 HA3 GLY 7 HA1 GLY 7 4.301 4.262 -2.094
43 HA PRO 8 HA PRO 8 8.263 6.617 -1.367
44 HB2 PRO 8 HB2 PRO 8 7.190 8.393 0.383
45 HB3 PRO 8 HB1 PRO 8 7.198 8.653 -1.365
46 HG2 PRO 8 HG2 PRO 8 4.992 7.646 0.389
47 HG3 PRO 8 HG1 PRO 8 4.917 8.814 -0.943
48 HD2 PRO 8 HD2 PRO 8 4.186 6.223 -1.234
49 HD3 PRO 8 HD1 PRO 8 4.908 7.166 -2.554
50 H TRP 9 H TRP 9 5.719 5.450 0.780
51 HA TRP 9 HA TRP 9 7.599 5.170 2.989
52 HB2 TRP 9 HB2 TRP 9 4.636 5.008 2.689
53 HB3 TRP 9 HB1 TRP 9 5.382 4.117 4.012
54 HD1 TRP 9 HD TRP 9 5.181 7.746 2.670
55 HE1 TRP 9 HE1 TRP 9 5.410 9.346 4.673
56 HE3 TRP 9 HE3 TRP 9 6.066 4.314 6.356
57 HZ2 TRP 9 HZ2 TRP 9 5.902 9.177 7.448
58 HZ3 TRP 9 HZ3 TRP 9 6.406 5.117 8.657
59 HH2 TRP 9 HH TRP 9 6.325 7.497 9.190
60 H GLY 10 H GLY 10 5.579 3.133 0.898
61 HA2 GLY 10 HA2 GLY 10 6.620 1.053 0.100
62 HA3 GLY 10 HA1 GLY 10 7.239 0.834 1.730
63 HA PRO 11 HA PRO 11 3.776 -1.730 2.572
64 HB2 PRO 11 HB2 PRO 11 3.717 -1.533 5.280
65 HB3 PRO 11 HB1 PRO 11 4.945 -2.461 4.410
66 HG2 PRO 11 HG2 PRO 11 5.116 0.298 5.560
67 HG3 PRO 11 HG1 PRO 11 6.308 -1.013 5.616
68 HD2 PRO 11 HD2 PRO 11 6.492 1.050 3.871
69 HD3 PRO 11 HD1 PRO 11 7.066 -0.585 3.483
70 H PHE 12 H PHE 12 2.314 -0.153 1.524
71 HA PHE 12 HA PHE 12 0.709 1.332 3.499
72 HB2 PHE 12 HB2 PHE 12 0.205 2.961 1.885
73 HB3 PHE 12 HB1 PHE 12 1.912 2.619 1.618
74 HD1 PHE 12 HD2 PHE 12 -1.478 2.229 0.297
75 HD2 PHE 12 HD1 PHE 12 2.662 1.506 -0.378
76 HE1 PHE 12 HE2 PHE 12 -1.955 1.720 -2.062
77 HE2 PHE 12 HE1 PHE 12 2.191 0.996 -2.739
78 HZ PHE 12 HZ PHE 12 -0.120 1.101 -3.583
79 H CYS 13 H CYS 13 -1.520 1.142 3.455
80 HA CYS 13 HA CYS 13 -2.532 -1.143 1.904
81 HB2 CYS 13 HB2 CYS 13 -3.859 0.067 4.325
82 HB3 CYS 13 HB1 CYS 13 -4.127 -1.522 3.617
83 H ILE 14 H ILE 14 -4.572 -1.014 0.894
84 HA ILE 14 HA ILE 14 -5.426 1.743 0.308
85 HB ILE 14 HB ILE 14 -6.497 0.564 -1.751
86 HG12 ILE 14 HG12 ILE 14 -4.294 -1.387 -1.049
87 HG13 ILE 14 HG11 ILE 14 -6.018 -1.729 -0.970
88 HG21 ILE 14 HG21 ILE 14 -4.110 1.920 -1.302
89 HG22 ILE 14 HG22 ILE 14 -3.663 0.535 -2.296
90 HG23 ILE 14 HG23 ILE 14 -4.904 1.656 -2.854
91 HD11 ILE 14 HD11 ILE 14 -5.062 -2.664 -2.976
92 HD12 ILE 14 HD12 ILE 14 -6.178 -1.363 -3.391
93 HD13 ILE 14 HD13 ILE 14 -4.437 -1.085 -3.447
94 HA PRO 15 HA PRO 15 -9.451 0.989 1.886
95 HB2 PRO 15 HB2 PRO 15 -11.011 2.350 0.129
96 HB3 PRO 15 HB1 PRO 15 -9.969 3.152 1.311
97 HG2 PRO 15 HG2 PRO 15 -9.485 2.634 -1.598
98 HG3 PRO 15 HG1 PRO 15 -9.158 4.099 -0.653
99 HD2 PRO 15 HD2 PRO 15 -7.224 2.314 -1.290
100 HD3 PRO 15 HD1 PRO 15 -7.200 3.252 0.218
101 H ASP 16 H ASP 16 -8.895 0.269 -1.507
102 HA ASP 16 HA ASP 16 -11.296 -1.301 -1.783
103 HB2 ASP 16 HB2 ASP 16 -8.898 -1.200 -3.622
104 HB3 ASP 16 HB1 ASP 16 -10.513 -1.779 -4.019
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -8.490 -2.251 0.007
2 HA2 GLY 1 HA2 GLY 1 -7.984 -4.811 -1.150
3 HA3 GLY 1 HA1 GLY 1 -7.027 -3.559 -1.930
4 HA PRO 2 HA PRO 2 -5.071 -5.162 2.101
5 HB2 PRO 2 HB2 PRO 2 -3.094 -6.663 1.002
6 HB3 PRO 2 HB1 PRO 2 -4.682 -7.320 1.416
7 HG2 PRO 2 HG2 PRO 2 -3.636 -6.426 -1.243
8 HG3 PRO 2 HG1 PRO 2 -4.594 -7.864 -0.843
9 HD2 PRO 2 HD2 PRO 2 -5.691 -5.636 -1.922
10 HD3 PRO 2 HD1 PRO 2 -6.574 -6.685 -0.796
11 H CYS 3 H CYS 3 -2.365 -5.317 2.170
12 HA CYS 3 HA CYS 3 -1.564 -2.641 1.264
13 HB2 CYS 3 HB2 CYS 3 0.004 -4.254 3.245
14 HB3 CYS 3 HB1 CYS 3 -0.136 -2.505 3.095
15 H PHE 4 H PHE 4 0.462 -2.298 0.290
16 HA PHE 4 HA PHE 4 1.939 -4.663 -0.591
17 HB2 PHE 4 HB2 PHE 4 0.571 -2.671 -2.366
18 HB3 PHE 4 HB1 PHE 4 2.050 -3.457 -2.909
19 HD1 PHE 4 HD2 PHE 4 2.106 -5.903 -3.219
20 HD2 PHE 4 HD1 PHE 4 -1.494 -3.836 -2.281
21 HE1 PHE 4 HE2 PHE 4 0.799 -7.856 -3.947
22 HE2 PHE 4 HE1 PHE 4 -2.807 -5.786 -3.007
23 HZ PHE 4 HZ PHE 4 -1.661 -7.799 -3.843
24 HA PRO 5 HA PRO 5 5.388 -2.111 0.414
25 HB2 PRO 5 HB2 PRO 5 7.315 -3.512 -0.888
26 HB3 PRO 5 HB1 PRO 5 6.576 -4.067 0.618
27 HG2 PRO 5 HG2 PRO 5 5.975 -4.880 -2.200
28 HG3 PRO 5 HG1 PRO 5 6.126 -5.892 -0.752
29 HD2 PRO 5 HD2 PRO 5 3.727 -5.156 -1.771
30 HD3 PRO 5 HD1 PRO 5 3.992 -5.401 -0.032
31 H MET 6 H MET 6 4.466 -0.361 -0.953
32 HA MET 6 HA MET 6 6.311 0.264 -3.102
33 HB2 MET 6 HB2 MET 6 3.428 -0.321 -3.527
34 HB3 MET 6 HB1 MET 6 4.104 1.050 -4.398
35 HG2 MET 6 HG2 MET 6 5.859 -0.453 -5.295
36 HG3 MET 6 HG1 MET 6 5.041 -1.806 -4.516
37 HE1 MET 6 HE1 MET 6 4.053 0.184 -8.449
38 HE2 MET 6 HE2 MET 6 4.135 1.261 -7.055
39 HE3 MET 6 HE3 MET 6 5.525 0.262 -7.480
40 H GLY 7 H GLY 7 5.563 2.546 -4.048
41 HA2 GLY 7 HA2 GLY 7 4.990 4.757 -3.638
42 HA3 GLY 7 HA1 GLY 7 4.304 4.262 -2.098
43 HA PRO 8 HA PRO 8 8.265 6.614 -1.363
44 HB2 PRO 8 HB2 PRO 8 7.189 8.391 0.386
45 HB3 PRO 8 HB1 PRO 8 7.201 8.651 -1.362
46 HG2 PRO 8 HG2 PRO 8 4.990 7.644 0.387
47 HG3 PRO 8 HG1 PRO 8 4.919 8.813 -0.944
48 HD2 PRO 8 HD2 PRO 8 4.187 6.222 -1.239
49 HD3 PRO 8 HD1 PRO 8 4.912 7.165 -2.556
50 H TRP 9 H TRP 9 5.715 5.454 0.782
51 HA TRP 9 HA TRP 9 7.588 5.172 2.994
52 HB2 TRP 9 HB2 TRP 9 4.627 4.586 2.794
53 HB3 TRP 9 HB1 TRP 9 5.587 4.402 4.260
54 HD1 TRP 9 HD TRP 9 3.886 7.020 2.109
55 HE1 TRP 9 HE1 TRP 9 3.986 9.294 3.311
56 HE3 TRP 9 HE3 TRP 9 7.078 5.791 5.908
57 HZ2 TRP 9 HZ2 TRP 9 5.252 10.418 5.570
58 HZ3 TRP 9 HZ3 TRP 9 7.684 7.522 7.547
59 HH2 TRP 9 HH TRP 9 6.789 9.788 7.379
60 H GLY 10 H GLY 10 5.578 3.134 0.898
61 HA2 GLY 10 HA2 GLY 10 6.621 1.054 0.103
62 HA3 GLY 10 HA1 GLY 10 7.236 0.836 1.735
63 HA PRO 11 HA PRO 11 3.773 -1.734 2.566
64 HB2 PRO 11 HB2 PRO 11 3.712 -1.541 5.273
65 HB3 PRO 11 HB1 PRO 11 4.941 -2.466 4.404
66 HG2 PRO 11 HG2 PRO 11 5.110 0.290 5.559
67 HG3 PRO 11 HG1 PRO 11 6.303 -1.021 5.614
68 HD2 PRO 11 HD2 PRO 11 6.488 1.045 3.874
69 HD3 PRO 11 HD1 PRO 11 7.063 -0.589 3.482
70 H PHE 12 H PHE 12 2.318 -0.145 1.518
71 HA PHE 12 HA PHE 12 0.711 1.336 3.494
72 HB2 PHE 12 HB2 PHE 12 0.205 2.963 1.878
73 HB3 PHE 12 HB1 PHE 12 1.912 2.622 1.612
74 HD1 PHE 12 HD2 PHE 12 -1.477 2.227 0.290
75 HD2 PHE 12 HD1 PHE 12 2.663 1.509 -0.384
76 HE1 PHE 12 HE2 PHE 12 -1.954 1.713 -2.068
77 HE2 PHE 12 HE1 PHE 12 2.194 0.996 -2.743
78 HZ PHE 12 HZ PHE 12 -0.117 1.097 -3.588
79 H CYS 13 H CYS 13 -1.518 1.145 3.452
80 HA CYS 13 HA CYS 13 -2.532 -1.141 1.905
81 HB2 CYS 13 HB2 CYS 13 -3.855 0.072 4.326
82 HB3 CYS 13 HB1 CYS 13 -4.125 -1.518 3.619
83 H ILE 14 H ILE 14 -4.569 -1.013 0.894
84 HA ILE 14 HA ILE 14 -5.425 1.744 0.306
85 HB ILE 14 HB ILE 14 -6.497 0.565 -1.752
86 HG12 ILE 14 HG12 ILE 14 -4.294 -1.389 -1.049
87 HG13 ILE 14 HG11 ILE 14 -6.020 -1.730 -0.970
88 HG21 ILE 14 HG21 ILE 14 -3.747 0.517 -2.445
89 HG22 ILE 14 HG22 ILE 14 -4.937 1.782 -2.751
90 HG23 ILE 14 HG23 ILE 14 -3.991 1.803 -1.263
91 HD11 ILE 14 HD11 ILE 14 -6.077 -1.171 -3.448
92 HD12 ILE 14 HD12 ILE 14 -4.316 -1.271 -3.390
93 HD13 ILE 14 HD13 ILE 14 -5.295 -2.679 -2.975
94 HA PRO 15 HA PRO 15 -9.450 0.990 1.887
95 HB2 PRO 15 HB2 PRO 15 -11.010 2.350 0.130
96 HB3 PRO 15 HB1 PRO 15 -9.968 3.152 1.311
97 HG2 PRO 15 HG2 PRO 15 -9.486 2.632 -1.598
98 HG3 PRO 15 HG1 PRO 15 -9.159 4.098 -0.654
99 HD2 PRO 15 HD2 PRO 15 -7.224 2.313 -1.290
100 HD3 PRO 15 HD1 PRO 15 -7.200 3.252 0.216
101 H ASP 16 H ASP 16 -8.895 0.268 -1.506
102 HA ASP 16 HA ASP 16 -11.296 -1.302 -1.781
103 HB2 ASP 16 HB2 ASP 16 -10.329 -0.095 -3.703
104 HB3 ASP 16 HB1 ASP 16 -8.886 -1.100 -3.600
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -8.671 -2.486 0.147
2 HA2 GLY 1 HA2 GLY 1 -7.980 -4.804 -1.162
3 HA3 GLY 1 HA1 GLY 1 -7.023 -3.549 -1.934
4 HA PRO 2 HA PRO 2 -5.072 -5.167 2.093
5 HB2 PRO 2 HB2 PRO 2 -3.093 -6.664 0.991
6 HB3 PRO 2 HB1 PRO 2 -4.681 -7.323 1.400
7 HG2 PRO 2 HG2 PRO 2 -3.632 -6.420 -1.254
8 HG3 PRO 2 HG1 PRO 2 -4.592 -7.859 -0.860
9 HD2 PRO 2 HD2 PRO 2 -5.686 -5.627 -1.934
10 HD3 PRO 2 HD1 PRO 2 -6.572 -6.680 -0.812
11 H CYS 3 H CYS 3 -2.366 -5.323 2.163
12 HA CYS 3 HA CYS 3 -1.563 -2.645 1.266
13 HB2 CYS 3 HB2 CYS 3 -0.002 -4.260 3.248
14 HB3 CYS 3 HB1 CYS 3 -0.139 -2.511 3.100
15 H PHE 4 H PHE 4 0.459 -2.300 0.289
16 HA PHE 4 HA PHE 4 1.942 -4.664 -0.588
17 HB2 PHE 4 HB2 PHE 4 0.575 -2.672 -2.365
18 HB3 PHE 4 HB1 PHE 4 2.055 -3.460 -2.906
19 HD1 PHE 4 HD2 PHE 4 2.112 -5.910 -3.202
20 HD2 PHE 4 HD1 PHE 4 -1.491 -3.832 -2.296
21 HE1 PHE 4 HE2 PHE 4 0.806 -7.863 -3.930
22 HE2 PHE 4 HE1 PHE 4 -2.802 -5.782 -3.022
23 HZ PHE 4 HZ PHE 4 -1.655 -7.801 -3.842
24 HA PRO 5 HA PRO 5 5.387 -2.107 0.422
25 HB2 PRO 5 HB2 PRO 5 7.317 -3.504 -0.877
26 HB3 PRO 5 HB1 PRO 5 6.577 -4.062 0.628
27 HG2 PRO 5 HG2 PRO 5 5.980 -4.874 -2.191
28 HG3 PRO 5 HG1 PRO 5 6.131 -5.886 -0.744
29 HD2 PRO 5 HD2 PRO 5 3.733 -5.153 -1.765
30 HD3 PRO 5 HD1 PRO 5 3.996 -5.399 -0.027
31 H MET 6 H MET 6 4.446 -0.366 -0.958
32 HA MET 6 HA MET 6 6.298 0.262 -3.103
33 HB2 MET 6 HB2 MET 6 3.414 -0.320 -3.523
34 HB3 MET 6 HB1 MET 6 4.089 1.050 -4.395
35 HG2 MET 6 HG2 MET 6 5.281 -1.708 -4.467
36 HG3 MET 6 HG1 MET 6 4.087 -1.128 -5.627
37 HE1 MET 6 HE1 MET 6 6.184 -0.031 -8.319
38 HE2 MET 6 HE2 MET 6 6.297 -1.679 -7.702
39 HE3 MET 6 HE3 MET 6 4.751 -0.830 -7.670
40 H GLY 7 H GLY 7 5.547 2.545 -4.048
41 HA2 GLY 7 HA2 GLY 7 4.975 4.756 -3.637
42 HA3 GLY 7 HA1 GLY 7 4.294 4.261 -2.094
43 HA PRO 8 HA PRO 8 8.259 6.612 -1.372
44 HB2 PRO 8 HB2 PRO 8 7.189 8.390 0.379
45 HB3 PRO 8 HB1 PRO 8 7.196 8.650 -1.370
46 HG2 PRO 8 HG2 PRO 8 4.991 7.644 0.388
47 HG3 PRO 8 HG1 PRO 8 4.915 8.812 -0.944
48 HD2 PRO 8 HD2 PRO 8 4.182 6.222 -1.234
49 HD3 PRO 8 HD1 PRO 8 4.902 7.164 -2.556
50 H TRP 9 H TRP 9 5.715 5.453 0.780
51 HA TRP 9 HA TRP 9 7.597 5.172 2.986
52 HB2 TRP 9 HB2 TRP 9 4.624 4.912 2.699
53 HB3 TRP 9 HB1 TRP 9 5.433 4.168 4.075
54 HD1 TRP 9 HD TRP 9 4.386 7.539 2.686
55 HE1 TRP 9 HE1 TRP 9 4.799 9.349 4.468
56 HE3 TRP 9 HE3 TRP 9 7.015 4.756 6.075
57 HZ2 TRP 9 HZ2 TRP 9 6.072 9.568 6.979
58 HZ3 TRP 9 HZ3 TRP 9 7.794 5.842 8.140
59 HH2 TRP 9 HH TRP 9 7.332 8.199 8.581
60 H GLY 10 H GLY 10 5.579 3.134 0.898
61 HA2 GLY 10 HA2 GLY 10 6.621 1.054 0.099
62 HA3 GLY 10 HA1 GLY 10 7.240 0.836 1.729
63 HA PRO 11 HA PRO 11 3.780 -1.732 2.573
64 HB2 PRO 11 HB2 PRO 11 3.724 -1.536 5.280
65 HB3 PRO 11 HB1 PRO 11 4.953 -2.462 4.409
66 HG2 PRO 11 HG2 PRO 11 5.122 0.295 5.560
67 HG3 PRO 11 HG1 PRO 11 6.315 -1.014 5.615
68 HD2 PRO 11 HD2 PRO 11 6.497 1.048 3.870
69 HD3 PRO 11 HD1 PRO 11 7.071 -0.586 3.480
70 H PHE 12 H PHE 12 2.317 -0.154 1.527
71 HA PHE 12 HA PHE 12 0.712 1.327 3.505
72 HB2 PHE 12 HB2 PHE 12 0.209 2.960 1.895
73 HB3 PHE 12 HB1 PHE 12 1.914 2.618 1.626
74 HD1 PHE 12 HD2 PHE 12 -1.477 2.235 0.308
75 HD2 PHE 12 HD1 PHE 12 2.661 1.506 -0.373
76 HE1 PHE 12 HE2 PHE 12 -1.958 1.731 -2.052
77 HE2 PHE 12 HE1 PHE 12 2.186 1.001 -2.734
78 HZ PHE 12 HZ PHE 12 -0.126 1.111 -3.576
79 H CYS 13 H CYS 13 -1.518 1.142 3.455
80 HA CYS 13 HA CYS 13 -2.529 -1.143 1.904
81 HB2 CYS 13 HB2 CYS 13 -3.858 0.065 4.324
82 HB3 CYS 13 HB1 CYS 13 -4.125 -1.524 3.615
83 H ILE 14 H ILE 14 -4.573 -1.013 0.898
84 HA ILE 14 HA ILE 14 -5.426 1.745 0.311
85 HB ILE 14 HB ILE 14 -6.496 0.565 -1.748
86 HG12 ILE 14 HG12 ILE 14 -4.286 -1.379 -1.049
87 HG13 ILE 14 HG11 ILE 14 -6.009 -1.728 -0.971
88 HG21 ILE 14 HG21 ILE 14 -4.058 1.876 -1.275
89 HG22 ILE 14 HG22 ILE 14 -3.700 0.536 -2.365
