Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
603942 | 2nb5 RC | 25962 | 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 -10.843 -2.034 -2.218
2 HA2 GLY 1 HA2 GLY 1 -11.407 -2.111 0.476
3 HA3 GLY 1 HA1 GLY 1 -12.469 -3.312 -0.245
4 H ASP 2 H ASP 2 -9.100 -2.365 -0.909
5 HA ASP 2 HA ASP 2 -8.097 -4.875 0.093
6 HB2 ASP 2 HB2 ASP 2 -7.051 -5.495 -2.114
7 HB3 ASP 2 HB1 ASP 2 -8.801 -5.687 -2.044
8 H CYS 3 H CYS 3 -5.772 -4.972 0.112
9 HA CYS 3 HA CYS 3 -4.465 -2.376 -0.361
10 HB2 CYS 3 HB2 CYS 3 -3.836 -4.179 1.977
11 HB3 CYS 3 HB1 CYS 3 -3.267 -2.535 1.701
12 H TYR 4 H TYR 4 -1.994 -2.650 -0.243
13 HA TYR 4 HA TYR 4 -1.065 -5.243 -1.184
14 HB2 TYR 4 HB2 TYR 4 0.085 -4.109 -3.146
15 HB3 TYR 4 HB1 TYR 4 -1.658 -4.309 -3.282
16 HD1 TYR 4 HD1 TYR 4 -3.153 -2.345 -2.956
17 HD2 TYR 4 HD2 TYR 4 1.080 -1.946 -3.118
18 HE1 TYR 4 HE1 TYR 4 -3.402 0.066 -3.375
19 HE2 TYR 4 HE2 TYR 4 0.843 0.466 -3.537
20 HH TYR 4 HH TYR 4 -2.192 1.912 -4.280
21 H TRP 5 H TRP 5 1.237 -5.457 -1.166
22 HA TRP 5 HA TRP 5 2.472 -3.780 0.858
23 HB2 TRP 5 HB2 TRP 5 2.891 -6.049 1.256
24 HB3 TRP 5 HB1 TRP 5 3.191 -6.390 -0.446
25 HD1 TRP 5 HD TRP 5 5.658 -6.610 -1.092
26 HE1 TRP 5 HE1 TRP 5 7.906 -5.938 -0.036
27 HE3 TRP 5 HE3 TRP 5 3.912 -3.999 2.942
28 HZ2 TRP 5 HZ2 TRP 5 8.820 -4.492 2.211
29 HZ3 TRP 5 HZ3 TRP 5 5.539 -3.004 4.496
30 HH2 TRP 5 HH TRP 5 7.941 -3.246 4.137
31 H THR 6 H THR 6 4.339 -2.576 0.586
32 HA THR 6 HA THR 6 5.481 -2.356 -2.093
33 HB THR 6 HB THR 6 5.347 0.104 -2.072
34 HG1 THR 6 HG1 THR 6 4.837 1.017 -0.241
35 HG21 THR 6 HG21 THR 6 3.488 -1.542 -2.972
36 HG22 THR 6 HG22 THR 6 3.241 0.204 -2.983
37 HG23 THR 6 HG23 THR 6 2.525 -0.780 -1.708
38 H SER 7 H SER 7 7.548 -1.329 -2.145
39 HA SER 7 HA SER 7 9.091 -1.825 0.223
40 HB2 SER 7 HB2 SER 7 9.752 -2.085 -2.311
41 HB3 SER 7 HB1 SER 7 10.210 -0.390 -2.156
42 HG SER 7 HG SER 7 12.006 -1.475 -1.585
43 H THR 8 H THR 8 8.780 1.089 -1.815
44 HA THR 8 HA THR 8 9.871 2.817 0.152
45 HB THR 8 HB THR 8 9.092 4.657 -1.290
46 HG1 THR 8 HG1 THR 8 7.646 4.326 -2.840
47 HG21 THR 8 HG21 THR 8 10.581 2.329 -2.398