90 HG23 ILE 14 HG23 ILE 14 -4.926 1.725 -2.804
91 HD11 ILE 14 HD11 ILE 14 -5.925 -0.999 -3.495
92 HD12 ILE 14 HD12 ILE 14 -4.231 -1.461 -3.328
93 HD13 ILE 14 HD13 ILE 14 -5.503 -2.636 -2.991
94 HA PRO 15 HA PRO 15 -9.451 0.989 1.887
95 HB2 PRO 15 HB2 PRO 15 -11.011 2.350 0.130
96 HB3 PRO 15 HB1 PRO 15 -9.970 3.152 1.313
97 HG2 PRO 15 HG2 PRO 15 -9.484 2.635 -1.596
98 HG3 PRO 15 HG1 PRO 15 -9.159 4.099 -0.650
99 HD2 PRO 15 HD2 PRO 15 -7.223 2.316 -1.286
100 HD3 PRO 15 HD1 PRO 15 -7.199 3.252 0.221
101 H ASP 16 H ASP 16 -8.894 0.272 -1.508
102 HA ASP 16 HA ASP 16 -11.295 -1.298 -1.787
103 HB2 ASP 16 HB2 ASP 16 -10.228 -0.050 -3.682
104 HB3 ASP 16 HB1 ASP 16 -8.894 -1.199 -3.623
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -8.665 -2.478 0.145
2 HA2 GLY 1 HA2 GLY 1 -7.983 -4.808 -1.154
3 HA3 GLY 1 HA1 GLY 1 -7.026 -3.557 -1.931
4 HA PRO 2 HA PRO 2 -5.072 -5.163 2.098
5 HB2 PRO 2 HB2 PRO 2 -3.094 -6.663 0.999
6 HB3 PRO 2 HB1 PRO 2 -4.681 -7.321 1.411
7 HG2 PRO 2 HG2 PRO 2 -3.635 -6.424 -1.246
8 HG3 PRO 2 HG1 PRO 2 -4.593 -7.862 -0.849
9 HD2 PRO 2 HD2 PRO 2 -5.690 -5.633 -1.926
10 HD3 PRO 2 HD1 PRO 2 -6.573 -6.683 -0.800
11 H CYS 3 H CYS 3 -2.365 -5.319 2.168
12 HA CYS 3 HA CYS 3 -1.564 -2.642 1.264
13 HB2 CYS 3 HB2 CYS 3 0.003 -4.255 3.247
14 HB3 CYS 3 HB1 CYS 3 -0.138 -2.506 3.098
15 H PHE 4 H PHE 4 0.460 -2.299 0.289
16 HA PHE 4 HA PHE 4 1.941 -4.664 -0.589
17 HB2 PHE 4 HB2 PHE 4 0.573 -2.672 -2.366
18 HB3 PHE 4 HB1 PHE 4 2.052 -3.460 -2.908
19 HD1 PHE 4 HD2 PHE 4 2.109 -5.907 -3.209
20 HD2 PHE 4 HD1 PHE 4 -1.494 -3.834 -2.289
21 HE1 PHE 4 HE2 PHE 4 0.801 -7.861 -3.937
22 HE2 PHE 4 HE1 PHE 4 -2.806 -5.784 -3.015
23 HZ PHE 4 HZ PHE 4 -1.659 -7.802 -3.839
24 HA PRO 5 HA PRO 5 5.388 -2.110 0.417
25 HB2 PRO 5 HB2 PRO 5 7.316 -3.508 -0.886
26 HB3 PRO 5 HB1 PRO 5 6.576 -4.065 0.621
27 HG2 PRO 5 HG2 PRO 5 5.977 -4.877 -2.198
28 HG3 PRO 5 HG1 PRO 5 6.129 -5.890 -0.751
29 HD2 PRO 5 HD2 PRO 5 3.729 -5.154 -1.769
30 HD3 PRO 5 HD1 PRO 5 3.994 -5.400 -0.031
31 H MET 6 H MET 6 4.457 -0.363 -0.955
32 HA MET 6 HA MET 6 6.304 0.264 -3.103
33 HB2 MET 6 HB2 MET 6 3.421 -0.319 -3.524
34 HB3 MET 6 HB1 MET 6 4.096 1.050 -4.396
35 HG2 MET 6 HG2 MET 6 5.259 -1.720 -4.471
36 HG3 MET 6 HG1 MET 6 4.103 -1.102 -5.648
37 HE1 MET 6 HE1 MET 6 8.439 -0.993 -6.143
38 HE2 MET 6 HE2 MET 6 7.798 -1.254 -4.520
39 HE3 MET 6 HE3 MET 6 7.242 -2.259 -5.860
40 H GLY 7 H GLY 7 5.556 2.546 -4.047
41 HA2 GLY 7 HA2 GLY 7 4.982 4.757 -3.636
42 HA3 GLY 7 HA1 GLY 7 4.300 4.262 -2.094
43 HA PRO 8 HA PRO 8 8.263 6.615 -1.368
44 HB2 PRO 8 HB2 PRO 8 7.191 8.392 0.383
45 HB3 PRO 8 HB1 PRO 8 7.200 8.651 -1.366
46 HG2 PRO 8 HG2 PRO 8 4.993 7.645 0.389
47 HG3 PRO 8 HG1 PRO 8 4.919 8.813 -0.943
48 HD2 PRO 8 HD2 PRO 8 4.185 6.223 -1.234
49 HD3 PRO 8 HD1 PRO 8 4.907 7.166 -2.555
50 H TRP 9 H TRP 9 5.718 5.451 0.780
51 HA TRP 9 HA TRP 9 7.596 5.171 2.989
52 HB2 TRP 9 HB2 TRP 9 4.621 4.769 2.730
53 HB3 TRP 9 HB1 TRP 9 5.507 4.258 4.164
54 HD1 TRP 9 HD TRP 9 7.453 6.814 4.358
55 HE1 TRP 9 HE1 TRP 9 6.471 9.056 5.155
56 HE3 TRP 9 HE3 TRP 9 2.517 5.939 3.355
57 HZ2 TRP 9 HZ2 TRP 9 3.938 10.290 5.334
58 HZ3 TRP 9 HZ3 TRP 9 0.879 7.702 3.869
59 HH2 TRP 9 HH TRP 9 1.577 9.831 4.839
60 H GLY 10 H GLY 10 5.580 3.134 0.898
61 HA2 GLY 10 HA2 GLY 10 6.620 1.053 0.100
62 HA3 GLY 10 HA1 GLY 10 7.238 0.834 1.731
63 HA PRO 11 HA PRO 11 3.775 -1.732 2.570
64 HB2 PRO 11 HB2 PRO 11 3.717 -1.536 5.278
65 HB3 PRO 11 HB1 PRO 11 4.945 -2.463 4.408
66 HG2 PRO 11 HG2 PRO 11 5.116 0.295 5.560
67 HG3 PRO 11 HG1 PRO 11 6.309 -1.016 5.615
68 HD2 PRO 11 HD2 PRO 11 6.494 1.047 3.871
69 HD3 PRO 11 HD1 PRO 11 7.067 -0.588 3.481
70 H PHE 12 H PHE 12 2.315 -0.152 1.524
71 HA PHE 12 HA PHE 12 0.710 1.332 3.500
72 HB2 PHE 12 HB2 PHE 12 0.206 2.961 1.887
73 HB3 PHE 12 HB1 PHE 12 1.912 2.619 1.620
74 HD1 PHE 12 HD2 PHE 12 -1.478 2.231 0.299
75 HD2 PHE 12 HD1 PHE 12 2.661 1.507 -0.378
76 HE1 PHE 12 HE2 PHE 12 -1.957 1.723 -2.060
77 HE2 PHE 12 HE1 PHE 12 2.190 0.998 -2.739
78 HZ PHE 12 HZ PHE 12 -0.122 1.105 -3.582
79 H CYS 13 H CYS 13 -1.519 1.141 3.456
80 HA CYS 13 HA CYS 13 -2.532 -1.144 1.906
81 HB2 CYS 13 HB2 CYS 13 -3.859 0.067 4.326
82 HB3 CYS 13 HB1 CYS 13 -4.127 -1.522 3.618
83 H ILE 14 H ILE 14 -4.573 -1.013 0.896
84 HA ILE 14 HA ILE 14 -5.426 1.743 0.309
85 HB ILE 14 HB ILE 14 -6.497 0.564 -1.750
86 HG12 ILE 14 HG12 ILE 14 -4.291 -1.385 -1.048
87 HG13 ILE 14 HG11 ILE 14 -6.016 -1.730 -0.970
88 HG21 ILE 14 HG21 ILE 14 -4.918 1.698 -2.823
89 HG22 ILE 14 HG22 ILE 14 -4.076 1.890 -1.286
90 HG23 ILE 14 HG23 ILE 14 -3.686 0.532 -2.341
91 HD11 ILE 14 HD11 ILE 14 -4.965 -2.644 -2.980
92 HD12 ILE 14 HD12 ILE 14 -6.203 -1.448 -3.366
93 HD13 ILE 14 HD13 ILE 14 -4.496 -1.015 -3.467
94 HA PRO 15 HA PRO 15 -9.451 0.989 1.886
95 HB2 PRO 15 HB2 PRO 15 -11.010 2.350 0.128
96 HB3 PRO 15 HB1 PRO 15 -9.969 3.153 1.310
97 HG2 PRO 15 HG2 PRO 15 -9.485 2.634 -1.598
98 HG3 PRO 15 HG1 PRO 15 -9.158 4.098 -0.653
99 HD2 PRO 15 HD2 PRO 15 -7.223 2.314 -1.289
100 HD3 PRO 15 HD1 PRO 15 -7.199 3.252 0.219
101 H ASP 16 H ASP 16 -8.894 0.270 -1.507
102 HA ASP 16 HA ASP 16 -11.294 -1.301 -1.783
103 HB2 ASP 16 HB2 ASP 16 -8.933 -0.725 -3.551
104 HB3 ASP 16 HB1 ASP 16 -10.083 -1.991 -3.975
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -8.580 -2.371 0.095
2 HA2 GLY 1 HA2 GLY 1 -7.984 -4.807 -1.157
3 HA3 GLY 1 HA1 GLY 1 -7.027 -3.554 -1.933
4 HA PRO 2 HA PRO 2 -5.074 -5.166 2.095
5 HB2 PRO 2 HB2 PRO 2 -3.096 -6.665 0.993
6 HB3 PRO 2 HB1 PRO 2 -4.684 -7.322 1.405
7 HG2 PRO 2 HG2 PRO 2 -3.636 -6.423 -1.251
8 HG3 PRO 2 HG1 PRO 2 -4.595 -7.861 -0.855
9 HD2 PRO 2 HD2 PRO 2 -5.691 -5.630 -1.930
10 HD3 PRO 2 HD1 PRO 2 -6.575 -6.683 -0.806
11 H CYS 3 H CYS 3 -2.367 -5.322 2.164
12 HA CYS 3 HA CYS 3 -1.565 -2.644 1.264
13 HB2 CYS 3 HB2 CYS 3 -0.001 -4.260 3.245
14 HB3 CYS 3 HB1 CYS 3 -0.138 -2.511 3.096
15 H PHE 4 H PHE 4 0.461 -2.300 0.291
16 HA PHE 4 HA PHE 4 1.940 -4.665 -0.590
17 HB2 PHE 4 HB2 PHE 4 0.573 -2.670 -2.365
18 HB3 PHE 4 HB1 PHE 4 2.052 -3.458 -2.907
19 HD1 PHE 4 HD2 PHE 4 2.108 -5.907 -3.207
20 HD2 PHE 4 HD1 PHE 4 -1.493 -3.831 -2.293
21 HE1 PHE 4 HE2 PHE 4 0.801 -7.860 -3.936
22 HE2 PHE 4 HE1 PHE 4 -2.806 -5.781 -3.021
23 HZ PHE 4 HZ PHE 4 -1.659 -7.798 -3.845
24 HA PRO 5 HA PRO 5 5.387 -2.111 0.419
25 HB2 PRO 5 HB2 PRO 5 7.316 -3.510 -0.882
26 HB3 PRO 5 HB1 PRO 5 6.575 -4.066 0.623
27 HG2 PRO 5 HG2 PRO 5 5.977 -4.878 -2.196
28 HG3 PRO 5 HG1 PRO 5 6.127 -5.890 -0.748
29 HD2 PRO 5 HD2 PRO 5 3.730 -5.154 -1.768
30 HD3 PRO 5 HD1 PRO 5 3.993 -5.400 -0.029
31 H MET 6 H MET 6 4.456 -0.363 -0.954
32 HA MET 6 HA MET 6 6.306 0.264 -3.099
33 HB2 MET 6 HB2 MET 6 3.423 -0.322 -3.524
34 HB3 MET 6 HB1 MET 6 4.098 1.049 -4.395
35 HG2 MET 6 HG2 MET 6 5.791 -0.391 -5.381
36 HG3 MET 6 HG1 MET 6 5.152 -1.768 -4.485
37 HE1 MET 6 HE1 MET 6 3.564 -3.089 -4.912
38 HE2 MET 6 HE2 MET 6 1.978 -2.480 -5.384
39 HE3 MET 6 HE3 MET 6 2.949 -3.397 -6.537
40 H GLY 7 H GLY 7 5.555 2.546 -4.045
41 HA2 GLY 7 HA2 GLY 7 4.977 4.756 -3.634
42 HA3 GLY 7 HA1 GLY 7 4.298 4.260 -2.091
43 HA PRO 8 HA PRO 8 8.258 6.618 -1.371
44 HB2 PRO 8 HB2 PRO 8 7.186 8.394 0.381
45 HB3 PRO 8 HB1 PRO 8 7.191 8.654 -1.367
46 HG2 PRO 8 HG2 PRO 8 4.989 7.644 0.391
47 HG3 PRO 8 HG1 PRO 8 4.911 8.812 -0.941
48 HD2 PRO 8 HD2 PRO 8 4.181 6.221 -1.231
49 HD3 PRO 8 HD1 PRO 8 4.900 7.164 -2.553
50 H TRP 9 H TRP 9 5.719 5.450 0.780
51 HA TRP 9 HA TRP 9 7.602 5.171 2.986
52 HB2 TRP 9 HB2 TRP 9 5.180 5.977 3.235
53 HB3 TRP 9 HB1 TRP 9 4.719 4.294 2.987
54 HD1 TRP 9 HD TRP 9 7.645 5.604 5.162
55 HE1 TRP 9 HE1 TRP 9 7.284 4.763 7.567
56 HE3 TRP 9 HE3 TRP 9 3.101 3.340 4.557
57 HZ2 TRP 9 HZ2 TRP 9 5.331 3.330 9.017
58 HZ3 TRP 9 HZ3 TRP 9 2.055 2.257 6.504
59 HH2 TRP 9 HH TRP 9 3.149 2.252 8.686
60 H GLY 10 H GLY 10 5.580 3.134 0.900
61 HA2 GLY 10 HA2 GLY 10 6.620 1.053 0.099
62 HA3 GLY 10 HA1 GLY 10 7.241 0.834 1.728
63 HA PRO 11 HA PRO 11 3.779 -1.730 2.576
64 HB2 PRO 11 HB2 PRO 11 3.722 -1.530 5.283
65 HB3 PRO 11 HB1 PRO 11 4.950 -2.458 4.415
66 HG2 PRO 11 HG2 PRO 11 5.121 0.303 5.561
67 HG3 PRO 11 HG1 PRO 11 6.313 -1.007 5.619
68 HD2 PRO 11 HD2 PRO 11 6.496 1.052 3.871
69 HD3 PRO 11 HD1 PRO 11 7.070 -0.582 3.483
70 H PHE 12 H PHE 12 2.316 -0.155 1.527
71 HA PHE 12 HA PHE 12 0.711 1.331 3.502
72 HB2 PHE 12 HB2 PHE 12 0.208 2.960 1.887
73 HB3 PHE 12 HB1 PHE 12 1.914 2.617 1.620
74 HD1 PHE 12 HD2 PHE 12 -1.476 2.231 0.301
75 HD2 PHE 12 HD1 PHE 12 2.661 1.500 -0.376
76 HE1 PHE 12 HE2 PHE 12 -1.957 1.720 -2.057
77 HE2 PHE 12 HE1 PHE 12 2.188 0.990 -2.737
78 HZ PHE 12 HZ PHE 12 -0.124 1.100 -3.580
79 H CYS 13 H CYS 13 -1.519 1.146 3.450
80 HA CYS 13 HA CYS 13 -2.530 -1.142 1.902
81 HB2 CYS 13 HB2 CYS 13 -3.857 0.067 4.324
82 HB3 CYS 13 HB1 CYS 13 -4.125 -1.522 3.615
83 H ILE 14 H ILE 14 -4.572 -1.014 0.894
84 HA ILE 14 HA ILE 14 -5.426 1.744 0.308
85 HB ILE 14 HB ILE 14 -6.497 0.565 -1.750
86 HG12 ILE 14 HG12 ILE 14 -4.293 -1.385 -1.049
87 HG13 ILE 14 HG11 ILE 14 -6.017 -1.729 -0.972
88 HG21 ILE 14 HG21 ILE 14 -4.932 1.747 -2.784
89 HG22 ILE 14 HG22 ILE 14 -4.032 1.846 -1.271
90 HG23 ILE 14 HG23 ILE 14 -3.720 0.526 -2.399
91 HD11 ILE 14 HD11 ILE 14 -6.039 -1.121 -3.462
92 HD12 ILE 14 HD12 ILE 14 -4.289 -1.317 -3.374
93 HD13 ILE 14 HD13 ILE 14 -5.348 -2.671 -2.979
94 HA PRO 15 HA PRO 15 -9.450 0.988 1.887
95 HB2 PRO 15 HB2 PRO 15 -11.011 2.350 0.131
96 HB3 PRO 15 HB1 PRO 15 -9.970 3.151 1.312
97 HG2 PRO 15 HG2 PRO 15 -9.486 2.634 -1.596
98 HG3 PRO 15 HG1 PRO 15 -9.159 4.098 -0.652
99 HD2 PRO 15 HD2 PRO 15 -7.224 2.315 -1.289
100 HD3 PRO 15 HD1 PRO 15 -7.200 3.252 0.219
101 H ASP 16 H ASP 16 -8.897 0.271 -1.508
102 HA ASP 16 HA ASP 16 -11.297 -1.299 -1.784
103 HB2 ASP 16 HB2 ASP 16 -8.968 -0.634 -3.540
104 HB3 ASP 16 HB1 ASP 16 -9.987 -2.009 -3.959
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -8.596 -2.393 0.106
2 HA2 GLY 1 HA2 GLY 1 -7.982 -4.809 -1.155
3 HA3 GLY 1 HA1 GLY 1 -7.025 -3.556 -1.932
4 HA PRO 2 HA PRO 2 -5.072 -5.164 2.097
5 HB2 PRO 2 HB2 PRO 2 -3.094 -6.663 0.998
6 HB3 PRO 2 HB1 PRO 2 -4.682 -7.321 1.409
7 HG2 PRO 2 HG2 PRO 2 -3.634 -6.424 -1.248
8 HG3 PRO 2 HG1 PRO 2 -4.593 -7.862 -0.851
9 HD2 PRO 2 HD2 PRO 2 -5.689 -5.632 -1.927
10 HD3 PRO 2 HD1 PRO 2 -6.573 -6.683 -0.803
11 H CYS 3 H CYS 3 -2.366 -5.319 2.167
12 HA CYS 3 HA CYS 3 -1.564 -2.643 1.264
13 HB2 CYS 3 HB2 CYS 3 0.002 -4.255 3.246
14 HB3 CYS 3 HB1 CYS 3 -0.139 -2.507 3.097
15 H PHE 4 H PHE 4 0.460 -2.298 0.288
16 HA PHE 4 HA PHE 4 1.940 -4.663 -0.590
17 HB2 PHE 4 HB2 PHE 4 0.574 -2.671 -2.367
18 HB3 PHE 4 HB1 PHE 4 2.052 -3.459 -2.908
19 HD1 PHE 4 HD2 PHE 4 2.107 -5.908 -3.206
20 HD2 PHE 4 HD1 PHE 4 -1.494 -3.831 -2.294
21 HE1 PHE 4 HE2 PHE 4 0.801 -7.861 -3.935
22 HE2 PHE 4 HE1 PHE 4 -2.806 -5.781 -3.020
23 HZ PHE 4 HZ PHE 4 -1.660 -7.800 -3.841
24 HA PRO 5 HA PRO 5 5.387 -2.109 0.418
25 HB2 PRO 5 HB2 PRO 5 7.315 -3.509 -0.882
26 HB3 PRO 5 HB1 PRO 5 6.575 -4.064 0.623
27 HG2 PRO 5 HG2 PRO 5 5.977 -4.878 -2.195
28 HG3 PRO 5 HG1 PRO 5 6.128 -5.890 -0.747
29 HD2 PRO 5 HD2 PRO 5 3.730 -5.155 -1.767
30 HD3 PRO 5 HD1 PRO 5 3.993 -5.400 -0.029
31 H MET 6 H MET 6 4.458 -0.362 -0.955
32 HA MET 6 HA MET 6 6.306 0.263 -3.102
33 HB2 MET 6 HB2 MET 6 3.423 -0.320 -3.525
34 HB3 MET 6 HB1 MET 6 4.098 1.050 -4.397
35 HG2 MET 6 HG2 MET 6 5.257 -1.724 -4.471
36 HG3 MET 6 HG1 MET 6 4.107 -1.099 -5.650
37 HE1 MET 6 HE1 MET 6 7.951 -0.816 -4.389
38 HE2 MET 6 HE2 MET 6 7.303 -2.161 -5.327
39 HE3 MET 6 HE3 MET 6 8.438 -1.035 -6.071
40 H GLY 7 H GLY 7 5.557 2.545 -4.048
41 HA2 GLY 7 HA2 GLY 7 4.985 4.757 -3.638
42 HA3 GLY 7 HA1 GLY 7 4.300 4.262 -2.097
43 HA PRO 8 HA PRO 8 8.264 6.613 -1.367
44 HB2 PRO 8 HB2 PRO 8 7.190 8.390 0.383
45 HB3 PRO 8 HB1 PRO 8 7.201 8.650 -1.366
46 HG2 PRO 8 HG2 PRO 8 4.992 7.644 0.387
47 HG3 PRO 8 HG1 PRO 8 4.919 8.813 -0.945
48 HD2 PRO 8 HD2 PRO 8 4.185 6.223 -1.238
49 HD3 PRO 8 HD1 PRO 8 4.909 7.165 -2.557
50 H TRP 9 H TRP 9 5.715 5.455 0.781
51 HA TRP 9 HA TRP 9 7.591 5.174 2.992
52 HB2 TRP 9 HB2 TRP 9 4.651 4.469 2.856
53 HB3 TRP 9 HB1 TRP 9 5.645 4.515 4.310
54 HD1 TRP 9 HD TRP 9 6.906 7.177 4.515
55 HE1 TRP 9 HE1 TRP 9 5.618 9.404 4.462
56 HE3 TRP 9 HE3 TRP 9 2.639 5.593 2.186
57 HZ2 TRP 9 HZ2 TRP 9 3.124 10.363 3.554
58 HZ3 TRP 9 HZ3 TRP 9 0.850 7.228 1.764
59 HH2 TRP 9 HH TRP 9 1.089 9.564 2.434
60 H GLY 10 H GLY 10 5.578 3.134 0.898
61 HA2 GLY 10 HA2 GLY 10 6.622 1.054 0.102
62 HA3 GLY 10 HA1 GLY 10 7.239 0.837 1.733
63 HA PRO 11 HA PRO 11 3.777 -1.734 2.569
64 HB2 PRO 11 HB2 PRO 11 3.718 -1.540 5.276
65 HB3 PRO 11 HB1 PRO 11 4.947 -2.465 4.405
66 HG2 PRO 11 HG2 PRO 11 5.116 0.291 5.560
67 HG3 PRO 11 HG1 PRO 11 6.309 -1.020 5.614
68 HD2 PRO 11 HD2 PRO 11 6.493 1.045 3.873
69 HD3 PRO 11 HD1 PRO 11 7.068 -0.588 3.481
70 H PHE 12 H PHE 12 2.317 -0.149 1.523
71 HA PHE 12 HA PHE 12 0.712 1.331 3.499
72 HB2 PHE 12 HB2 PHE 12 0.206 2.960 1.886
73 HB3 PHE 12 HB1 PHE 12 1.913 2.620 1.619
74 HD1 PHE 12 HD2 PHE 12 -1.477 2.227 0.298
75 HD2 PHE 12 HD1 PHE 12 2.663 1.510 -0.378
76 HE1 PHE 12 HE2 PHE 12 -1.954 1.718 -2.061
77 HE2 PHE 12 HE1 PHE 12 2.193 1.000 -2.739
78 HZ PHE 12 HZ PHE 12 -0.119 1.102 -3.582
79 H CYS 13 H CYS 13 -1.517 1.145 3.453
80 HA CYS 13 HA CYS 13 -2.531 -1.142 1.904
81 HB2 CYS 13 HB2 CYS 13 -3.856 0.069 4.325
82 HB3 CYS 13 HB1 CYS 13 -4.125 -1.521 3.618
83 H ILE 14 H ILE 14 -4.572 -1.013 0.895
84 HA ILE 14 HA ILE 14 -5.425 1.744 0.308
85 HB ILE 14 HB ILE 14 -6.497 0.565 -1.750
86 HG12 ILE 14 HG12 ILE 14 -4.292 -1.386 -1.048
87 HG13 ILE 14 HG11 ILE 14 -6.017 -1.729 -0.971
88 HG21 ILE 14 HG21 ILE 14 -3.651 0.540 -2.275
89 HG22 ILE 14 HG22 ILE 14 -4.898 1.637 -2.867
90 HG23 ILE 14 HG23 ILE 14 -4.128 1.937 -1.310
91 HD11 ILE 14 HD11 ILE 14 -5.274 -2.676 -2.976
92 HD12 ILE 14 HD12 ILE 14 -6.076 -1.177 -3.446
93 HD13 ILE 14 HD13 ILE 14 -4.315 -1.255 -3.392
94 HA PRO 15 HA PRO 15 -9.450 0.989 1.887
95 HB2 PRO 15 HB2 PRO 15 -11.010 2.349 0.130
96 HB3 PRO 15 HB1 PRO 15 -9.969 3.152 1.312
97 HG2 PRO 15 HG2 PRO 15 -9.485 2.634 -1.597
98 HG3 PRO 15 HG1 PRO 15 -9.158 4.099 -0.651
99 HD2 PRO 15 HD2 PRO 15 -7.223 2.315 -1.289
100 HD3 PRO 15 HD1 PRO 15 -7.200 3.253 0.219
101 H ASP 16 H ASP 16 -8.894 0.270 -1.507
102 HA ASP 16 HA ASP 16 -11.296 -1.298 -1.785
103 HB2 ASP 16 HB2 ASP 16 -8.892 -0.882 -3.565
104 HB3 ASP 16 HB1 ASP 16 -10.228 -1.947 -3.994
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -8.591 -2.381 0.102
2 HA2 GLY 1 HA2 GLY 1 -7.986 -4.804 -1.159
3 HA3 GLY 1 HA1 GLY 1 -7.028 -3.551 -1.934
4 HA PRO 2 HA PRO 2 -5.076 -5.167 2.092
5 HB2 PRO 2 HB2 PRO 2 -3.098 -6.666 0.990
6 HB3 PRO 2 HB1 PRO 2 -4.687 -7.324 1.400
7 HG2 PRO 2 HG2 PRO 2 -3.639 -6.422 -1.256
8 HG3 PRO 2 HG1 PRO 2 -4.598 -7.860 -0.861
9 HD2 PRO 2 HD2 PRO 2 -5.694 -5.629 -1.934
10 HD3 PRO 2 HD1 PRO 2 -6.578 -6.681 -0.810
11 H CYS 3 H CYS 3 -2.370 -5.325 2.160
12 HA CYS 3 HA CYS 3 -1.567 -2.647 1.263
13 HB2 CYS 3 HB2 CYS 3 -0.004 -4.265 3.244
14 HB3 CYS 3 HB1 CYS 3 -0.137 -2.516 3.095
15 H PHE 4 H PHE 4 0.468 -2.302 0.301
16 HA PHE 4 HA PHE 4 1.946 -4.666 -0.585
17 HB2 PHE 4 HB2 PHE 4 0.577 -2.675 -2.362
18 HB3 PHE 4 HB1 PHE 4 2.056 -3.462 -2.903
19 HD1 PHE 4 HD2 PHE 4 2.112 -5.908 -3.209
20 HD2 PHE 4 HD1 PHE 4 -1.489 -3.838 -2.280
21 HE1 PHE 4 HE2 PHE 4 0.805 -7.861 -3.938
22 HE2 PHE 4 HE1 PHE 4 -2.801 -5.788 -3.006
23 HZ PHE 4 HZ PHE 4 -1.654 -7.804 -3.836
24 HA PRO 5 HA PRO 5 5.390 -2.109 0.422
25 HB2 PRO 5 HB2 PRO 5 7.320 -3.505 -0.880
26 HB3 PRO 5 HB1 PRO 5 6.580 -4.063 0.626
27 HG2 PRO 5 HG2 PRO 5 5.981 -4.875 -2.193
28 HG3 PRO 5 HG1 PRO 5 6.134 -5.888 -0.746
29 HD2 PRO 5 HD2 PRO 5 3.735 -5.155 -1.764
30 HD3 PRO 5 HD1 PRO 5 3.999 -5.401 -0.027
31 H MET 6 H MET 6 4.450 -0.366 -0.954
32 HA MET 6 HA MET 6 6.300 0.263 -3.100
33 HB2 MET 6 HB2 MET 6 3.417 -0.322 -3.522
34 HB3 MET 6 HB1 MET 6 4.090 1.049 -4.394
35 HG2 MET 6 HG2 MET 6 5.795 -0.405 -5.363
36 HG3 MET 6 HG1 MET 6 5.119 -1.777 -4.490
37 HE1 MET 6 HE1 MET 6 5.619 -0.925 -7.768
38 HE2 MET 6 HE2 MET 6 4.105 -0.592 -8.609
39 HE3 MET 6 HE3 MET 6 4.802 0.620 -7.534
40 H GLY 7 H GLY 7 5.546 2.546 -4.045
41 HA2 GLY 7 HA2 GLY 7 4.968 4.756 -3.633
42 HA3 GLY 7 HA1 GLY 7 4.292 4.260 -2.089
43 HA PRO 8 HA PRO 8 8.252 6.620 -1.376
44 HB2 PRO 8 HB2 PRO 8 7.182 8.395 0.378
45 HB3 PRO 8 HB1 PRO 8 7.184 8.654 -1.370
46 HG2 PRO 8 HG2 PRO 8 4.986 7.643 0.393
47 HG3 PRO 8 HG1 PRO 8 4.905 8.811 -0.939
48 HD2 PRO 8 HD2 PRO 8 4.176 6.219 -1.229
49 HD3 PRO 8 HD1 PRO 8 4.891 7.163 -2.551
50 H TRP 9 H TRP 9 5.717 5.449 0.780
51 HA TRP 9 HA TRP 9 7.606 5.171 2.982
52 HB2 TRP 9 HB2 TRP 9 5.316 6.010 3.420
53 HB3 TRP 9 HB1 TRP 9 4.665 4.473 2.859
54 HD1 TRP 9 HD TRP 9 4.862 2.382 4.492
55 HE1 TRP 9 HE1 TRP 9 5.378 2.188 7.006
56 HE3 TRP 9 HE3 TRP 9 6.721 7.075 5.304
57 HZ2 TRP 9 HZ2 TRP 9 6.434 3.809 9.060
58 HZ3 TRP 9 HZ3 TRP 9 7.462 7.673 7.572
59 HH2 TRP 9 HH TRP 9 7.320 6.072 9.411
60 H GLY 10 H GLY 10 5.580 3.133 0.899
61 HA2 GLY 10 HA2 GLY 10 6.622 1.054 0.097
62 HA3 GLY 10 HA1 GLY 10 7.244 0.835 1.725
63 HA PRO 11 HA PRO 11 3.785 -1.731 2.580
64 HB2 PRO 11 HB2 PRO 11 3.732 -1.528 5.287
65 HB3 PRO 11 HB1 PRO 11 4.960 -2.455 4.418
66 HG2 PRO 11 HG2 PRO 11 5.129 0.306 5.562
67 HG3 PRO 11 HG1 PRO 11 6.323 -1.005 5.619
68 HD2 PRO 11 HD2 PRO 11 6.501 1.055 3.870
69 HD3 PRO 11 HD1 PRO 11 7.077 -0.580 3.483
70 H PHE 12 H PHE 12 2.320 -0.159 1.532
71 HA PHE 12 HA PHE 12 0.715 1.325 3.508
72 HB2 PHE 12 HB2 PHE 12 0.212 2.957 1.899
73 HB3 PHE 12 HB1 PHE 12 1.917 2.614 1.627
74 HD1 PHE 12 HD2 PHE 12 -1.476 2.235 0.312
75 HD2 PHE 12 HD1 PHE 12 2.661 1.499 -0.371
76 HE1 PHE 12 HE2 PHE 12 -1.959 1.728 -2.047
77 HE2 PHE 12 HE1 PHE 12 2.185 0.993 -2.732
78 HZ PHE 12 HZ PHE 12 -0.128 1.106 -3.572
79 H CYS 13 H CYS 13 -1.519 1.148 3.448
80 HA CYS 13 HA CYS 13 -2.527 -1.142 1.900
81 HB2 CYS 13 HB2 CYS 13 -3.857 0.065 4.320
82 HB3 CYS 13 HB1 CYS 13 -4.124 -1.524 3.611
83 H ILE 14 H ILE 14 -4.576 -1.014 0.899
84 HA ILE 14 HA ILE 14 -5.426 1.745 0.309
85 HB ILE 14 HB ILE 14 -6.498 0.566 -1.750
86 HG12 ILE 14 HG12 ILE 14 -4.289 -1.382 -1.048
87 HG13 ILE 14 HG11 ILE 14 -6.014 -1.728 -0.973
88 HG21 ILE 14 HG21 ILE 14 -4.012 1.828 -1.264
89 HG22 ILE 14 HG22 ILE 14 -3.734 0.529 -2.423
90 HG23 ILE 14 HG23 ILE 14 -4.937 1.772 -2.764
91 HD11 ILE 14 HD11 ILE 14 -6.044 -2.272 -3.114
92 HD12 ILE 14 HD12 ILE 14 -5.318 -0.730 -3.569
93 HD13 ILE 14 HD13 ILE 14 -4.289 -2.096 -3.134
94 HA PRO 15 HA PRO 15 -9.451 0.988 1.886
95 HB2 PRO 15 HB2 PRO 15 -11.011 2.350 0.129
96 HB3 PRO 15 HB1 PRO 15 -9.970 3.152 1.312
97 HG2 PRO 15 HG2 PRO 15 -9.484 2.635 -1.597
98 HG3 PRO 15 HG1 PRO 15 -9.159 4.099 -0.651
99 HD2 PRO 15 HD2 PRO 15 -7.224 2.316 -1.288
100 HD3 PRO 15 HD1 PRO 15 -7.200 3.253 0.219
101 H ASP 16 H ASP 16 -8.898 0.274 -1.510
102 HA ASP 16 HA ASP 16 -11.297 -1.296 -1.787
103 HB2 ASP 16 HB2 ASP 16 -9.901 0.002 -3.612
104 HB3 ASP 16 HB1 ASP 16 -9.008 -1.514 -3.697
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -8.564 -2.351 0.083
2 HA2 GLY 1 HA2 GLY 1 -7.981 -4.804 -1.161
3 HA3 GLY 1 HA1 GLY 1 -7.024 -3.549 -1.934
4 HA PRO 2 HA PRO 2 -5.073 -5.167 2.092
5 HB2 PRO 2 HB2 PRO 2 -3.095 -6.664 0.991
6 HB3 PRO 2 HB1 PRO 2 -4.683 -7.323 1.400
7 HG2 PRO 2 HG2 PRO 2 -3.634 -6.420 -1.254
8 HG3 PRO 2 HG1 PRO 2 -4.593 -7.859 -0.861
9 HD2 PRO 2 HD2 PRO 2 -5.688 -5.626 -1.933
10 HD3 PRO 2 HD1 PRO 2 -6.573 -6.680 -0.811
11 H CYS 3 H CYS 3 -2.366 -5.324 2.163
12 HA CYS 3 HA CYS 3 -1.563 -2.644 1.265
13 HB2 CYS 3 HB2 CYS 3 -0.002 -4.261 3.248
14 HB3 CYS 3 HB1 CYS 3 -0.139 -2.512 3.099
15 H PHE 4 H PHE 4 0.461 -2.300 0.292
16 HA PHE 4 HA PHE 4 1.943 -4.665 -0.587
17 HB2 PHE 4 HB2 PHE 4 0.576 -2.674 -2.364
18 HB3 PHE 4 HB1 PHE 4 2.055 -3.461 -2.905
19 HD1 PHE 4 HD2 PHE 4 2.113 -5.909 -3.207
20 HD2 PHE 4 HD1 PHE 4 -1.490 -3.836 -2.286
21 HE1 PHE 4 HE2 PHE 4 0.807 -7.862 -3.936
22 HE2 PHE 4 HE1 PHE 4 -2.802 -5.787 -3.013
23 HZ PHE 4 HZ PHE 4 -1.654 -7.802 -3.840
24 HA PRO 5 HA PRO 5 5.388 -2.108 0.422
25 HB2 PRO 5 HB2 PRO 5 7.318 -3.505 -0.879
26 HB3 PRO 5 HB1 PRO 5 6.577 -4.062 0.626
27 HG2 PRO 5 HG2 PRO 5 5.980 -4.874 -2.193
28 HG3 PRO 5 HG1 PRO 5 6.132 -5.887 -0.745
29 HD2 PRO 5 HD2 PRO 5 3.733 -5.153 -1.765
30 HD3 PRO 5 HD1 PRO 5 3.996 -5.399 -0.027
31 H MET 6 H MET 6 4.447 -0.366 -0.957
32 HA MET 6 HA MET 6 6.298 0.262 -3.102
33 HB2 MET 6 HB2 MET 6 3.415 -0.321 -3.522
34 HB3 MET 6 HB1 MET 6 4.088 1.050 -4.394
35 HG2 MET 6 HG2 MET 6 5.278 -1.709 -4.467
36 HG3 MET 6 HG1 MET 6 4.088 -1.127 -5.628
37 HE1 MET 6 HE1 MET 6 5.475 -0.551 -8.152
38 HE2 MET 6 HE2 MET 6 7.100 -1.166 -7.856
39 HE3 MET 6 HE3 MET 6 5.702 -2.027 -7.214
40 H GLY 7 H GLY 7 5.547 2.545 -4.046
41 HA2 GLY 7 HA2 GLY 7 4.972 4.756 -3.635
42 HA3 GLY 7 HA1 GLY 7 4.293 4.261 -2.092
43 HA PRO 8 HA PRO 8 8.257 6.615 -1.374
44 HB2 PRO 8 HB2 PRO 8 7.188 8.391 0.378
45 HB3 PRO 8 HB1 PRO 8 7.193 8.650 -1.370
46 HG2 PRO 8 HG2 PRO 8 4.990 7.643 0.390
47 HG3 PRO 8 HG1 PRO 8 4.912 8.812 -0.942
48 HD2 PRO 8 HD2 PRO 8 4.180 6.221 -1.232
49 HD3 PRO 8 HD1 PRO 8 4.899 7.164 -2.554
50 H TRP 9 H TRP 9 5.717 5.451 0.779
51 HA TRP 9 HA TRP 9 7.600 5.171 2.985
52 HB2 TRP 9 HB2 TRP 9 4.624 4.792 2.726
53 HB3 TRP 9 HB1 TRP 9 5.502 4.242 4.150
54 HD1 TRP 9 HD TRP 9 6.437 7.534 2.439
55 HE1 TRP 9 HE1 TRP 9 5.888 9.476 4.037
56 HE3 TRP 9 HE3 TRP 9 3.983 4.918 6.083
57 HZ2 TRP 9 HZ2 TRP 9 4.589 9.848 6.515
58 HZ3 TRP 9 HZ3 TRP 9 3.118 6.141 8.034
59 HH2 TRP 9 HH TRP 9 3.417 8.556 8.244
60 H GLY 10 H GLY 10 5.580 3.134 0.898
61 HA2 GLY 10 HA2 GLY 10 6.621 1.053 0.099
62 HA3 GLY 10 HA1 GLY 10 7.241 0.834 1.728
63 HA PRO 11 HA PRO 11 3.781 -1.732 2.576
64 HB2 PRO 11 HB2 PRO 11 3.725 -1.533 5.282
65 HB3 PRO 11 HB1 PRO 11 4.953 -2.460 4.412
66 HG2 PRO 11 HG2 PRO 11 5.124 0.299 5.560
67 HG3 PRO 11 HG1 PRO 11 6.317 -1.011 5.617
68 HD2 PRO 11 HD2 PRO 11 6.498 1.051 3.871
69 HD3 PRO 11 HD1 PRO 11 7.072 -0.584 3.481
70 H PHE 12 H PHE 12 2.317 -0.156 1.529
71 HA PHE 12 HA PHE 12 0.711 1.328 3.506
72 HB2 PHE 12 HB2 PHE 12 0.209 2.959 1.896
73 HB3 PHE 12 HB1 PHE 12 1.915 2.617 1.625
74 HD1 PHE 12 HD2 PHE 12 -1.478 2.236 0.309
75 HD2 PHE 12 HD1 PHE 12 2.659 1.502 -0.374
76 HE1 PHE 12 HE2 PHE 12 -1.960 1.731 -2.051
77 HE2 PHE 12 HE1 PHE 12 2.184 0.996 -2.734
78 HZ PHE 12 HZ PHE 12 -0.128 1.111 -3.576
79 H CYS 13 H CYS 13 -1.519 1.143 3.454