48 HG22 THR 8 HG22 THR 8 11.136 3.969 -2.063
49 HG23 THR 8 HG23 THR 8 10.154 3.644 -3.492
50 HA PRO 9 HA PRO 9 6.429 3.725 2.724
51 HB2 PRO 9 HB2 PRO 9 6.937 6.313 3.366
52 HB3 PRO 9 HB1 PRO 9 7.875 4.962 4.011
53 HG2 PRO 9 HG2 PRO 9 8.524 6.807 1.744
54 HG3 PRO 9 HG1 PRO 9 9.579 6.211 3.039
55 HD2 PRO 9 HD2 PRO 9 9.593 5.155 0.545
56 HD3 PRO 9 HD1 PRO 9 9.926 4.186 1.994
57 HA PRO 10 HA PRO 10 4.714 4.336 3.767
58 HB2 PRO 10 HB2 PRO 10 2.215 3.369 3.333
59 HB3 PRO 10 HB1 PRO 10 2.525 5.029 3.854
60 HG2 PRO 10 HG2 PRO 10 1.947 3.981 1.110
61 HG3 PRO 10 HG1 PRO 10 1.317 5.433 1.909
62 HD2 PRO 10 HD2 PRO 10 3.328 5.523 0.098
63 HD3 PRO 10 HD1 PRO 10 3.216 6.658 1.458
64 H PHE 11 H PHE 11 5.178 2.273 4.316
65 HA PHE 11 HA PHE 11 5.995 0.423 2.371
66 HB2 PHE 11 HB2 PHE 11 5.254 -0.270 5.214
67 HB3 PHE 11 HB1 PHE 11 6.422 -1.079 4.176
68 HD1 PHE 11 HD2 PHE 11 7.938 1.187 3.096
69 HD2 PHE 11 HD1 PHE 11 6.476 0.477 7.030
70 HE1 PHE 11 HE2 PHE 11 9.731 2.599 4.014
71 HE2 PHE 11 HE1 PHE 11 8.266 1.890 7.954
72 HZ PHE 11 HZ PHE 11 9.898 2.952 6.446
73 H PHE 12 H PHE 12 2.924 0.995 3.862
74 HA PHE 12 HA PHE 12 1.791 -1.216 2.296
75 HB2 PHE 12 HB2 PHE 12 2.013 -1.655 4.843
76 HB3 PHE 12 HB1 PHE 12 0.682 -0.512 4.998
77 HD1 PHE 12 HD1 PHE 12 1.644 -3.633 3.217
78 HD2 PHE 12 HD2 PHE 12 -1.497 -1.264 4.839
79 HE1 PHE 12 HE1 PHE 12 0.044 -5.444 2.754
80 HE2 PHE 12 HE2 PHE 12 -3.103 -3.071 4.379
81 HZ PHE 12 HZ PHE 12 -2.332 -5.165 3.337
82 H THR 13 H THR 13 0.159 -0.613 1.031
83 HA THR 13 HA THR 13 -1.256 1.893 1.670
84 HB THR 13 HB THR 13 -0.454 0.907 -1.074
85 HG1 THR 13 HG1 THR 13 1.269 2.041 -0.612
86 HG21 THR 13 HG21 THR 13 -2.350 3.000 -0.150
87 HG22 THR 13 HG22 THR 13 -2.400 1.984 -1.591
88 HG23 THR 13 HG23 THR 13 -1.325 3.380 -1.533
89 H CYS 14 H CYS 14 -3.453 1.965 1.277
90 HA CYS 14 HA CYS 14 -4.701 -0.590 0.499
91 HB2 CYS 14 HB2 CYS 14 -5.493 1.379 2.642
92 HB3 CYS 14 HB1 CYS 14 -6.616 0.179 2.009
93 H THR 15 H THR 15 -7.021 -0.283 -0.229
94 HA THR 15 HA THR 15 -7.277 2.196 -1.802
95 HB THR 15 HB THR 15 -8.363 0.891 -3.587
96 HG1 THR 15 HG1 THR 15 -8.987 -1.066 -3.110