80 HA CYS 13 HA CYS 13 -2.529 -1.143 1.903
81 HB2 CYS 13 HB2 CYS 13 -3.859 0.065 4.323
82 HB3 CYS 13 HB1 CYS 13 -4.126 -1.524 3.614
83 H ILE 14 H ILE 14 -4.574 -1.013 0.898
84 HA ILE 14 HA ILE 14 -5.426 1.745 0.311
85 HB ILE 14 HB ILE 14 -6.498 0.565 -1.748
86 HG12 ILE 14 HG12 ILE 14 -4.285 -1.379 -1.050
87 HG13 ILE 14 HG11 ILE 14 -6.009 -1.728 -0.970
88 HG21 ILE 14 HG21 ILE 14 -4.922 1.706 -2.820
89 HG22 ILE 14 HG22 ILE 14 -4.078 1.895 -1.284
90 HG23 ILE 14 HG23 ILE 14 -3.688 0.540 -2.345
91 HD11 ILE 14 HD11 ILE 14 -4.253 -1.389 -3.350
92 HD12 ILE 14 HD12 ILE 14 -5.429 -2.651 -2.986
93 HD13 ILE 14 HD13 ILE 14 -5.979 -1.050 -3.480
94 HA PRO 15 HA PRO 15 -9.451 0.989 1.886
95 HB2 PRO 15 HB2 PRO 15 -11.010 2.350 0.129
96 HB3 PRO 15 HB1 PRO 15 -9.970 3.152 1.312
97 HG2 PRO 15 HG2 PRO 15 -9.484 2.635 -1.597
98 HG3 PRO 15 HG1 PRO 15 -9.159 4.099 -0.651
99 HD2 PRO 15 HD2 PRO 15 -7.224 2.316 -1.287
100 HD3 PRO 15 HD1 PRO 15 -7.200 3.253 0.221
101 H ASP 16 H ASP 16 -8.896 0.273 -1.508
102 HA ASP 16 HA ASP 16 -11.295 -1.299 -1.785
103 HB2 ASP 16 HB2 ASP 16 -10.040 -0.005 -3.637
104 HB3 ASP 16 HB1 ASP 16 -8.951 -1.388 -3.667
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -8.602 -2.401 0.111
2 HA2 GLY 1 HA2 GLY 1 -7.983 -4.809 -1.153
3 HA3 GLY 1 HA1 GLY 1 -7.026 -3.558 -1.931
4 HA PRO 2 HA PRO 2 -5.072 -5.163 2.099
5 HB2 PRO 2 HB2 PRO 2 -3.094 -6.663 0.999
6 HB3 PRO 2 HB1 PRO 2 -4.682 -7.321 1.411
7 HG2 PRO 2 HG2 PRO 2 -3.635 -6.425 -1.246
8 HG3 PRO 2 HG1 PRO 2 -4.593 -7.863 -0.848
9 HD2 PRO 2 HD2 PRO 2 -5.689 -5.633 -1.926
10 HD3 PRO 2 HD1 PRO 2 -6.573 -6.684 -0.801
11 H CYS 3 H CYS 3 -2.366 -5.319 2.168
12 HA CYS 3 HA CYS 3 -1.564 -2.643 1.265
13 HB2 CYS 3 HB2 CYS 3 0.002 -4.255 3.246
14 HB3 CYS 3 HB1 CYS 3 -0.139 -2.506 3.098
15 H PHE 4 H PHE 4 0.460 -2.298 0.289
16 HA PHE 4 HA PHE 4 1.940 -4.664 -0.590
17 HB2 PHE 4 HB2 PHE 4 0.573 -2.672 -2.366
18 HB3 PHE 4 HB1 PHE 4 2.051 -3.460 -2.908
19 HD1 PHE 4 HD2 PHE 4 2.106 -5.910 -3.204
20 HD2 PHE 4 HD1 PHE 4 -1.495 -3.831 -2.295
21 HE1 PHE 4 HE2 PHE 4 0.800 -7.863 -3.932
22 HE2 PHE 4 HE1 PHE 4 -2.807 -5.781 -3.020
23 HZ PHE 4 HZ PHE 4 -1.661 -7.801 -3.839
24 HA PRO 5 HA PRO 5 5.388 -2.110 0.416
25 HB2 PRO 5 HB2 PRO 5 7.316 -3.509 -0.886
26 HB3 PRO 5 HB1 PRO 5 6.576 -4.065 0.620
27 HG2 PRO 5 HG2 PRO 5 5.976 -4.877 -2.198
28 HG3 PRO 5 HG1 PRO 5 6.128 -5.890 -0.750
29 HD2 PRO 5 HD2 PRO 5 3.729 -5.155 -1.769
30 HD3 PRO 5 HD1 PRO 5 3.993 -5.400 -0.031
31 H MET 6 H MET 6 4.459 -0.361 -0.954
32 HA MET 6 HA MET 6 6.306 0.264 -3.102
33 HB2 MET 6 HB2 MET 6 3.423 -0.319 -3.524
34 HB3 MET 6 HB1 MET 6 4.098 1.051 -4.397
35 HG2 MET 6 HG2 MET 6 5.806 -0.405 -5.362
36 HG3 MET 6 HG1 MET 6 5.122 -1.778 -4.492
37 HE1 MET 6 HE1 MET 6 3.827 -3.199 -5.164
38 HE2 MET 6 HE2 MET 6 2.210 -2.850 -5.774
39 HE3 MET 6 HE3 MET 6 3.465 -3.421 -6.876
40 H GLY 7 H GLY 7 5.559 2.547 -4.047
41 HA2 GLY 7 HA2 GLY 7 4.985 4.758 -3.637
42 HA3 GLY 7 HA1 GLY 7 4.302 4.263 -2.095
43 HA PRO 8 HA PRO 8 8.265 6.615 -1.367
44 HB2 PRO 8 HB2 PRO 8 7.191 8.392 0.382
45 HB3 PRO 8 HB1 PRO 8 7.201 8.652 -1.366
46 HG2 PRO 8 HG2 PRO 8 4.993 7.646 0.388
47 HG3 PRO 8 HG1 PRO 8 4.920 8.814 -0.944
48 HD2 PRO 8 HD2 PRO 8 4.186 6.224 -1.236
49 HD3 PRO 8 HD1 PRO 8 4.909 7.166 -2.555
50 H TRP 9 H TRP 9 5.719 5.450 0.779
51 HA TRP 9 HA TRP 9 7.596 5.171 2.989
52 HB2 TRP 9 HB2 TRP 9 4.623 4.889 2.702
53 HB3 TRP 9 HB1 TRP 9 5.443 4.181 4.090
54 HD1 TRP 9 HD TRP 9 6.549 7.551 2.640
55 HE1 TRP 9 HE1 TRP 9 6.090 9.384 4.388
56 HE3 TRP 9 HE3 TRP 9 3.977 4.772 6.075
57 HZ2 TRP 9 HZ2 TRP 9 4.809 9.621 6.892
58 HZ3 TRP 9 HZ3 TRP 9 3.170 5.877 8.120
59 HH2 TRP 9 HH TRP 9 3.578 8.251 8.519
60 H GLY 10 H GLY 10 5.579 3.134 0.897
61 HA2 GLY 10 HA2 GLY 10 6.620 1.053 0.100
62 HA3 GLY 10 HA1 GLY 10 7.238 0.835 1.731
63 HA PRO 11 HA PRO 11 3.775 -1.732 2.571
64 HB2 PRO 11 HB2 PRO 11 3.717 -1.535 5.278
65 HB3 PRO 11 HB1 PRO 11 4.945 -2.462 4.408
66 HG2 PRO 11 HG2 PRO 11 5.116 0.295 5.559
67 HG3 PRO 11 HG1 PRO 11 6.307 -1.016 5.615
68 HD2 PRO 11 HD2 PRO 11 6.493 1.047 3.872
69 HD3 PRO 11 HD1 PRO 11 7.066 -0.587 3.481
70 H PHE 12 H PHE 12 2.313 -0.153 1.524
71 HA PHE 12 HA PHE 12 0.709 1.331 3.500
72 HB2 PHE 12 HB2 PHE 12 0.205 2.960 1.886
73 HB3 PHE 12 HB1 PHE 12 1.912 2.620 1.620
74 HD1 PHE 12 HD2 PHE 12 -1.479 2.228 0.298
75 HD2 PHE 12 HD1 PHE 12 2.662 1.508 -0.377
76 HE1 PHE 12 HE2 PHE 12 -1.956 1.719 -2.061
77 HE2 PHE 12 HE1 PHE 12 2.191 0.997 -2.738
78 HZ PHE 12 HZ PHE 12 -0.120 1.104 -3.583
79 H CYS 13 H CYS 13 -1.519 1.142 3.456
80 HA CYS 13 HA CYS 13 -2.532 -1.143 1.905
81 HB2 CYS 13 HB2 CYS 13 -3.859 0.068 4.327
82 HB3 CYS 13 HB1 CYS 13 -4.127 -1.522 3.618
83 H ILE 14 H ILE 14 -4.572 -1.013 0.896
84 HA ILE 14 HA ILE 14 -5.427 1.744 0.309
85 HB ILE 14 HB ILE 14 -6.497 0.566 -1.750
86 HG12 ILE 14 HG12 ILE 14 -4.292 -1.386 -1.048
87 HG13 ILE 14 HG11 ILE 14 -6.018 -1.729 -0.971
88 HG21 ILE 14 HG21 ILE 14 -3.678 0.532 -2.325
89 HG22 ILE 14 HG22 ILE 14 -4.912 1.683 -2.834
90 HG23 ILE 14 HG23 ILE 14 -4.087 1.900 -1.291
91 HD11 ILE 14 HD11 ILE 14 -4.929 -2.633 -2.984
92 HD12 ILE 14 HD12 ILE 14 -6.215 -1.484 -3.354
93 HD13 ILE 14 HD13 ILE 14 -4.528 -0.988 -3.476
94 HA PRO 15 HA PRO 15 -9.451 0.989 1.886
95 HB2 PRO 15 HB2 PRO 15 -11.011 2.349 0.129
96 HB3 PRO 15 HB1 PRO 15 -9.970 3.152 1.311
97 HG2 PRO 15 HG2 PRO 15 -9.485 2.634 -1.597
98 HG3 PRO 15 HG1 PRO 15 -9.159 4.098 -0.652
99 HD2 PRO 15 HD2 PRO 15 -7.224 2.314 -1.289
100 HD3 PRO 15 HD1 PRO 15 -7.200 3.252 0.219
101 H ASP 16 H ASP 16 -8.895 0.270 -1.507
102 HA ASP 16 HA ASP 16 -11.296 -1.301 -1.783
103 HB2 ASP 16 HB2 ASP 16 -8.886 -0.997 -3.587
104 HB3 ASP 16 HB1 ASP 16 -10.342 -1.893 -4.007
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -8.548 -2.321 0.064
2 HA2 GLY 1 HA2 GLY 1 -7.994 -4.803 -1.161
3 HA3 GLY 1 HA1 GLY 1 -7.035 -3.551 -1.936
4 HA PRO 2 HA PRO 2 -5.079 -5.174 2.085
5 HB2 PRO 2 HB2 PRO 2 -3.101 -6.667 0.977
6 HB3 PRO 2 HB1 PRO 2 -4.688 -7.327 1.387
7 HG2 PRO 2 HG2 PRO 2 -3.642 -6.417 -1.267
8 HG3 PRO 2 HG1 PRO 2 -4.601 -7.857 -0.876
9 HD2 PRO 2 HD2 PRO 2 -5.698 -5.623 -1.941
10 HD3 PRO 2 HD1 PRO 2 -6.581 -6.680 -0.821
11 H CYS 3 H CYS 3 -2.371 -5.330 2.148
12 HA CYS 3 HA CYS 3 -1.571 -2.649 1.255
13 HB2 CYS 3 HB2 CYS 3 -0.008 -4.262 3.239
14 HB3 CYS 3 HB1 CYS 3 -0.151 -2.513 3.092
15 H PHE 4 H PHE 4 0.474 -2.306 0.307
16 HA PHE 4 HA PHE 4 1.955 -4.668 -0.573
17 HB2 PHE 4 HB2 PHE 4 0.585 -2.687 -2.359
18 HB3 PHE 4 HB1 PHE 4 2.068 -3.470 -2.895
19 HD1 PHE 4 HD2 PHE 4 2.134 -5.905 -3.224
20 HD2 PHE 4 HD1 PHE 4 -1.475 -3.871 -2.249
21 HE1 PHE 4 HE2 PHE 4 0.837 -7.865 -3.950
22 HE2 PHE 4 HE1 PHE 4 -2.778 -5.828 -2.972
23 HZ PHE 4 HZ PHE 4 -1.622 -7.829 -3.826
24 HA PRO 5 HA PRO 5 5.392 -2.100 0.431
25 HB2 PRO 5 HB2 PRO 5 7.327 -3.492 -0.868
26 HB3 PRO 5 HB1 PRO 5 6.588 -4.052 0.636
27 HG2 PRO 5 HG2 PRO 5 5.994 -4.866 -2.182
28 HG3 PRO 5 HG1 PRO 5 6.148 -5.878 -0.734
29 HD2 PRO 5 HD2 PRO 5 3.747 -5.152 -1.755
30 HD3 PRO 5 HD1 PRO 5 4.011 -5.396 -0.016
31 H MET 6 H MET 6 4.431 -0.371 -0.959
32 HA MET 6 HA MET 6 6.283 0.261 -3.106
33 HB2 MET 6 HB2 MET 6 3.397 -0.320 -3.513
34 HB3 MET 6 HB1 MET 6 4.069 1.050 -4.388
35 HG2 MET 6 HG2 MET 6 5.314 -1.680 -4.462
36 HG3 MET 6 HG1 MET 6 4.050 -1.178 -5.582
37 HE1 MET 6 HE1 MET 6 7.000 -2.218 -5.590
38 HE2 MET 6 HE2 MET 6 7.107 -1.784 -7.297
39 HE3 MET 6 HE3 MET 6 8.242 -1.091 -6.137
40 H GLY 7 H GLY 7 5.524 2.544 -4.049
41 HA2 GLY 7 HA2 GLY 7 4.955 4.756 -3.635
42 HA3 GLY 7 HA1 GLY 7 4.280 4.261 -2.090
43 HA PRO 8 HA PRO 8 8.248 6.612 -1.385
44 HB2 PRO 8 HB2 PRO 8 7.186 8.391 0.370
45 HB3 PRO 8 HB1 PRO 8 7.186 8.649 -1.378
46 HG2 PRO 8 HG2 PRO 8 4.987 7.646 0.388
47 HG3 PRO 8 HG1 PRO 8 4.907 8.813 -0.945
48 HD2 PRO 8 HD2 PRO 8 4.171 6.223 -1.231
49 HD3 PRO 8 HD1 PRO 8 4.887 7.164 -2.555
50 H TRP 9 H TRP 9 5.713 5.457 0.779
51 HA TRP 9 HA TRP 9 7.600 5.177 2.980
52 HB2 TRP 9 HB2 TRP 9 5.084 5.923 3.109
53 HB3 TRP 9 HB1 TRP 9 4.776 4.189 3.095
54 HD1 TRP 9 HD TRP 9 7.559 6.101 5.005
55 HE1 TRP 9 HE1 TRP 9 7.339 5.527 7.505
56 HE3 TRP 9 HE3 TRP 9 3.348 3.208 4.806
57 HZ2 TRP 9 HZ2 TRP 9 5.609 4.045 9.172
58 HZ3 TRP 9 HZ3 TRP 9 2.475 2.250 6.898
59 HH2 TRP 9 HH TRP 9 3.585 2.660 9.035
60 H GLY 10 H GLY 10 5.580 3.134 0.897
61 HA2 GLY 10 HA2 GLY 10 6.624 1.055 0.096
62 HA3 GLY 10 HA1 GLY 10 7.249 0.839 1.726
63 HA PRO 11 HA PRO 11 3.796 -1.735 2.580
64 HB2 PRO 11 HB2 PRO 11 3.749 -1.539 5.288
65 HB3 PRO 11 HB1 PRO 11 4.976 -2.463 4.412
66 HG2 PRO 11 HG2 PRO 11 5.145 0.296 5.563
67 HG3 PRO 11 HG1 PRO 11 6.341 -1.013 5.613
68 HD2 PRO 11 HD2 PRO 11 6.512 1.050 3.868
69 HD3 PRO 11 HD1 PRO 11 7.088 -0.582 3.476
70 H PHE 12 H PHE 12 2.325 -0.162 1.540
71 HA PHE 12 HA PHE 12 0.722 1.313 3.525
72 HB2 PHE 12 HB2 PHE 12 0.217 2.952 1.924
73 HB3 PHE 12 HB1 PHE 12 1.922 2.611 1.646
74 HD1 PHE 12 HD2 PHE 12 -1.474 2.240 0.338
75 HD2 PHE 12 HD1 PHE 12 2.660 1.503 -0.359
76 HE1 PHE 12 HE2 PHE 12 -1.963 1.746 -2.023
77 HE2 PHE 12 HE1 PHE 12 2.178 1.008 -2.720
78 HZ PHE 12 HZ PHE 12 -0.137 1.128 -3.555
79 H CYS 13 H CYS 13 -1.517 1.151 3.447
80 HA CYS 13 HA CYS 13 -2.523 -1.140 1.897
81 HB2 CYS 13 HB2 CYS 13 -3.857 0.059 4.320
82 HB3 CYS 13 HB1 CYS 13 -4.119 -1.528 3.606
83 H ILE 14 H ILE 14 -4.576 -1.007 0.901
84 HA ILE 14 HA ILE 14 -5.426 1.754 0.323
85 HB ILE 14 HB ILE 14 -6.497 0.571 -1.742
86 HG12 ILE 14 HG12 ILE 14 -4.171 -1.294 -1.303
87 HG13 ILE 14 HG11 ILE 14 -5.799 -1.708 -0.777
88 HG21 ILE 14 HG21 ILE 14 -3.920 1.752 -1.234
89 HG22 ILE 14 HG22 ILE 14 -3.827 0.589 -2.556
90 HG23 ILE 14 HG23 ILE 14 -4.976 1.923 -2.635
91 HD11 ILE 14 HD11 ILE 14 -5.415 -2.716 -2.896
92 HD12 ILE 14 HD12 ILE 14 -6.556 -1.390 -3.127
93 HD13 ILE 14 HD13 ILE 14 -4.866 -1.189 -3.585
94 HA PRO 15 HA PRO 15 -9.454 0.982 1.884
95 HB2 PRO 15 HB2 PRO 15 -11.013 2.345 0.128
96 HB3 PRO 15 HB1 PRO 15 -9.977 3.145 1.316
97 HG2 PRO 15 HG2 PRO 15 -9.483 2.640 -1.593
98 HG3 PRO 15 HG1 PRO 15 -9.164 4.102 -0.641
99 HD2 PRO 15 HD2 PRO 15 -7.222 2.326 -1.280
100 HD3 PRO 15 HD1 PRO 15 -7.205 3.258 0.231
101 H ASP 16 H ASP 16 -8.894 0.285 -1.515
102 HA ASP 16 HA ASP 16 -11.289 -1.284 -1.812
103 HB2 ASP 16 HB2 ASP 16 -8.888 -0.777 -3.557
104 HB3 ASP 16 HB1 ASP 16 -10.108 -1.968 -3.997
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -8.391 -2.232 -0.271
2 HA2 GLY 1 HA2 GLY 1 -8.100 -4.873 -1.076
3 HA3 GLY 1 HA1 GLY 1 -6.966 -3.937 -2.039
4 HA PRO 2 HA PRO 2 -5.118 -5.121 2.129
5 HB2 PRO 2 HB2 PRO 2 -3.105 -6.659 1.152
6 HB3 PRO 2 HB1 PRO 2 -4.699 -7.307 1.559
7 HG2 PRO 2 HG2 PRO 2 -3.594 -6.536 -1.114
8 HG3 PRO 2 HG1 PRO 2 -4.552 -7.958 -0.668
9 HD2 PRO 2 HD2 PRO 2 -5.637 -5.794 -1.881
10 HD3 PRO 2 HD1 PRO 2 -6.540 -6.794 -0.726
11 H CYS 3 H CYS 3 -2.396 -5.277 2.233
12 HA CYS 3 HA CYS 3 -1.607 -2.615 1.286
13 HB2 CYS 3 HB2 CYS 3 0.006 -4.205 3.244
14 HB3 CYS 3 HB1 CYS 3 -0.172 -2.459 3.104
15 H PHE 4 H PHE 4 0.419 -2.268 0.301
16 HA PHE 4 HA PHE 4 1.873 -4.638 -0.613
17 HB2 PHE 4 HB2 PHE 4 0.510 -2.611 -2.351
18 HB3 PHE 4 HB1 PHE 4 1.983 -3.392 -2.914
19 HD1 PHE 4 HD2 PHE 4 2.032 -5.842 -3.242
20 HD2 PHE 4 HD1 PHE 4 -1.559 -3.763 -2.296
21 HE1 PHE 4 HE2 PHE 4 0.717 -7.779 -3.996
22 HE2 PHE 4 HE1 PHE 4 -2.882 -5.697 -3.046
23 HZ PHE 4 HZ PHE 4 -1.744 -7.708 -3.899
24 HA PRO 5 HA PRO 5 5.341 -2.121 0.433
25 HB2 PRO 5 HB2 PRO 5 7.261 -3.559 -0.838
26 HB3 PRO 5 HB1 PRO 5 6.499 -4.092 0.665
27 HG2 PRO 5 HG2 PRO 5 5.914 -4.919 -2.152
28 HG3 PRO 5 HG1 PRO 5 6.037 -5.921 -0.694
29 HD2 PRO 5 HD2 PRO 5 3.660 -5.160 -1.743
30 HD3 PRO 5 HD1 PRO 5 3.903 -5.394 0.000
31 H MET 6 H MET 6 4.467 -0.363 -0.950
32 HA MET 6 HA MET 6 6.343 0.225 -3.078
33 HB2 MET 6 HB2 MET 6 3.467 -0.354 -3.554
34 HB3 MET 6 HB1 MET 6 4.165 1.005 -4.426
35 HG2 MET 6 HG2 MET 6 5.912 -0.490 -5.304
36 HG3 MET 6 HG1 MET 6 5.134 -1.842 -4.484
37 HE1 MET 6 HE1 MET 6 5.302 -0.472 -8.179
38 HE2 MET 6 HE2 MET 6 3.810 0.466 -8.149
39 HE3 MET 6 HE3 MET 6 5.100 0.827 -7.002
40 H GLY 7 H GLY 7 5.602 2.500 -4.068
41 HA2 GLY 7 HA2 GLY 7 5.026 4.715 -3.691
42 HA3 GLY 7 HA1 GLY 7 4.323 4.238 -2.152
43 HA PRO 8 HA PRO 8 8.274 6.598 -1.397
44 HB2 PRO 8 HB2 PRO 8 7.179 8.389 0.325
45 HB3 PRO 8 HB1 PRO 8 7.208 8.634 -1.425
46 HG2 PRO 8 HG2 PRO 8 4.982 7.640 0.311
47 HG3 PRO 8 HG1 PRO 8 4.923 8.797 -1.032
48 HD2 PRO 8 HD2 PRO 8 4.196 6.203 -1.309
49 HD3 PRO 8 HD1 PRO 8 4.933 7.134 -2.628
50 H TRP 9 H TRP 9 5.704 5.457 0.734
51 HA TRP 9 HA TRP 9 7.558 5.194 2.966
52 HB2 TRP 9 HB2 TRP 9 4.586 4.833 2.664
53 HB3 TRP 9 HB1 TRP 9 5.433 4.263 4.099
54 HD1 TRP 9 HD TRP 9 6.178 7.595 2.303
55 HE1 TRP 9 HE1 TRP 9 5.724 9.517 3.954
56 HE3 TRP 9 HE3 TRP 9 4.243 4.889 6.185
57 HZ2 TRP 9 HZ2 TRP 9 4.685 9.842 6.557
58 HZ3 TRP 9 HZ3 TRP 9 3.543 6.081 8.220
59 HH2 TRP 9 HH TRP 9 3.760 8.507 8.400
60 H GLY 10 H GLY 10 5.564 3.138 0.870
61 HA2 GLY 10 HA2 GLY 10 6.611 1.050 0.103
62 HA3 GLY 10 HA1 GLY 10 7.216 0.848 1.741
63 HA PRO 11 HA PRO 11 3.748 -1.718 2.567
64 HB2 PRO 11 HB2 PRO 11 3.683 -1.518 5.273
65 HB3 PRO 11 HB1 PRO 11 4.912 -2.449 4.408
66 HG2 PRO 11 HG2 PRO 11 5.084 0.310 5.556
67 HG3 PRO 11 HG1 PRO 11 6.274 -1.003 5.617
68 HD2 PRO 11 HD2 PRO 11 6.467 1.057 3.871
69 HD3 PRO 11 HD1 PRO 11 7.039 -0.578 3.484
70 H PHE 12 H PHE 12 2.305 -0.118 1.510
71 HA PHE 12 HA PHE 12 0.709 1.389 3.475
72 HB2 PHE 12 HB2 PHE 12 0.165 2.965 1.809
73 HB3 PHE 12 HB1 PHE 12 1.880 2.646 1.570
74 HD1 PHE 12 HD2 PHE 12 -1.493 2.122 0.235
75 HD2 PHE 12 HD1 PHE 12 2.676 1.535 -0.399
76 HE1 PHE 12 HE2 PHE 12 -1.935 1.541 -2.115
77 HE2 PHE 12 HE1 PHE 12 2.240 0.954 -2.750
78 HZ PHE 12 HZ PHE 12 -0.067 0.956 -3.611
79 H CYS 13 H CYS 13 -1.505 1.164 3.504
80 HA CYS 13 HA CYS 13 -2.549 -1.132 1.991
81 HB2 CYS 13 HB2 CYS 13 -3.804 0.088 4.446
82 HB3 CYS 13 HB1 CYS 13 -4.105 -1.499 3.747
83 H ILE 14 H ILE 14 -4.526 -1.002 0.929
84 HA ILE 14 HA ILE 14 -5.449 1.743 0.403
85 HB ILE 14 HB ILE 14 -6.513 0.606 -1.660
86 HG12 ILE 14 HG12 ILE 14 -4.371 -1.416 -0.965
87 HG13 ILE 14 HG11 ILE 14 -6.106 -1.708 -0.917
88 HG21 ILE 14 HG21 ILE 14 -3.728 0.492 -2.297
89 HG22 ILE 14 HG22 ILE 14 -4.911 1.737 -2.697
90 HG23 ILE 14 HG23 ILE 14 -4.021 1.822 -1.177
91 HD11 ILE 14 HD11 ILE 14 -5.346 -2.655 -2.922
92 HD12 ILE 14 HD12 ILE 14 -6.125 -1.140 -3.381
93 HD13 ILE 14 HD13 ILE 14 -4.366 -1.241 -3.312
94 HA PRO 15 HA PRO 15 -9.440 0.921 2.033
95 HB2 PRO 15 HB2 PRO 15 -11.035 2.303 0.324
96 HB3 PRO 15 HB1 PRO 15 -9.984 3.091 1.507
97 HG2 PRO 15 HG2 PRO 15 -9.535 2.634 -1.417
98 HG3 PRO 15 HG1 PRO 15 -9.209 4.083 -0.448
99 HD2 PRO 15 HD2 PRO 15 -7.268 2.328 -1.145
100 HD3 PRO 15 HD1 PRO 15 -7.231 3.236 0.380
101 H ASP 16 H ASP 16 -8.910 0.260 -1.374
102 HA ASP 16 HA ASP 16 -11.083 -1.730 -1.291
103 HB2 ASP 16 HB2 ASP 16 -9.940 -0.171 -3.613
104 HB3 ASP 16 HB1 ASP 16 -11.015 -1.553 -3.815
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -8.391 -2.233 -0.270
2 HA2 GLY 1 HA2 GLY 1 -8.099 -4.875 -1.074
3 HA3 GLY 1 HA1 GLY 1 -6.966 -3.939 -2.038
4 HA PRO 2 HA PRO 2 -5.116 -5.121 2.132
5 HB2 PRO 2 HB2 PRO 2 -3.104 -6.658 1.156
6 HB3 PRO 2 HB1 PRO 2 -4.697 -7.306 1.563
7 HG2 PRO 2 HG2 PRO 2 -3.593 -6.535 -1.111
8 HG3 PRO 2 HG1 PRO 2 -4.551 -7.959 -0.665
9 HD2 PRO 2 HD2 PRO 2 -5.637 -5.795 -1.877
10 HD3 PRO 2 HD1 PRO 2 -6.540 -6.794 -0.722
11 H CYS 3 H CYS 3 -2.395 -5.275 2.235
12 HA CYS 3 HA CYS 3 -1.607 -2.613 1.286
13 HB2 CYS 3 HB2 CYS 3 0.008 -4.200 3.244
14 HB3 CYS 3 HB1 CYS 3 -0.175 -2.454 3.104
15 H PHE 4 H PHE 4 0.417 -2.267 0.298
16 HA PHE 4 HA PHE 4 1.872 -4.636 -0.613
17 HB2 PHE 4 HB2 PHE 4 0.508 -2.611 -2.351
18 HB3 PHE 4 HB1 PHE 4 1.982 -3.391 -2.915
19 HD1 PHE 4 HD2 PHE 4 2.034 -5.834 -3.259
20 HD2 PHE 4 HD1 PHE 4 -1.560 -3.770 -2.282
21 HE1 PHE 4 HE2 PHE 4 0.719 -7.772 -4.013
22 HE2 PHE 4 HE1 PHE 4 -2.880 -5.706 -3.034
23 HZ PHE 4 HZ PHE 4 -1.740 -7.710 -3.902
24 HA PRO 5 HA PRO 5 5.341 -2.120 0.431
25 HB2 PRO 5 HB2 PRO 5 7.260 -3.558 -0.840
26 HB3 PRO 5 HB1 PRO 5 6.498 -4.092 0.663
27 HG2 PRO 5 HG2 PRO 5 5.913 -4.918 -2.154
28 HG3 PRO 5 HG1 PRO 5 6.036 -5.921 -0.697
29 HD2 PRO 5 HD2 PRO 5 3.658 -5.159 -1.745
30 HD3 PRO 5 HD1 PRO 5 3.902 -5.394 -0.002
31 H MET 6 H MET 6 4.466 -0.363 -0.952
32 HA MET 6 HA MET 6 6.342 0.225 -3.080
33 HB2 MET 6 HB2 MET 6 3.466 -0.352 -3.554
34 HB3 MET 6 HB1 MET 6 4.163 1.007 -4.427
35 HG2 MET 6 HG2 MET 6 5.899 -0.479 -5.321
36 HG3 MET 6 HG1 MET 6 5.151 -1.834 -4.481
37 HE1 MET 6 HE1 MET 6 3.265 0.504 -7.970
38 HE2 MET 6 HE2 MET 6 3.074 1.097 -6.321
39 HE3 MET 6 HE3 MET 6 4.682 0.986 -7.038
40 H GLY 7 H GLY 7 5.602 2.500 -4.068
41 HA2 GLY 7 HA2 GLY 7 5.027 4.717 -3.690
42 HA3 GLY 7 HA1 GLY 7 4.324 4.239 -2.152
43 HA PRO 8 HA PRO 8 8.278 6.596 -1.396
44 HB2 PRO 8 HB2 PRO 8 7.183 8.388 0.327
45 HB3 PRO 8 HB1 PRO 8 7.213 8.633 -1.424
46 HG2 PRO 8 HG2 PRO 8 4.985 7.640 0.313
47 HG3 PRO 8 HG1 PRO 8 4.928 8.797 -1.030
48 HD2 PRO 8 HD2 PRO 8 4.199 6.204 -1.309
49 HD3 PRO 8 HD1 PRO 8 4.936 7.136 -2.628
50 H TRP 9 H TRP 9 5.705 5.457 0.735
51 HA TRP 9 HA TRP 9 7.558 5.193 2.966
52 HB2 TRP 9 HB2 TRP 9 4.588 4.904 2.649
53 HB3 TRP 9 HB1 TRP 9 5.395 4.217 4.055
54 HD1 TRP 9 HD TRP 9 5.933 7.667 2.350
55 HE1 TRP 9 HE1 TRP 9 5.675 9.485 4.154
56 HE3 TRP 9 HE3 TRP 9 4.705 4.696 6.325
57 HZ2 TRP 9 HZ2 TRP 9 5.036 9.639 6.900
58 HZ3 TRP 9 HZ3 TRP 9 4.288 5.757 8.506
59 HH2 TRP 9 HH TRP 9 4.450 8.177 8.785
60 H GLY 10 H GLY 10 5.564 3.138 0.871
61 HA2 GLY 10 HA2 GLY 10 6.611 1.050 0.102
62 HA3 GLY 10 HA1 GLY 10 7.215 0.846 1.740
63 HA PRO 11 HA PRO 11 3.745 -1.718 2.564
64 HB2 PRO 11 HB2 PRO 11 3.680 -1.520 5.271
65 HB3 PRO 11 HB1 PRO 11 4.908 -2.451 4.405
66 HG2 PRO 11 HG2 PRO 11 5.083 0.308 5.555
67 HG3 PRO 11 HG1 PRO 11 6.272 -1.007 5.615
68 HD2 PRO 11 HD2 PRO 11 6.466 1.055 3.871
69 HD3 PRO 11 HD1 PRO 11 7.037 -0.581 3.483
70 H PHE 12 H PHE 12 2.302 -0.118 1.508
71 HA PHE 12 HA PHE 12 0.708 1.391 3.474
72 HB2 PHE 12 HB2 PHE 12 0.164 2.966 1.809
73 HB3 PHE 12 HB1 PHE 12 1.879 2.647 1.569
74 HD1 PHE 12 HD2 PHE 12 -1.494 2.124 0.233
75 HD2 PHE 12 HD1 PHE 12 2.675 1.538 -0.399
76 HE1 PHE 12 HE2 PHE 12 -1.935 1.544 -2.116
77 HE2 PHE 12 HE1 PHE 12 2.239 0.957 -2.750
78 HZ PHE 12 HZ PHE 12 -0.068 0.959 -3.611
79 H CYS 13 H CYS 13 -1.504 1.161 3.508
80 HA CYS 13 HA CYS 13 -2.550 -1.133 1.994
81 HB2 CYS 13 HB2 CYS 13 -3.804 0.089 4.449
82 HB3 CYS 13 HB1 CYS 13 -4.107 -1.499 3.751
83 H ILE 14 H ILE 14 -4.527 -1.002 0.931
84 HA ILE 14 HA ILE 14 -5.450 1.743 0.405
85 HB ILE 14 HB ILE 14 -6.511 0.605 -1.660
86 HG12 ILE 14 HG12 ILE 14 -4.369 -1.415 -0.964
87 HG13 ILE 14 HG11 ILE 14 -6.104 -1.708 -0.916
88 HG21 ILE 14 HG21 ILE 14 -4.054 1.857 -1.186
89 HG22 ILE 14 HG22 ILE 14 -3.703 0.498 -2.252
90 HG23 ILE 14 HG23 ILE 14 -4.901 1.702 -2.725
91 HD11 ILE 14 HD11 ILE 14 -4.353 -2.084 -3.065
92 HD12 ILE 14 HD12 ILE 14 -6.109 -2.243 -3.058
93 HD13 ILE 14 HD13 ILE 14 -5.364 -0.704 -3.490
94 HA PRO 15 HA PRO 15 -9.442 0.921 2.031
95 HB2 PRO 15 HB2 PRO 15 -11.035 2.301 0.321
96 HB3 PRO 15 HB1 PRO 15 -9.986 3.091 1.505
97 HG2 PRO 15 HG2 PRO 15 -9.534 2.632 -1.419
98 HG3 PRO 15 HG1 PRO 15 -9.209 4.081 -0.450
99 HD2 PRO 15 HD2 PRO 15 -7.267 2.327 -1.145
100 HD3 PRO 15 HD1 PRO 15 -7.231 3.235 0.379
101 H ASP 16 H ASP 16 -8.909 0.259 -1.376
102 HA ASP 16 HA ASP 16 -11.081 -1.732 -1.293
103 HB2 ASP 16 HB2 ASP 16 -9.947 -0.150 -3.600
104 HB3 ASP 16 HB1 ASP 16 -10.985 -1.555 -3.827
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -8.395 -2.239 -0.265
2 HA2 GLY 1 HA2 GLY 1 -8.093 -4.875 -1.081
3 HA3 GLY 1 HA1 GLY 1 -6.963 -3.931 -2.040
4 HA PRO 2 HA PRO 2 -5.116 -5.123 2.129
5 HB2 PRO 2 HB2 PRO 2 -3.102 -6.660 1.151
6 HB3 PRO 2 HB1 PRO 2 -4.696 -7.309 1.556
7 HG2 PRO 2 HG2 PRO 2 -3.590 -6.534 -1.116
8 HG3 PRO 2 HG1 PRO 2 -4.550 -7.958 -0.672
9 HD2 PRO 2 HD2 PRO 2 -5.633 -5.792 -1.882
10 HD3 PRO 2 HD1 PRO 2 -6.537 -6.794 -0.728
11 H CYS 3 H CYS 3 -2.394 -5.279 2.233
12 HA CYS 3 HA CYS 3 -1.605 -2.616 1.289
13 HB2 CYS 3 HB2 CYS 3 0.006 -4.209 3.246
14 HB3 CYS 3 HB1 CYS 3 -0.169 -2.463 3.106
15 H PHE 4 H PHE 4 0.412 -2.266 0.295
16 HA PHE 4 HA PHE 4 1.869 -4.634 -0.621
17 HB2 PHE 4 HB2 PHE 4 0.506 -2.601 -2.353
18 HB3 PHE 4 HB1 PHE 4 1.979 -3.383 -2.918
19 HD1 PHE 4 HD2 PHE 4 2.027 -5.837 -3.239
20 HD2 PHE 4 HD1 PHE 4 -1.565 -3.747 -2.317
21 HE1 PHE 4 HE2 PHE 4 0.711 -7.772 -3.997
22 HE2 PHE 4 HE1 PHE 4 -2.887 -5.679 -3.073
23 HZ PHE 4 HZ PHE 4 -1.750 -7.694 -3.916
24 HA PRO 5 HA PRO 5 5.337 -2.122 0.434
25 HB2 PRO 5 HB2 PRO 5 7.256 -3.562 -0.834
26 HB3 PRO 5 HB1 PRO 5 6.491 -4.095 0.668
27 HG2 PRO 5 HG2 PRO 5 5.910 -4.921 -2.150
28 HG3 PRO 5 HG1 PRO 5 6.030 -5.923 -0.692
29 HD2 PRO 5 HD2 PRO 5 3.654 -5.159 -1.745
30 HD3 PRO 5 HD1 PRO 5 3.895 -5.393 -0.002
31 H MET 6 H MET 6 4.467 -0.363 -0.952
32 HA MET 6 HA MET 6 6.348 0.223 -3.076
33 HB2 MET 6 HB2 MET 6 3.473 -0.354 -3.558
34 HB3 MET 6 HB1 MET 6 4.173 1.005 -4.429
35 HG2 MET 6 HG2 MET 6 5.917 -0.487 -5.310
36 HG3 MET 6 HG1 MET 6 5.151 -1.840 -4.481
37 HE1 MET 6 HE1 MET 6 3.700 -3.448 -6.910
38 HE2 MET 6 HE2 MET 6 4.785 -2.606 -8.017
39 HE3 MET 6 HE3 MET 6 5.334 -3.029 -6.394
40 H GLY 7 H GLY 7 5.607 2.498 -4.068
41 HA2 GLY 7 HA2 GLY 7 5.031 4.713 -3.691
42 HA3 GLY 7 HA1 GLY 7 4.326 4.237 -2.154
43 HA PRO 8 HA PRO 8 8.278 6.598 -1.395
44 HB2 PRO 8 HB2 PRO 8 7.181 8.389 0.324
45 HB3 PRO 8 HB1 PRO 8 7.212 8.633 -1.427
46 HG2 PRO 8 HG2 PRO 8 4.983 7.641 0.309
47 HG3 PRO 8 HG1 PRO 8 4.926 8.797 -1.035
48 HD2 PRO 8 HD2 PRO 8 4.199 6.202 -1.312
49 HD3 PRO 8 HD1 PRO 8 4.937 7.134 -2.631
50 H TRP 9 H TRP 9 5.706 5.456 0.732
51 HA TRP 9 HA TRP 9 7.556 5.194 2.966
52 HB2 TRP 9 HB2 TRP 9 4.589 4.945 2.640
53 HB3 TRP 9 HB1 TRP 9 5.372 4.196 4.029
54 HD1 TRP 9 HD TRP 9 5.658 7.715 2.381
55 HE1 TRP 9 HE1 TRP 9 5.557 9.469 4.262
56 HE3 TRP 9 HE3 TRP 9 5.142 4.579 6.386
57 HZ2 TRP 9 HZ2 TRP 9 5.293 9.517 7.072
58 HZ3 TRP 9 HZ3 TRP 9 4.973 5.560 8.637
59 HH2 TRP 9 HH TRP 9 5.048 7.977 8.970
60 H GLY 10 H GLY 10 5.563 3.138 0.870
61 HA2 GLY 10 HA2 GLY 10 6.610 1.049 0.104
62 HA3 GLY 10 HA1 GLY 10 7.214 0.846 1.742
63 HA PRO 11 HA PRO 11 3.744 -1.717 2.566
64 HB2 PRO 11 HB2 PRO 11 3.677 -1.516 5.273
65 HB3 PRO 11 HB1 PRO 11 4.906 -2.448 4.409
66 HG2 PRO 11 HG2 PRO 11 5.080 0.312 5.556
67 HG3 PRO 11 HG1 PRO 11 6.268 -1.002 5.619
68 HD2 PRO 11 HD2 PRO 11 6.463 1.058 3.872
69 HD3 PRO 11 HD1 PRO 11 7.035 -0.578 3.487