97 HG21 THR 15 HG21 THR 15 -5.865 1.333 -3.519
98 HG22 THR 15 HG22 THR 15 -6.389 -0.001 -4.547
99 HG23 THR 15 HG23 THR 15 -5.682 -0.332 -2.966
100 HA PRO 16 HA PRO 16 -11.289 2.688 -0.084
101 HB2 PRO 16 HB2 PRO 16 -12.577 3.921 -2.130
102 HB3 PRO 16 HB1 PRO 16 -11.356 4.728 -1.139
103 HG2 PRO 16 HG2 PRO 16 -11.077 3.483 -3.848
104 HG3 PRO 16 HG1 PRO 16 -10.421 5.017 -3.248
105 HD2 PRO 16 HD2 PRO 16 -8.927 2.767 -3.432
106 HD3 PRO 16 HD1 PRO 16 -8.660 3.990 -2.173
107 H ASP 17 H ASP 17 -10.818 0.863 -2.973
108 HA ASP 17 HA ASP 17 -13.502 0.034 -3.391
109 HB2 ASP 17 HB2 ASP 17 -10.829 -1.010 -4.293
110 HB3 ASP 17 HB1 ASP 17 -12.313 -1.891 -4.647
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -10.791 -2.032 -2.225
2 HA2 GLY 1 HA2 GLY 1 -11.477 -2.151 0.429
3 HA3 GLY 1 HA1 GLY 1 -12.500 -3.352 -0.343
4 H ASP 2 H ASP 2 -9.122 -2.395 -0.916
5 HA ASP 2 HA ASP 2 -8.117 -4.868 0.160
6 HB2 ASP 2 HB2 ASP 2 -8.302 -4.420 -2.802
7 HB3 ASP 2 HB1 ASP 2 -6.980 -5.373 -2.133
8 H CYS 3 H CYS 3 -5.778 -4.964 0.154
9 HA CYS 3 HA CYS 3 -4.499 -2.361 -0.346
10 HB2 CYS 3 HB2 CYS 3 -3.826 -4.151 1.989
11 HB3 CYS 3 HB1 CYS 3 -3.280 -2.502 1.704
12 H TYR 4 H TYR 4 -2.024 -2.609 -0.254
13 HA TYR 4 HA TYR 4 -1.090 -5.196 -1.219
14 HB2 TYR 4 HB2 TYR 4 0.057 -4.035 -3.165
15 HB3 TYR 4 HB1 TYR 4 -1.688 -4.228 -3.301
16 HD1 TYR 4 HD1 TYR 4 -3.175 -2.264 -2.941
17 HD2 TYR 4 HD2 TYR 4 1.058 -1.877 -3.108
18 HE1 TYR 4 HE1 TYR 4 -3.418 0.154 -3.322
19 HE2 TYR 4 HE2 TYR 4 0.829 0.542 -3.488
20 HH TYR 4 HH TYR 4 -2.269 2.019 -4.096
21 H TRP 5 H TRP 5 1.207 -5.417 -1.195
22 HA TRP 5 HA TRP 5 2.446 -3.753 0.839
23 HB2 TRP 5 HB2 TRP 5 2.844 -6.025 1.241
24 HB3 TRP 5 HB1 TRP 5 3.150 -6.369 -0.459
25 HD1 TRP 5 HD TRP 5 5.617 -6.609 -1.094
26 HE1 TRP 5 HE1 TRP 5 7.867 -5.954 -0.031
27 HE3 TRP 5 HE3 TRP 5 3.875 -3.981 2.929
28 HZ2 TRP 5 HZ2 TRP 5 8.781 -4.513 2.218
29 HZ3 TRP 5 HZ3 TRP 5 5.504 -2.997 4.489
30 HH2 TRP 5 HH TRP 5 7.905 -3.258 4.139
31 H THR 6 H THR 6 4.325 -2.566 0.573
32 HA THR 6 HA THR 6 5.478 -2.357 -2.102
33 HB THR 6 HB THR 6 5.362 0.103 -2.087
34 HG1 THR 6 HG1 THR 6 4.846 1.028 -0.264