70 H PHE 12 H PHE 12 2.301 -0.117 1.509
71 HA PHE 12 HA PHE 12 0.706 1.392 3.471
72 HB2 PHE 12 HB2 PHE 12 0.162 2.966 1.802
73 HB3 PHE 12 HB1 PHE 12 1.877 2.647 1.567
74 HD1 PHE 12 HD2 PHE 12 -1.493 2.117 0.227
75 HD2 PHE 12 HD1 PHE 12 2.676 1.537 -0.400
76 HE1 PHE 12 HE2 PHE 12 -1.931 1.533 -2.123
77 HE2 PHE 12 HE1 PHE 12 2.245 0.953 -2.751
78 HZ PHE 12 HZ PHE 12 -0.061 0.950 -3.615
79 H CYS 13 H CYS 13 -1.505 1.161 3.508
80 HA CYS 13 HA CYS 13 -2.551 -1.133 1.992
81 HB2 CYS 13 HB2 CYS 13 -3.804 0.086 4.449
82 HB3 CYS 13 HB1 CYS 13 -4.106 -1.501 3.750
83 H ILE 14 H ILE 14 -4.524 -1.001 0.925
84 HA ILE 14 HA ILE 14 -5.449 1.743 0.402
85 HB ILE 14 HB ILE 14 -6.511 0.610 -1.662
86 HG12 ILE 14 HG12 ILE 14 -4.379 -1.423 -0.969
87 HG13 ILE 14 HG11 ILE 14 -6.116 -1.706 -0.915
88 HG21 ILE 14 HG21 ILE 14 -4.899 1.718 -2.710
89 HG22 ILE 14 HG22 ILE 14 -4.029 1.830 -1.181
90 HG23 ILE 14 HG23 ILE 14 -3.716 0.485 -2.277
91 HD11 ILE 14 HD11 ILE 14 -6.090 -1.076 -3.398
92 HD12 ILE 14 HD12 ILE 14 -4.347 -1.322 -3.294
93 HD13 ILE 14 HD13 ILE 14 -5.448 -2.649 -2.925
94 HA PRO 15 HA PRO 15 -9.439 0.920 2.035
95 HB2 PRO 15 HB2 PRO 15 -11.034 2.304 0.330
96 HB3 PRO 15 HB1 PRO 15 -9.982 3.091 1.513
97 HG2 PRO 15 HG2 PRO 15 -9.536 2.637 -1.413
98 HG3 PRO 15 HG1 PRO 15 -9.207 4.084 -0.441
99 HD2 PRO 15 HD2 PRO 15 -7.268 2.330 -1.143
100 HD3 PRO 15 HD1 PRO 15 -7.229 3.235 0.384
101 H ASP 16 H ASP 16 -8.907 0.257 -1.370
102 HA ASP 16 HA ASP 16 -11.083 -1.728 -1.290
103 HB2 ASP 16 HB2 ASP 16 -9.889 -0.595 -3.814
104 HB3 ASP 16 HB1 ASP 16 -11.424 -1.436 -3.611
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -8.393 -2.233 -0.269
2 HA2 GLY 1 HA2 GLY 1 -8.102 -4.874 -1.074
3 HA3 GLY 1 HA1 GLY 1 -6.969 -3.939 -2.037
4 HA PRO 2 HA PRO 2 -5.118 -5.120 2.130
5 HB2 PRO 2 HB2 PRO 2 -3.106 -6.659 1.153
6 HB3 PRO 2 HB1 PRO 2 -4.698 -7.307 1.561
7 HG2 PRO 2 HG2 PRO 2 -3.595 -6.536 -1.113
8 HG3 PRO 2 HG1 PRO 2 -4.554 -7.960 -0.666
9 HD2 PRO 2 HD2 PRO 2 -5.639 -5.795 -1.879
10 HD3 PRO 2 HD1 PRO 2 -6.542 -6.794 -0.723
11 H CYS 3 H CYS 3 -2.396 -5.276 2.233
12 HA CYS 3 HA CYS 3 -1.608 -2.615 1.284
13 HB2 CYS 3 HB2 CYS 3 0.007 -4.203 3.242
14 HB3 CYS 3 HB1 CYS 3 -0.174 -2.457 3.102
15 H PHE 4 H PHE 4 0.421 -2.268 0.303
16 HA PHE 4 HA PHE 4 1.874 -4.638 -0.612
17 HB2 PHE 4 HB2 PHE 4 0.510 -2.612 -2.350
18 HB3 PHE 4 HB1 PHE 4 1.984 -3.393 -2.913
19 HD1 PHE 4 HD2 PHE 4 2.034 -5.832 -3.263
20 HD2 PHE 4 HD1 PHE 4 -1.558 -3.774 -2.276
21 HE1 PHE 4 HE2 PHE 4 0.720 -7.771 -4.017
22 HE2 PHE 4 HE1 PHE 4 -2.878 -5.709 -3.027
23 HZ PHE 4 HZ PHE 4 -1.739 -7.712 -3.899
24 HA PRO 5 HA PRO 5 5.342 -2.122 0.432
25 HB2 PRO 5 HB2 PRO 5 7.261 -3.561 -0.841
26 HB3 PRO 5 HB1 PRO 5 6.500 -4.093 0.663
27 HG2 PRO 5 HG2 PRO 5 5.914 -4.919 -2.154
28 HG3 PRO 5 HG1 PRO 5 6.037 -5.922 -0.696
29 HD2 PRO 5 HD2 PRO 5 3.659 -5.161 -1.744
30 HD3 PRO 5 HD1 PRO 5 3.904 -5.396 -0.001
31 H MET 6 H MET 6 4.469 -0.364 -0.950
32 HA MET 6 HA MET 6 6.344 0.226 -3.079
33 HB2 MET 6 HB2 MET 6 3.469 -0.354 -3.555
34 HB3 MET 6 HB1 MET 6 4.166 1.005 -4.426
35 HG2 MET 6 HG2 MET 6 5.899 -0.474 -5.327
36 HG3 MET 6 HG1 MET 6 5.164 -1.833 -4.477
37 HE1 MET 6 HE1 MET 6 4.155 0.718 -7.788
38 HE2 MET 6 HE2 MET 6 5.701 0.006 -7.322
39 HE3 MET 6 HE3 MET 6 4.704 -0.776 -8.550
40 H GLY 7 H GLY 7 5.601 2.500 -4.067
41 HA2 GLY 7 HA2 GLY 7 5.024 4.715 -3.689
42 HA3 GLY 7 HA1 GLY 7 4.321 4.237 -2.150
43 HA PRO 8 HA PRO 8 8.272 6.601 -1.396
44 HB2 PRO 8 HB2 PRO 8 7.177 8.389 0.327
45 HB3 PRO 8 HB1 PRO 8 7.205 8.635 -1.424
46 HG2 PRO 8 HG2 PRO 8 4.980 7.638 0.314
47 HG3 PRO 8 HG1 PRO 8 4.919 8.795 -1.028
48 HD2 PRO 8 HD2 PRO 8 4.194 6.202 -1.307
49 HD3 PRO 8 HD1 PRO 8 4.929 7.134 -2.626
50 H TRP 9 H TRP 9 5.704 5.456 0.735
51 HA TRP 9 HA TRP 9 7.560 5.193 2.966
52 HB2 TRP 9 HB2 TRP 9 4.588 4.870 2.658
53 HB3 TRP 9 HB1 TRP 9 5.417 4.238 4.078
54 HD1 TRP 9 HD TRP 9 5.858 7.651 2.271
55 HE1 TRP 9 HE1 TRP 9 5.585 9.511 4.029
56 HE3 TRP 9 HE3 TRP 9 4.759 4.763 6.345
57 HZ2 TRP 9 HZ2 TRP 9 4.984 9.726 6.779
58 HZ3 TRP 9 HZ3 TRP 9 4.349 5.874 8.502
59 HH2 TRP 9 HH TRP 9 4.461 8.304 8.712
60 H GLY 10 H GLY 10 5.564 3.139 0.872
61 HA2 GLY 10 HA2 GLY 10 6.610 1.050 0.102
62 HA3 GLY 10 HA1 GLY 10 7.216 0.847 1.739
63 HA PRO 11 HA PRO 11 3.748 -1.717 2.567
64 HB2 PRO 11 HB2 PRO 11 3.684 -1.518 5.274
65 HB3 PRO 11 HB1 PRO 11 4.912 -2.448 4.409
66 HG2 PRO 11 HG2 PRO 11 5.085 0.311 5.556
67 HG3 PRO 11 HG1 PRO 11 6.275 -1.002 5.617
68 HD2 PRO 11 HD2 PRO 11 6.468 1.058 3.871
69 HD3 PRO 11 HD1 PRO 11 7.040 -0.577 3.485
70 H PHE 12 H PHE 12 2.305 -0.118 1.510
71 HA PHE 12 HA PHE 12 0.710 1.390 3.474
72 HB2 PHE 12 HB2 PHE 12 0.166 2.966 1.809
73 HB3 PHE 12 HB1 PHE 12 1.880 2.646 1.568
74 HD1 PHE 12 HD2 PHE 12 -1.493 2.124 0.234
75 HD2 PHE 12 HD1 PHE 12 2.675 1.533 -0.399
76 HE1 PHE 12 HE2 PHE 12 -1.936 1.542 -2.116
77 HE2 PHE 12 HE1 PHE 12 2.239 0.952 -2.750
78 HZ PHE 12 HZ PHE 12 -0.069 0.955 -3.611
79 H CYS 13 H CYS 13 -1.504 1.164 3.503
80 HA CYS 13 HA CYS 13 -2.549 -1.131 1.991
81 HB2 CYS 13 HB2 CYS 13 -3.803 0.089 4.446
82 HB3 CYS 13 HB1 CYS 13 -4.105 -1.499 3.748
83 H ILE 14 H ILE 14 -4.526 -1.001 0.929
84 HA ILE 14 HA ILE 14 -5.449 1.744 0.402
85 HB ILE 14 HB ILE 14 -6.512 0.605 -1.662
86 HG12 ILE 14 HG12 ILE 14 -4.368 -1.416 -0.967
87 HG13 ILE 14 HG11 ILE 14 -6.103 -1.708 -0.915
88 HG21 ILE 14 HG21 ILE 14 -3.722 0.494 -2.289
89 HG22 ILE 14 HG22 ILE 14 -4.909 1.728 -2.705
90 HG23 ILE 14 HG23 ILE 14 -4.029 1.831 -1.181
91 HD11 ILE 14 HD11 ILE 14 -6.228 -1.330 -3.327
92 HD12 ILE 14 HD12 ILE 14 -4.483 -1.069 -3.368
93 HD13 ILE 14 HD13 ILE 14 -5.129 -2.647 -2.919
94 HA PRO 15 HA PRO 15 -9.439 0.922 2.031
95 HB2 PRO 15 HB2 PRO 15 -11.035 2.303 0.322
96 HB3 PRO 15 HB1 PRO 15 -9.984 3.092 1.505
97 HG2 PRO 15 HG2 PRO 15 -9.535 2.633 -1.420
98 HG3 PRO 15 HG1 PRO 15 -9.208 4.082 -0.451
99 HD2 PRO 15 HD2 PRO 15 -7.266 2.327 -1.147
100 HD3 PRO 15 HD1 PRO 15 -7.230 3.236 0.377
101 H ASP 16 H ASP 16 -8.911 0.261 -1.376
102 HA ASP 16 HA ASP 16 -11.084 -1.730 -1.292
103 HB2 ASP 16 HB2 ASP 16 -11.317 0.146 -2.961
104 HB3 ASP 16 HB1 ASP 16 -9.885 -0.485 -3.770
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -8.385 -2.226 -0.278
2 HA2 GLY 1 HA2 GLY 1 -8.099 -4.869 -1.086
3 HA3 GLY 1 HA1 GLY 1 -6.965 -3.931 -2.046
4 HA PRO 2 HA PRO 2 -5.119 -5.125 2.121
5 HB2 PRO 2 HB2 PRO 2 -3.105 -6.661 1.140
6 HB3 PRO 2 HB1 PRO 2 -4.698 -7.310 1.545
7 HG2 PRO 2 HG2 PRO 2 -3.592 -6.530 -1.126
8 HG3 PRO 2 HG1 PRO 2 -4.550 -7.955 -0.684
9 HD2 PRO 2 HD2 PRO 2 -5.635 -5.787 -1.891
10 HD3 PRO 2 HD1 PRO 2 -6.539 -6.791 -0.739
11 H CYS 3 H CYS 3 -2.397 -5.282 2.226
12 HA CYS 3 HA CYS 3 -1.608 -2.617 1.284
13 HB2 CYS 3 HB2 CYS 3 0.004 -4.207 3.245
14 HB3 CYS 3 HB1 CYS 3 -0.180 -2.460 3.107
15 H PHE 4 H PHE 4 0.417 -2.268 0.301
16 HA PHE 4 HA PHE 4 1.877 -4.636 -0.609
17 HB2 PHE 4 HB2 PHE 4 0.515 -2.611 -2.350
18 HB3 PHE 4 HB1 PHE 4 1.990 -3.392 -2.909
19 HD1 PHE 4 HD2 PHE 4 2.041 -5.842 -3.234
20 HD2 PHE 4 HD1 PHE 4 -1.555 -3.762 -2.303
21 HE1 PHE 4 HE2 PHE 4 0.727 -7.781 -3.990
22 HE2 PHE 4 HE1 PHE 4 -2.873 -5.697 -3.056
23 HZ PHE 4 HZ PHE 4 -1.733 -7.710 -3.900
24 HA PRO 5 HA PRO 5 5.339 -2.114 0.442
25 HB2 PRO 5 HB2 PRO 5 7.263 -3.551 -0.824
26 HB3 PRO 5 HB1 PRO 5 6.499 -4.083 0.677
27 HG2 PRO 5 HG2 PRO 5 5.921 -4.913 -2.140
28 HG3 PRO 5 HG1 PRO 5 6.042 -5.915 -0.682
29 HD2 PRO 5 HD2 PRO 5 3.666 -5.156 -1.735
30 HD3 PRO 5 HD1 PRO 5 3.906 -5.390 0.008
31 H MET 6 H MET 6 4.447 -0.368 -0.956
32 HA MET 6 HA MET 6 6.331 0.222 -3.080
33 HB2 MET 6 HB2 MET 6 3.454 -0.353 -3.551
34 HB3 MET 6 HB1 MET 6 4.150 1.005 -4.423
35 HG2 MET 6 HG2 MET 6 5.279 -1.782 -4.452
36 HG3 MET 6 HG1 MET 6 4.180 -1.138 -5.669
37 HE1 MET 6 HE1 MET 6 4.682 -0.038 -7.539
38 HE2 MET 6 HE2 MET 6 5.165 1.556 -6.961
39 HE3 MET 6 HE3 MET 6 6.211 0.666 -8.069
40 H GLY 7 H GLY 7 5.589 2.497 -4.070
41 HA2 GLY 7 HA2 GLY 7 5.018 4.714 -3.691
42 HA3 GLY 7 HA1 GLY 7 4.317 4.238 -2.152
43 HA PRO 8 HA PRO 8 8.275 6.592 -1.405
44 HB2 PRO 8 HB2 PRO 8 7.187 8.387 0.317
45 HB3 PRO 8 HB1 PRO 8 7.213 8.630 -1.433
46 HG2 PRO 8 HG2 PRO 8 4.988 7.641 0.308
47 HG3 PRO 8 HG1 PRO 8 4.928 8.797 -1.036
48 HD2 PRO 8 HD2 PRO 8 4.196 6.205 -1.311
49 HD3 PRO 8 HD1 PRO 8 4.932 7.135 -2.632
50 H TRP 9 H TRP 9 5.706 5.459 0.731
51 HA TRP 9 HA TRP 9 7.561 5.196 2.961
52 HB2 TRP 9 HB2 TRP 9 5.200 6.028 3.262
53 HB3 TRP 9 HB1 TRP 9 4.645 4.404 2.864
54 HD1 TRP 9 HD TRP 9 4.715 2.606 4.756
55 HE1 TRP 9 HE1 TRP 9 5.338 2.663 7.253
56 HE3 TRP 9 HE3 TRP 9 6.885 7.230 4.945
57 HZ2 TRP 9 HZ2 TRP 9 6.582 4.436 9.063
58 HZ3 TRP 9 HZ3 TRP 9 7.766 8.033 7.097
59 HH2 TRP 9 HH TRP 9 7.616 6.664 9.112
60 H GLY 10 H GLY 10 5.566 3.138 0.869
61 HA2 GLY 10 HA2 GLY 10 6.612 1.050 0.101
62 HA3 GLY 10 HA1 GLY 10 7.218 0.848 1.739
63 HA PRO 11 HA PRO 11 3.752 -1.717 2.571
64 HB2 PRO 11 HB2 PRO 11 3.690 -1.516 5.277
65 HB3 PRO 11 HB1 PRO 11 4.918 -2.447 4.411
66 HG2 PRO 11 HG2 PRO 11 5.092 0.313 5.558
67 HG3 PRO 11 HG1 PRO 11 6.282 -1.001 5.617
68 HD2 PRO 11 HD2 PRO 11 6.473 1.059 3.870
69 HD3 PRO 11 HD1 PRO 11 7.044 -0.577 3.483
70 H PHE 12 H PHE 12 2.303 -0.123 1.516
71 HA PHE 12 HA PHE 12 0.710 1.385 3.483
72 HB2 PHE 12 HB2 PHE 12 0.168 2.964 1.821
73 HB3 PHE 12 HB1 PHE 12 1.882 2.644 1.579
74 HD1 PHE 12 HD2 PHE 12 -1.493 2.129 0.247
75 HD2 PHE 12 HD1 PHE 12 2.673 1.533 -0.393
76 HE1 PHE 12 HE2 PHE 12 -1.939 1.554 -2.104
77 HE2 PHE 12 HE1 PHE 12 2.234 0.958 -2.743
78 HZ PHE 12 HZ PHE 12 -0.074 0.966 -3.602
79 H CYS 13 H CYS 13 -1.504 1.160 3.509
80 HA CYS 13 HA CYS 13 -2.548 -1.134 1.993
81 HB2 CYS 13 HB2 CYS 13 -3.805 0.083 4.448
82 HB3 CYS 13 HB1 CYS 13 -4.105 -1.504 3.748
83 H ILE 14 H ILE 14 -4.527 -1.002 0.933
84 HA ILE 14 HA ILE 14 -5.449 1.744 0.409
85 HB ILE 14 HB ILE 14 -6.512 0.606 -1.656
86 HG12 ILE 14 HG12 ILE 14 -4.361 -1.408 -0.964
87 HG13 ILE 14 HG11 ILE 14 -6.096 -1.708 -0.917
88 HG21 ILE 14 HG21 ILE 14 -4.900 1.684 -2.741
89 HG22 ILE 14 HG22 ILE 14 -4.083 1.889 -1.193
90 HG23 ILE 14 HG23 ILE 14 -3.688 0.513 -2.223
91 HD11 ILE 14 HD11 ILE 14 -4.312 -1.330 -3.281
92 HD12 ILE 14 HD12 ILE 14 -5.446 -2.634 -2.930
93 HD13 ILE 14 HD13 ILE 14 -6.048 -1.046 -3.404
94 HA PRO 15 HA PRO 15 -9.441 0.919 2.034
95 HB2 PRO 15 HB2 PRO 15 -11.035 2.301 0.325
96 HB3 PRO 15 HB1 PRO 15 -9.986 3.088 1.510
97 HG2 PRO 15 HG2 PRO 15 -9.535 2.634 -1.414
98 HG3 PRO 15 HG1 PRO 15 -9.209 4.082 -0.444
99 HD2 PRO 15 HD2 PRO 15 -7.267 2.329 -1.141
100 HD3 PRO 15 HD1 PRO 15 -7.231 3.235 0.386
101 H ASP 16 H ASP 16 -8.913 0.265 -1.375
102 HA ASP 16 HA ASP 16 -11.083 -1.728 -1.295
103 HB2 ASP 16 HB2 ASP 16 -11.174 0.235 -2.979
104 HB3 ASP 16 HB1 ASP 16 -9.900 -0.631 -3.834
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -8.387 -2.232 -0.274
2 HA2 GLY 1 HA2 GLY 1 -8.089 -4.869 -1.095
3 HA3 GLY 1 HA1 GLY 1 -6.958 -3.921 -2.048
4 HA PRO 2 HA PRO 2 -5.117 -5.126 2.120
5 HB2 PRO 2 HB2 PRO 2 -3.102 -6.660 1.140
6 HB3 PRO 2 HB1 PRO 2 -4.696 -7.310 1.542
7 HG2 PRO 2 HG2 PRO 2 -3.586 -6.528 -1.126
8 HG3 PRO 2 HG1 PRO 2 -4.546 -7.953 -0.688
9 HD2 PRO 2 HD2 PRO 2 -5.628 -5.784 -1.894
10 HD3 PRO 2 HD1 PRO 2 -6.534 -6.789 -0.745
11 H CYS 3 H CYS 3 -2.395 -5.283 2.226
12 HA CYS 3 HA CYS 3 -1.605 -2.617 1.289
13 HB2 CYS 3 HB2 CYS 3 0.002 -4.211 3.249
14 HB3 CYS 3 HB1 CYS 3 -0.176 -2.464 3.112
15 H PHE 4 H PHE 4 0.409 -2.267 0.294
16 HA PHE 4 HA PHE 4 1.874 -4.634 -0.614
17 HB2 PHE 4 HB2 PHE 4 0.512 -2.605 -2.352
18 HB3 PHE 4 HB1 PHE 4 1.987 -3.388 -2.912
19 HD1 PHE 4 HD2 PHE 4 2.036 -5.844 -3.223
20 HD2 PHE 4 HD1 PHE 4 -1.558 -3.749 -2.321
21 HE1 PHE 4 HE2 PHE 4 0.721 -7.781 -3.981
22 HE2 PHE 4 HE1 PHE 4 -2.878 -5.683 -3.077
23 HZ PHE 4 HZ PHE 4 -1.739 -7.701 -3.910
24 HA PRO 5 HA PRO 5 5.335 -2.115 0.443
25 HB2 PRO 5 HB2 PRO 5 7.261 -3.553 -0.822
26 HB3 PRO 5 HB1 PRO 5 6.494 -4.085 0.679
27 HG2 PRO 5 HG2 PRO 5 5.918 -4.914 -2.139
28 HG3 PRO 5 HG1 PRO 5 6.037 -5.915 -0.681
29 HD2 PRO 5 HD2 PRO 5 3.662 -5.156 -1.737
30 HD3 PRO 5 HD1 PRO 5 3.902 -5.389 0.007
31 H MET 6 H MET 6 4.446 -0.369 -0.956
32 HA MET 6 HA MET 6 6.333 0.220 -3.078
33 HB2 MET 6 HB2 MET 6 3.456 -0.353 -3.552
34 HB3 MET 6 HB1 MET 6 4.154 1.006 -4.424
35 HG2 MET 6 HG2 MET 6 5.283 -1.782 -4.451
36 HG3 MET 6 HG1 MET 6 4.185 -1.139 -5.670
37 HE1 MET 6 HE1 MET 6 7.164 -0.899 -7.969
38 HE2 MET 6 HE2 MET 6 6.230 -2.160 -7.164
39 HE3 MET 6 HE3 MET 6 5.403 -0.806 -7.936
40 H GLY 7 H GLY 7 5.590 2.496 -4.070
41 HA2 GLY 7 HA2 GLY 7 5.021 4.713 -3.691
42 HA3 GLY 7 HA1 GLY 7 4.319 4.237 -2.152
43 HA PRO 8 HA PRO 8 8.276 6.593 -1.404
44 HB2 PRO 8 HB2 PRO 8 7.187 8.386 0.318
45 HB3 PRO 8 HB1 PRO 8 7.213 8.629 -1.432
46 HG2 PRO 8 HG2 PRO 8 4.988 7.640 0.308
47 HG3 PRO 8 HG1 PRO 8 4.928 8.796 -1.036
48 HD2 PRO 8 HD2 PRO 8 4.197 6.204 -1.311
49 HD3 PRO 8 HD1 PRO 8 4.933 7.133 -2.632
50 H TRP 9 H TRP 9 5.707 5.457 0.732
51 HA TRP 9 HA TRP 9 7.562 5.195 2.960
52 HB2 TRP 9 HB2 TRP 9 4.598 4.990 2.634
53 HB3 TRP 9 HB1 TRP 9 5.356 4.173 3.998
54 HD1 TRP 9 HD TRP 9 4.722 7.686 2.594
55 HE1 TRP 9 HE1 TRP 9 5.046 9.395 4.492
56 HE3 TRP 9 HE3 TRP 9 6.525 4.552 6.207
57 HZ2 TRP 9 HZ2 TRP 9 5.948 9.410 7.167
58 HZ3 TRP 9 HZ3 TRP 9 7.096 5.493 8.408
59 HH2 TRP 9 HH TRP 9 6.813 7.872 8.876
60 H GLY 10 H GLY 10 5.566 3.138 0.869
61 HA2 GLY 10 HA2 GLY 10 6.610 1.049 0.101
62 HA3 GLY 10 HA1 GLY 10 7.218 0.847 1.738
63 HA PRO 11 HA PRO 11 3.749 -1.716 2.571
64 HB2 PRO 11 HB2 PRO 11 3.687 -1.514 5.277
65 HB3 PRO 11 HB1 PRO 11 4.915 -2.445 4.413
66 HG2 PRO 11 HG2 PRO 11 5.089 0.315 5.558
67 HG3 PRO 11 HG1 PRO 11 6.279 -0.999 5.618
68 HD2 PRO 11 HD2 PRO 11 6.470 1.060 3.870
69 HD3 PRO 11 HD1 PRO 11 7.041 -0.577 3.484
70 H PHE 12 H PHE 12 2.301 -0.124 1.516
71 HA PHE 12 HA PHE 12 0.707 1.386 3.480
72 HB2 PHE 12 HB2 PHE 12 0.166 2.966 1.818
73 HB3 PHE 12 HB1 PHE 12 1.880 2.645 1.577
74 HD1 PHE 12 HD2 PHE 12 -1.493 2.129 0.243
75 HD2 PHE 12 HD1 PHE 12 2.673 1.533 -0.394
76 HE1 PHE 12 HE2 PHE 12 -1.939 1.552 -2.107
77 HE2 PHE 12 HE1 PHE 12 2.235 0.957 -2.745
78 HZ PHE 12 HZ PHE 12 -0.073 0.966 -3.605
79 H CYS 13 H CYS 13 -1.505 1.158 3.511
80 HA CYS 13 HA CYS 13 -2.549 -1.134 1.992
81 HB2 CYS 13 HB2 CYS 13 -3.806 0.082 4.449
82 HB3 CYS 13 HB1 CYS 13 -4.105 -1.506 3.747
83 H ILE 14 H ILE 14 -4.528 -1.002 0.933
84 HA ILE 14 HA ILE 14 -5.451 1.744 0.410
85 HB ILE 14 HB ILE 14 -6.513 0.609 -1.656
86 HG12 ILE 14 HG12 ILE 14 -4.369 -1.412 -0.963
87 HG13 ILE 14 HG11 ILE 14 -6.104 -1.706 -0.919
88 HG21 ILE 14 HG21 ILE 14 -4.918 1.768 -2.670
89 HG22 ILE 14 HG22 ILE 14 -4.005 1.808 -1.163
90 HG23 ILE 14 HG23 ILE 14 -3.743 0.501 -2.317
91 HD11 ILE 14 HD11 ILE 14 -6.118 -1.132 -3.382
92 HD12 ILE 14 HD12 ILE 14 -4.358 -1.235 -3.309
93 HD13 ILE 14 HD13 ILE 14 -5.342 -2.647 -2.923
94 HA PRO 15 HA PRO 15 -9.443 0.917 2.035
95 HB2 PRO 15 HB2 PRO 15 -11.037 2.301 0.328
96 HB3 PRO 15 HB1 PRO 15 -9.987 3.087 1.514
97 HG2 PRO 15 HG2 PRO 15 -9.536 2.636 -1.412
98 HG3 PRO 15 HG1 PRO 15 -9.210 4.082 -0.440
99 HD2 PRO 15 HD2 PRO 15 -7.268 2.330 -1.139
100 HD3 PRO 15 HD1 PRO 15 -7.233 3.236 0.388
101 H ASP 16 H ASP 16 -8.912 0.263 -1.373
102 HA ASP 16 HA ASP 16 -11.083 -1.728 -1.295
103 HB2 ASP 16 HB2 ASP 16 -10.975 -1.547 -3.832
104 HB3 ASP 16 HB1 ASP 16 -11.623 -0.148 -2.979
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -8.308 -2.164 -0.338
2 HA2 GLY 1 HA2 GLY 1 -8.088 -4.864 -1.108
3 HA3 GLY 1 HA1 GLY 1 -6.955 -3.913 -2.059
4 HA PRO 2 HA PRO 2 -5.116 -5.134 2.104
5 HB2 PRO 2 HB2 PRO 2 -3.100 -6.662 1.120
6 HB3 PRO 2 HB1 PRO 2 -4.694 -7.315 1.517
7 HG2 PRO 2 HG2 PRO 2 -3.583 -6.519 -1.146
8 HG3 PRO 2 HG1 PRO 2 -4.541 -7.948 -0.715
9 HD2 PRO 2 HD2 PRO 2 -5.624 -5.773 -1.912
10 HD3 PRO 2 HD1 PRO 2 -6.531 -6.784 -0.767
11 H CYS 3 H CYS 3 -2.394 -5.289 2.213
12 HA CYS 3 HA CYS 3 -1.605 -2.620 1.287
13 HB2 CYS 3 HB2 CYS 3 -0.003 -4.219 3.247
14 HB3 CYS 3 HB1 CYS 3 -0.177 -2.472 3.112
15 H PHE 4 H PHE 4 0.406 -2.264 0.291
16 HA PHE 4 HA PHE 4 1.875 -4.628 -0.620
17 HB2 PHE 4 HB2 PHE 4 0.516 -2.592 -2.352
18 HB3 PHE 4 HB1 PHE 4 1.992 -3.371 -2.913
19 HD1 PHE 4 HD2 PHE 4 2.043 -5.835 -3.216
20 HD2 PHE 4 HD1 PHE 4 -1.553 -3.728 -2.350
21 HE1 PHE 4 HE2 PHE 4 0.729 -7.768 -3.984
22 HE2 PHE 4 HE1 PHE 4 -2.873 -5.659 -3.116
23 HZ PHE 4 HZ PHE 4 -1.732 -7.682 -3.936
24 HA PRO 5 HA PRO 5 5.332 -2.111 0.459
25 HB2 PRO 5 HB2 PRO 5 7.261 -3.550 -0.797
26 HB3 PRO 5 HB1 PRO 5 6.487 -4.082 0.700
27 HG2 PRO 5 HG2 PRO 5 5.924 -4.910 -2.121
28 HG3 PRO 5 HG1 PRO 5 6.036 -5.912 -0.662
29 HD2 PRO 5 HD2 PRO 5 3.667 -5.150 -1.729
30 HD3 PRO 5 HD1 PRO 5 3.897 -5.384 0.015
31 H MET 6 H MET 6 4.417 -0.382 -0.969
32 HA MET 6 HA MET 6 6.324 0.210 -3.077
33 HB2 MET 6 HB2 MET 6 3.447 -0.356 -3.555
34 HB3 MET 6 HB1 MET 6 4.149 1.001 -4.426
35 HG2 MET 6 HG2 MET 6 5.354 -1.750 -4.440
36 HG3 MET 6 HG1 MET 6 4.152 -1.218 -5.614
37 HE1 MET 6 HE1 MET 6 6.579 -1.406 -7.940
38 HE2 MET 6 HE2 MET 6 4.868 -1.253 -7.538
39 HE3 MET 6 HE3 MET 6 5.730 0.107 -8.258
40 H GLY 7 H GLY 7 5.577 2.487 -4.074
41 HA2 GLY 7 HA2 GLY 7 5.015 4.705 -3.697
42 HA3 GLY 7 HA1 GLY 7 4.313 4.233 -2.157
43 HA PRO 8 HA PRO 8 8.276 6.579 -1.413
44 HB2 PRO 8 HB2 PRO 8 7.189 8.382 0.302
45 HB3 PRO 8 HB1 PRO 8 7.220 8.620 -1.450
46 HG2 PRO 8 HG2 PRO 8 4.989 7.644 0.292
47 HG3 PRO 8 HG1 PRO 8 4.935 8.796 -1.056
48 HD2 PRO 8 HD2 PRO 8 4.195 6.205 -1.323
49 HD3 PRO 8 HD1 PRO 8 4.937 7.127 -2.647
50 H TRP 9 H TRP 9 5.698 5.465 0.725
51 HA TRP 9 HA TRP 9 7.546 5.206 2.960
52 HB2 TRP 9 HB2 TRP 9 4.579 4.935 2.629
53 HB3 TRP 9 HB1 TRP 9 5.369 4.214 4.030
54 HD1 TRP 9 HD TRP 9 4.036 7.458 2.759
55 HE1 TRP 9 HE1 TRP 9 4.532 9.336 4.448
56 HE3 TRP 9 HE3 TRP 9 7.328 4.980 5.786
57 HZ2 TRP 9 HZ2 TRP 9 6.109 9.717 6.757
58 HZ3 TRP 9 HZ3 TRP 9 8.285 6.173 7.714
59 HH2 TRP 9 HH TRP 9 7.687 8.493 8.187
60 H GLY 10 H GLY 10 5.564 3.138 0.866
61 HA2 GLY 10 HA2 GLY 10 6.615 1.049 0.109
62 HA3 GLY 10 HA1 GLY 10 7.219 0.854 1.748
63 HA PRO 11 HA PRO 11 3.757 -1.719 2.575
64 HB2 PRO 11 HB2 PRO 11 3.695 -1.519 5.283
65 HB3 PRO 11 HB1 PRO 11 4.924 -2.448 4.415
66 HG2 PRO 11 HG2 PRO 11 5.094 0.312 5.564
67 HG3 PRO 11 HG1 PRO 11 6.286 -1.000 5.623
68 HD2 PRO 11 HD2 PRO 11 6.474 1.061 3.876
69 HD3 PRO 11 HD1 PRO 11 7.047 -0.575 3.490
70 H PHE 12 H PHE 12 2.311 -0.120 1.520
71 HA PHE 12 HA PHE 12 0.714 1.383 3.488
72 HB2 PHE 12 HB2 PHE 12 0.171 2.964 1.828
73 HB3 PHE 12 HB1 PHE 12 1.885 2.643 1.583
74 HD1 PHE 12 HD2 PHE 12 -1.490 2.133 0.254
75 HD2 PHE 12 HD1 PHE 12 2.674 1.529 -0.388
76 HE1 PHE 12 HE2 PHE 12 -1.940 1.560 -2.097
77 HE2 PHE 12 HE1 PHE 12 2.232 0.955 -2.740
78 HZ PHE 12 HZ PHE 12 -0.077 0.969 -3.597
79 H CYS 13 H CYS 13 -1.502 1.162 3.508
80 HA CYS 13 HA CYS 13 -2.543 -1.133 1.991
81 HB2 CYS 13 HB2 CYS 13 -3.801 0.077 4.450
82 HB3 CYS 13 HB1 CYS 13 -4.097 -1.510 3.746
83 H ILE 14 H ILE 14 -4.525 -1.002 0.935
84 HA ILE 14 HA ILE 14 -5.450 1.745 0.417
85 HB ILE 14 HB ILE 14 -6.512 0.612 -1.651
86 HG12 ILE 14 HG12 ILE 14 -4.364 -1.405 -0.962
87 HG13 ILE 14 HG11 ILE 14 -6.098 -1.703 -0.918
88 HG21 ILE 14 HG21 ILE 14 -4.911 1.736 -2.699
89 HG22 ILE 14 HG22 ILE 14 -4.043 1.854 -1.169
90 HG23 ILE 14 HG23 ILE 14 -3.715 0.514 -2.267
91 HD11 ILE 14 HD11 ILE 14 -5.027 -2.611 -2.926
92 HD12 ILE 14 HD12 ILE 14 -6.243 -1.391 -3.307
93 HD13 ILE 14 HD13 ILE 14 -4.529 -0.982 -3.381
94 HA PRO 15 HA PRO 15 -9.440 0.911 2.043
95 HB2 PRO 15 HB2 PRO 15 -11.036 2.298 0.340
96 HB3 PRO 15 HB1 PRO 15 -9.986 3.083 1.527
97 HG2 PRO 15 HG2 PRO 15 -9.537 2.638 -1.399
98 HG3 PRO 15 HG1 PRO 15 -9.212 4.083 -0.424
99 HD2 PRO 15 HD2 PRO 15 -7.268 2.334 -1.129
100 HD3 PRO 15 HD1 PRO 15 -7.233 3.235 0.400
101 H ASP 16 H ASP 16 -8.914 0.269 -1.369
102 HA ASP 16 HA ASP 16 -11.080 -1.727 -1.292
103 HB2 ASP 16 HB2 ASP 16 -11.052 0.294 -2.992
104 HB3 ASP 16 HB1 ASP 16 -9.938 -0.746 -3.874
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -8.306 -2.184 -0.363
2 HA2 GLY 1 HA2 GLY 1 -8.023 -4.826 -1.152
3 HA3 GLY 1 HA1 GLY 1 -6.848 -3.912 -2.086
4 HA PRO 2 HA PRO 2 -5.136 -5.104 2.137
5 HB2 PRO 2 HB2 PRO 2 -3.112 -6.666 1.221
6 HB3 PRO 2 HB1 PRO 2 -4.724 -7.295 1.583
7 HG2 PRO 2 HG2 PRO 2 -3.534 -6.540 -1.059
8 HG3 PRO 2 HG1 PRO 2 -4.521 -7.953 -0.639
9 HD2 PRO 2 HD2 PRO 2 -5.545 -5.778 -1.886
10 HD3 PRO 2 HD1 PRO 2 -6.493 -6.766 -0.756
11 H CYS 3 H CYS 3 -2.422 -5.287 2.323
12 HA CYS 3 HA CYS 3 -1.578 -2.634 1.407
13 HB2 CYS 3 HB2 CYS 3 -0.010 -4.245 3.379
14 HB3 CYS 3 HB1 CYS 3 -0.201 -2.498 3.263
15 H PHE 4 H PHE 4 0.383 -2.296 0.362
16 HA PHE 4 HA PHE 4 1.913 -4.652 -0.457
17 HB2 PHE 4 HB2 PHE 4 0.489 -2.743 -2.280
18 HB3 PHE 4 HB1 PHE 4 1.973 -3.526 -2.812
19 HD1 PHE 4 HD2 PHE 4 2.065 -6.000 -2.981
20 HD2 PHE 4 HD1 PHE 4 -1.561 -3.914 -2.192
21 HE1 PHE 4 HE2 PHE 4 0.780 -7.995 -3.630
22 HE2 PHE 4 HE1 PHE 4 -2.851 -5.907 -2.838
23 HZ PHE 4 HZ PHE 4 -1.682 -7.950 -3.559
24 HA PRO 5 HA PRO 5 5.313 -1.993 0.427
25 HB2 PRO 5 HB2 PRO 5 7.255 -3.376 -0.872
26 HB3 PRO 5 HB1 PRO 5 6.553 -3.914 0.659
27 HG2 PRO 5 HG2 PRO 5 5.930 -4.807 -2.130
28 HG3 PRO 5 HG1 PRO 5 6.128 -5.781 -0.662
29 HD2 PRO 5 HD2 PRO 5 3.697 -5.129 -1.660
30 HD3 PRO 5 HD1 PRO 5 3.994 -5.326 0.079
31 H MET 6 H MET 6 4.256 -0.340 -1.013
32 HA MET 6 HA MET 6 6.045 0.231 -3.250
33 HB2 MET 6 HB2 MET 6 3.074 -0.105 -3.436
34 HB3 MET 6 HB1 MET 6 3.883 1.052 -4.484
35 HG2 MET 6 HG2 MET 6 5.092 -0.602 -5.585
36 HG3 MET 6 HG1 MET 6 4.820 -1.782 -4.306
37 HE1 MET 6 HE1 MET 6 4.040 -2.607 -7.632
38 HE2 MET 6 HE2 MET 6 4.527 -3.359 -6.113
39 HE3 MET 6 HE3 MET 6 2.961 -3.744 -6.825
40 H GLY 7 H GLY 7 5.270 2.529 -4.181
41 HA2 GLY 7 HA2 GLY 7 4.921 4.773 -3.774
42 HA3 GLY 7 HA1 GLY 7 4.188 4.333 -2.238
43 HA PRO 8 HA PRO 8 8.252 6.462 -1.442
44 HB2 PRO 8 HB2 PRO 8 7.254 8.246 0.343
45 HB3 PRO 8 HB1 PRO 8 7.278 8.542 -1.399
46 HG2 PRO 8 HG2 PRO 8 5.026 7.595 0.331
47 HG3 PRO 8 HG1 PRO 8 5.005 8.793 -0.977
48 HD2 PRO 8 HD2 PRO 8 4.162 6.244 -1.324
49 HD3 PRO 8 HD1 PRO 8 4.927 7.182 -2.622
50 H TRP 9 H TRP 9 5.640 5.657 0.834
51 HA TRP 9 HA TRP 9 7.470 5.198 3.005
52 HB2 TRP 9 HB2 TRP 9 4.949 5.936 3.064
53 HB3 TRP 9 HB1 TRP 9 4.645 4.200 3.018
54 HD1 TRP 9 HD TRP 9 5.560 2.752 5.137
55 HE1 TRP 9 HE1 TRP 9 5.958 3.445 7.584
56 HE3 TRP 9 HE3 TRP 9 5.659 7.828 4.536
57 HZ2 TRP 9 HZ2 TRP 9 6.273 5.829 9.063
58 HZ3 TRP 9 HZ3 TRP 9 6.013 9.243 6.518
59 HH2 TRP 9 HH TRP 9 6.313 8.262 8.733
60 H GLY 10 H GLY 10 5.523 3.172 0.838
61 HA2 GLY 10 HA2 GLY 10 6.564 1.102 0.041
62 HA3 GLY 10 HA1 GLY 10 7.196 0.881 1.666
63 HA PRO 11 HA PRO 11 3.770 -1.770 2.431
64 HB2 PRO 11 HB2 PRO 11 3.841 -1.762 5.145
65 HB3 PRO 11 HB1 PRO 11 5.019 -2.632 4.156
66 HG2 PRO 11 HG2 PRO 11 5.267 0.038 5.486
67 HG3 PRO 11 HG1 PRO 11 6.450 -1.280 5.394
68 HD2 PRO 11 HD2 PRO 11 6.568 0.898 3.790
69 HD3 PRO 11 HD1 PRO 11 7.110 -0.707 3.261
70 H PHE 12 H PHE 12 2.230 -0.184 1.578
71 HA PHE 12 HA PHE 12 0.740 1.179 3.725
72 HB2 PHE 12 HB2 PHE 12 0.095 2.887 2.189
73 HB3 PHE 12 HB1 PHE 12 1.833 2.677 2.008
74 HD1 PHE 12 HD2 PHE 12 -1.444 1.962 0.481
75 HD2 PHE 12 HD1 PHE 12 2.780 1.979 -0.043
76 HE1 PHE 12 HE2 PHE 12 -1.745 1.602 -1.935
77 HE2 PHE 12 HE1 PHE 12 2.485 1.621 -2.460
78 HZ PHE 12 HZ PHE 12 0.221 1.432 -3.408
79 H CYS 13 H CYS 13 -1.487 0.994 3.760
80 HA CYS 13 HA CYS 13 -2.561 -1.210 2.149
81 HB2 CYS 13 HB2 CYS 13 -3.855 0.029 4.575
82 HB3 CYS 13 HB1 CYS 13 -4.186 -1.542 3.853
83 H ILE 14 H ILE 14 -4.471 -1.018 0.996
84 HA ILE 14 HA ILE 14 -5.330 1.751 0.484
85 HB ILE 14 HB ILE 14 -6.331 0.642 -1.640
86 HG12 ILE 14 HG12 ILE 14 -4.188 -1.365 -0.905
87 HG13 ILE 14 HG11 ILE 14 -5.919 -1.679 -0.914
88 HG21 ILE 14 HG21 ILE 14 -4.694 1.765 -2.635
89 HG22 ILE 14 HG22 ILE 14 -3.919 1.924 -1.060
90 HG23 ILE 14 HG23 ILE 14 -3.496 0.579 -2.119
91 HD11 ILE 14 HD11 ILE 14 -5.245 -2.564 -2.925
92 HD12 ILE 14 HD12 ILE 14 -5.770 -0.948 -3.398
93 HD13 ILE 14 HD13 ILE 14 -4.052 -1.296 -3.205
94 HA PRO 15 HA PRO 15 -9.403 0.966 1.915
95 HB2 PRO 15 HB2 PRO 15 -10.902 2.386 0.153
96 HB3 PRO 15 HB1 PRO 15 -9.896 3.148 1.389
97 HG2 PRO 15 HG2 PRO 15 -9.322 2.714 -1.516
98 HG3 PRO 15 HG1 PRO 15 -9.021 4.149 -0.518
99 HD2 PRO 15 HD2 PRO 15 -7.073 2.377 -1.147
100 HD3 PRO 15 HD1 PRO 15 -7.092 3.268 0.388
101 H ASP 16 H ASP 16 -8.731 0.333 -1.471
102 HA ASP 16 HA ASP 16 -10.931 -1.626 -1.508
103 HB2 ASP 16 HB2 ASP 16 -9.623 -0.586 -4.000
104 HB3 ASP 16 HB1 ASP 16 -11.238 -1.258 -3.792
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -8.384 -2.207 -0.296
2 HA2 GLY 1 HA2 GLY 1 -8.120 -4.868 -1.135
3 HA3 GLY 1 HA1 GLY 1 -7.001 -3.894 -2.078
4 HA PRO 2 HA PRO 2 -5.134 -5.163 2.062
5 HB2 PRO 2 HB2 PRO 2 -3.127 -6.684 1.049
6 HB3 PRO 2 HB1 PRO 2 -4.718 -7.339 1.453
7 HG2 PRO 2 HG2 PRO 2 -3.624 -6.522 -1.212
8 HG3 PRO 2 HG1 PRO 2 -4.582 -7.953 -0.787
9 HD2 PRO 2 HD2 PRO 2 -5.671 -5.767 -1.957
10 HD3 PRO 2 HD1 PRO 2 -6.570 -6.787 -0.815
11 H CYS 3 H CYS 3 -2.413 -5.321 2.152
12 HA CYS 3 HA CYS 3 -1.628 -2.642 1.247
13 HB2 CYS 3 HB2 CYS 3 -0.023 -4.280 3.178
14 HB3 CYS 3 HB1 CYS 3 -0.166 -2.529 3.054
15 H PHE 4 H PHE 4 0.427 -2.281 0.300
16 HA PHE 4 HA PHE 4 1.841 -4.642 -0.699
17 HB2 PHE 4 HB2 PHE 4 0.527 -2.520 -2.356
18 HB3 PHE 4 HB1 PHE 4 1.995 -3.295 -2.943
19 HD1 PHE 4 HD2 PHE 4 2.015 -5.707 -3.424
20 HD2 PHE 4 HD1 PHE 4 -1.556 -3.665 -2.328
21 HE1 PHE 4 HE2 PHE 4 0.680 -7.590 -4.275
22 HE2 PHE 4 HE1 PHE 4 -2.897 -5.547 -3.176
23 HZ PHE 4 HZ PHE 4 -1.778 -7.512 -4.152
24 HA PRO 5 HA PRO 5 5.352 -2.246 0.479
25 HB2 PRO 5 HB2 PRO 5 7.252 -3.680 -0.826
26 HB3 PRO 5 HB1 PRO 5 6.462 -4.251 0.648
27 HG2 PRO 5 HG2 PRO 5 5.889 -4.958 -2.204
28 HG3 PRO 5 HG1 PRO 5 5.974 -6.016 -0.783
29 HD2 PRO 5 HD2 PRO 5 3.625 -5.163 -1.826
30 HD3 PRO 5 HD1 PRO 5 3.845 -5.467 -0.090
31 H MET 6 H MET 6 4.467 -0.450 -0.892
32 HA MET 6 HA MET 6 6.423 0.245 -2.902
33 HB2 MET 6 HB2 MET 6 3.610 -0.436 -3.575
34 HB3 MET 6 HB1 MET 6 4.309 0.964 -4.377
35 HG2 MET 6 HG2 MET 6 6.238 -0.555 -5.017
36 HG3 MET 6 HG1 MET 6 5.216 -1.891 -4.492
37 HE1 MET 6 HE1 MET 6 4.945 0.495 -8.349
38 HE2 MET 6 HE2 MET 6 5.359 1.263 -6.816
39 HE3 MET 6 HE3 MET 6 6.387 -0.014 -7.468
40 H GLY 7 H GLY 7 5.596 2.502 -3.915
41 HA2 GLY 7 HA2 GLY 7 4.767 4.655 -3.513
42 HA3 GLY 7 HA1 GLY 7 4.239 4.129 -1.922
43 HA PRO 8 HA PRO 8 8.048 6.805 -1.527
44 HB2 PRO 8 HB2 PRO 8 6.956 8.564 0.228
45 HB3 PRO 8 HB1 PRO 8 6.842 8.760 -1.524
46 HG2 PRO 8 HG2 PRO 8 4.822 7.665 0.395
47 HG3 PRO 8 HG1 PRO 8 4.584 8.775 -0.967
48 HD2 PRO 8 HD2 PRO 8 4.025 6.131 -1.129
49 HD3 PRO 8 HD1 PRO 8 4.597 7.073 -2.521
50 H TRP 9 H TRP 9 5.886 5.124 0.576
51 HA TRP 9 HA TRP 9 7.924 5.111 2.703
52 HB2 TRP 9 HB2 TRP 9 5.754 4.104 3.948
53 HB3 TRP 9 HB1 TRP 9 6.124 5.825 3.893
54 HD1 TRP 9 HD TRP 9 3.997 3.252 1.916
55 HE1 TRP 9 HE1 TRP 9 1.915 4.471 1.020
56 HE3 TRP 9 HE3 TRP 9 5.090 7.992 3.490
57 HZ2 TRP 9 HZ2 TRP 9 0.873 7.094 0.985
58 HZ3 TRP 9 HZ3 TRP 9 3.499 9.798 2.984
59 HH2 TRP 9 HH TRP 9 1.435 9.358 1.757
60 H GLY 10 H GLY 10 5.655 3.083 0.888
61 HA2 GLY 10 HA2 GLY 10 6.603 0.956 0.054
62 HA3 GLY 10 HA1 GLY 10 7.300 0.749 1.654
63 HA PRO 11 HA PRO 11 3.799 -1.613 2.834
64 HB2 PRO 11 HB2 PRO 11 3.744 -1.129 5.505
65 HB3 PRO 11 HB1 PRO 11 4.966 -2.152 4.739
66 HG2 PRO 11 HG2 PRO 11 5.156 0.711 5.591
67 HG3 PRO 11 HG1 PRO 11 6.338 -0.594 5.787
68 HD2 PRO 11 HD2 PRO 11 6.537 1.270 3.832
69 HD3 PRO 11 HD1 PRO 11 7.099 -0.400 3.619
70 H PHE 12 H PHE 12 2.257 -0.282 1.674
71 HA PHE 12 HA PHE 12 0.670 1.423 3.477
72 HB2 PHE 12 HB2 PHE 12 0.221 2.949 1.759
73 HB3 PHE 12 HB1 PHE 12 1.923 2.562 1.521
74 HD1 PHE 12 HD2 PHE 12 -1.466 2.170 0.210
75 HD2 PHE 12 HD1 PHE 12 2.653 1.275 -0.385
76 HE1 PHE 12 HE2 PHE 12 -1.948 1.512 -2.112
77 HE2 PHE 12 HE1 PHE 12 2.178 0.617 -2.708
78 HZ PHE 12 HZ PHE 12 -0.125 0.735 -3.574
79 H CYS 13 H CYS 13 -1.547 1.200 3.431
80 HA CYS 13 HA CYS 13 -2.545 -1.127 1.926
81 HB2 CYS 13 HB2 CYS 13 -3.816 0.041 4.399
82 HB3 CYS 13 HB1 CYS 13 -4.098 -1.540 3.675
83 H ILE 14 H ILE 14 -4.527 -1.004 0.868
84 HA ILE 14 HA ILE 14 -5.465 1.737 0.362
85 HB ILE 14 HB ILE 14 -6.543 0.627 -1.693
86 HG12 ILE 14 HG12 ILE 14 -4.464 -1.465 -1.017
87 HG13 ILE 14 HG11 ILE 14 -6.206 -1.698 -0.934
88 HG21 ILE 14 HG21 ILE 14 -3.695 0.430 -2.208
89 HG22 ILE 14 HG22 ILE 14 -4.879 1.579 -2.828
90 HG23 ILE 14 HG23 ILE 14 -4.109 1.862 -1.267
91 HD11 ILE 14 HD11 ILE 14 -5.206 -2.659 -2.957
92 HD12 ILE 14 HD12 ILE 14 -6.394 -1.406 -3.319
93 HD13 ILE 14 HD13 ILE 14 -4.672 -1.049 -3.438
94 HA PRO 15 HA PRO 15 -9.433 0.922 2.050
95 HB2 PRO 15 HB2 PRO 15 -11.046 2.319 0.371
96 HB3 PRO 15 HB1 PRO 15 -9.976 3.097 1.543
97 HG2 PRO 15 HG2 PRO 15 -9.571 2.652 -1.389
98 HG3 PRO 15 HG1 PRO 15 -9.223 4.095 -0.418
99 HD2 PRO 15 HD2 PRO 15 -7.300 2.335 -1.151
100 HD3 PRO 15 HD1 PRO 15 -7.238 3.236 0.378
101 H ASP 16 H ASP 16 -8.941 0.261 -1.359
102 HA ASP 16 HA ASP 16 -11.125 -1.716 -1.257
103 HB2 ASP 16 HB2 ASP 16 -11.177 0.276 -2.944
104 HB3 ASP 16 HB1 ASP 16 -9.985 -0.672 -3.828
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -8.515 -1.884 -1.328
2 HA2 GLY 1 HA2 GLY 1 -8.053 -4.765 -1.409
3 HA3 GLY 1 HA1 GLY 1 -7.084 -3.534 -2.203
4 HA PRO 2 HA PRO 2 -5.163 -5.065 1.868
5 HB2 PRO 2 HB2 PRO 2 -3.167 -6.569 0.806
6 HB3 PRO 2 HB1 PRO 2 -4.756 -7.229 1.213
7 HG2 PRO 2 HG2 PRO 2 -3.687 -6.363 -1.447
8 HG3 PRO 2 HG1 PRO 2 -4.643 -7.800 -1.039
9 HD2 PRO 2 HD2 PRO 2 -5.739 -5.590 -2.156
10 HD3 PRO 2 HD1 PRO 2 -6.629 -6.632 -1.025
11 H CYS 3 H CYS 3 -2.461 -5.200 1.974
12 HA CYS 3 HA CYS 3 -1.657 -2.540 1.018
13 HB2 CYS 3 HB2 CYS 3 -0.094 -4.051 3.069
14 HB3 CYS 3 HB1 CYS 3 -0.323 -2.315 2.892
15 H PHE 4 H PHE 4 0.514 -2.230 0.246
16 HA PHE 4 HA PHE 4 1.962 -4.619 -0.593
17 HB2 PHE 4 HB2 PHE 4 0.686 -2.636 -2.442
18 HB3 PHE 4 HB1 PHE 4 2.188 -3.423 -2.914
19 HD1 PHE 4 HD2 PHE 4 2.259 -5.809 -3.354
20 HD2 PHE 4 HD1 PHE 4 -1.376 -3.864 -2.295
21 HE1 PHE 4 HE2 PHE 4 0.988 -7.769 -4.128
22 HE2 PHE 4 HE1 PHE 4 -2.652 -5.821 -3.067
23 HZ PHE 4 HZ PHE 4 -1.470 -7.776 -3.987
24 HA PRO 5 HA PRO 5 5.397 -2.098 0.536
25 HB2 PRO 5 HB2 PRO 5 7.360 -3.536 -0.668
26 HB3 PRO 5 HB1 PRO 5 6.549 -4.068 0.810
27 HG2 PRO 5 HG2 PRO 5 6.060 -4.901 -2.023
28 HG3 PRO 5 HG1 PRO 5 6.136 -5.900 -0.561
29 HD2 PRO 5 HD2 PRO 5 3.793 -5.144 -1.689
30 HD3 PRO 5 HD1 PRO 5 3.979 -5.375 0.061
31 H MET 6 H MET 6 4.512 -0.375 -0.919
32 HA MET 6 HA MET 6 6.471 0.213 -2.983
33 HB2 MET 6 HB2 MET 6 3.602 -0.343 -3.520
34 HB3 MET 6 HB1 MET 6 4.329 1.009 -4.379
35 HG2 MET 6 HG2 MET 6 6.149 -0.598 -5.088
36 HG3 MET 6 HG1 MET 6 5.117 -1.884 -4.469
37 HE1 MET 6 HE1 MET 6 2.295 -0.632 -5.079
38 HE2 MET 6 HE2 MET 6 1.873 -1.204 -6.693
39 HE3 MET 6 HE3 MET 6 2.553 -2.323 -5.509
40 H GLY 7 H GLY 7 5.759 2.491 -3.994
41 HA2 GLY 7 HA2 GLY 7 5.190 4.711 -3.630
42 HA3 GLY 7 HA1 GLY 7 4.461 4.242 -2.101
43 HA PRO 8 HA PRO 8 8.414 6.582 -1.292
44 HB2 PRO 8 HB2 PRO 8 7.305 8.380 0.412
45 HB3 PRO 8 HB1 PRO 8 7.361 8.622 -1.338
46 HG2 PRO 8 HG2 PRO 8 5.103 7.644 0.367
47 HG3 PRO 8 HG1 PRO 8 5.070 8.798 -0.978
48 HD2 PRO 8 HD2 PRO 8 4.333 6.208 -1.263
49 HD3 PRO 8 HD1 PRO 8 5.094 7.134 -2.572
50 H TRP 9 H TRP 9 5.806 5.457 0.803
51 HA TRP 9 HA TRP 9 7.625 5.188 3.063
52 HB2 TRP 9 HB2 TRP 9 4.741 5.356 2.702
53 HB3 TRP 9 HB1 TRP 9 5.196 4.045 3.786
54 HD1 TRP 9 HD TRP 9 5.225 4.788 6.223
55 HE1 TRP 9 HE1 TRP 9 5.723 6.971 7.492
56 HE3 TRP 9 HE3 TRP 9 6.380 7.790 2.251
57 HZ2 TRP 9 HZ2 TRP 9 6.501 9.616 6.889
58 HZ3 TRP 9 HZ3 TRP 9 6.991 10.134 2.682
59 HH2 TRP 9 HH TRP 9 7.049 11.027 4.954
60 H GLY 10 H GLY 10 5.651 3.139 0.943
61 HA2 GLY 10 HA2 GLY 10 6.703 1.044 0.194
62 HA3 GLY 10 HA1 GLY 10 7.279 0.841 1.841
63 HA PRO 11 HA PRO 11 3.784 -1.701 2.624
64 HB2 PRO 11 HB2 PRO 11 3.661 -1.475 5.326
65 HB3 PRO 11 HB1 PRO 11 4.906 -2.416 4.497
66 HG2 PRO 11 HG2 PRO 11 5.061 0.353 5.623
67 HG3 PRO 11 HG1 PRO 11 6.246 -0.963 5.722
68 HD2 PRO 11 HD2 PRO 11 6.482 1.080 3.961
69 HD3 PRO 11 HD1 PRO 11 7.058 -0.560 3.602
70 H PHE 12 H PHE 12 2.359 -0.123 1.523
71 HA PHE 12 HA PHE 12 0.715 1.391 3.443
72 HB2 PHE 12 HB2 PHE 12 0.251 2.997 1.792
73 HB3 PHE 12 HB1 PHE 12 1.963 2.650 1.576
74 HD1 PHE 12 HD2 PHE 12 -1.392 2.236 0.173
75 HD2 PHE 12 HD1 PHE 12 2.766 1.517 -0.386
76 HE1 PHE 12 HE2 PHE 12 -1.807 1.692 -2.191
77 HE2 PHE 12 HE1 PHE 12 2.358 0.972 -2.750
78 HZ PHE 12 HZ PHE 12 0.069 1.060 -3.656
79 H CYS 13 H CYS 13 -1.539 1.292 3.260
80 HA CYS 13 HA CYS 13 -2.521 -1.041 1.755
81 HB2 CYS 13 HB2 CYS 13 -3.888 0.227 4.126
82 HB3 CYS 13 HB1 CYS 13 -4.180 -1.361 3.425
83 H ILE 14 H ILE 14 -4.549 -0.911 0.707
84 HA ILE 14 HA ILE 14 -5.367 1.846 0.062
85 HB ILE 14 HB ILE 14 -6.362 0.632 -2.031
86 HG12 ILE 14 HG12 ILE 14 -4.011 -1.180 -1.550
87 HG13 ILE 14 HG11 ILE 14 -5.619 -1.620 -0.987
88 HG21 ILE 14 HG21 ILE 14 -3.876 1.917 -1.452
89 HG22 ILE 14 HG22 ILE 14 -3.626 0.687 -2.691
90 HG23 ILE 14 HG23 ILE 14 -4.828 1.954 -2.936
91 HD11 ILE 14 HD11 ILE 14 -6.417 -1.345 -3.339
92 HD12 ILE 14 HD12 ILE 14 -4.730 -1.158 -3.818
93 HD13 ILE 14 HD13 ILE 14 -5.276 -2.665 -3.084
94 HA PRO 15 HA PRO 15 -9.455 1.080 1.462
95 HB2 PRO 15 HB2 PRO 15 -10.950 2.398 -0.381
96 HB3 PRO 15 HB1 PRO 15 -9.968 3.229 0.832
97 HG2 PRO 15 HG2 PRO 15 -9.354 2.670 -2.045
98 HG3 PRO 15 HG1 PRO 15 -9.082 4.152 -1.111
99 HD2 PRO 15 HD2 PRO 15 -7.106 2.377 -1.635
100 HD3 PRO 15 HD1 PRO 15 -7.155 3.339 -0.143
101 H ASP 16 H ASP 16 -10.056 -1.020 1.323
102 HA ASP 16 HA ASP 16 -11.136 -2.875 0.564
103 HB2 ASP 16 HB2 ASP 16 -12.645 -0.915 -0.396
104 HB3 ASP 16 HB1 ASP 16 -12.031 -1.513 -1.935