35 HG21 THR 6 HG21 THR 6 2.527 -0.734 -1.733
36 HG22 THR 6 HG22 THR 6 3.486 -1.545 -2.973
37 HG23 THR 6 HG23 THR 6 3.274 0.205 -3.024
38 H SER 7 H SER 7 7.551 -1.341 -2.148
39 HA SER 7 HA SER 7 9.082 -1.846 0.226
40 HB2 SER 7 HB2 SER 7 9.849 -2.240 -2.177
41 HB3 SER 7 HB1 SER 7 10.083 -0.495 -2.281
42 HG SER 7 HG SER 7 11.945 -1.861 -1.614
43 H THR 8 H THR 8 8.800 1.067 -1.816
44 HA THR 8 HA THR 8 9.896 2.791 0.151
45 HB THR 8 HB THR 8 9.131 4.634 -1.295
46 HG1 THR 8 HG1 THR 8 7.790 2.521 -2.645
47 HG21 THR 8 HG21 THR 8 10.146 2.620 -3.232
48 HG22 THR 8 HG22 THR 8 11.127 2.958 -1.806
49 HG23 THR 8 HG23 THR 8 10.702 4.262 -2.914
50 HA PRO 9 HA PRO 9 6.453 3.725 2.714
51 HB2 PRO 9 HB2 PRO 9 6.977 6.311 3.355
52 HB3 PRO 9 HB1 PRO 9 7.905 4.953 4.003
53 HG2 PRO 9 HG2 PRO 9 8.570 6.791 1.736
54 HG3 PRO 9 HG1 PRO 9 9.619 6.189 3.033
55 HD2 PRO 9 HD2 PRO 9 9.631 5.131 0.540
56 HD3 PRO 9 HD1 PRO 9 9.955 4.161 1.992
57 HA PRO 10 HA PRO 10 4.739 4.342 3.750
58 HB2 PRO 10 HB2 PRO 10 2.236 3.389 3.308
59 HB3 PRO 10 HB1 PRO 10 2.554 5.047 3.831
60 HG2 PRO 10 HG2 PRO 10 1.979 4.004 1.085
61 HG3 PRO 10 HG1 PRO 10 1.354 5.459 1.881
62 HD2 PRO 10 HD2 PRO 10 3.370 5.539 0.077
63 HD3 PRO 10 HD1 PRO 10 3.261 6.674 1.437
64 H PHE 11 H PHE 11 5.190 2.277 4.300
65 HA PHE 11 HA PHE 11 6.001 0.423 2.357
66 HB2 PHE 11 HB2 PHE 11 5.250 -0.267 5.198
67 HB3 PHE 11 HB1 PHE 11 6.417 -1.082 4.163
68 HD1 PHE 11 HD2 PHE 11 7.949 1.175 3.089
69 HD2 PHE 11 HD1 PHE 11 6.467 0.477 7.018
70 HE1 PHE 11 HE2 PHE 11 9.746 2.578 4.012
71 HE2 PHE 11 HE1 PHE 11 8.262 1.880 7.948
72 HZ PHE 11 HZ PHE 11 9.906 2.932 6.444
73 H PHE 12 H PHE 12 2.940 0.965 3.911
74 HA PHE 12 HA PHE 12 1.792 -1.216 2.310
75 HB2 PHE 12 HB2 PHE 12 2.027 -1.704 4.837
76 HB3 PHE 12 HB1 PHE 12 0.724 -0.536 5.038
77 HD1 PHE 12 HD1 PHE 12 1.573 -3.612 3.116
78 HD2 PHE 12 HD2 PHE 12 -1.457 -1.270 4.974
79 HE1 PHE 12 HE1 PHE 12 -0.074 -5.380 2.651
80 HE2 PHE 12 HE2 PHE 12 -3.109 -3.035 4.512
81 HZ PHE 12 HZ PHE 12 -2.418 -5.093 3.349
82 H THR 13 H THR 13 0.165 -0.588 1.053
83 HA THR 13 HA THR 13 -1.258 1.901 1.738
84 HB THR 13 HB THR 13 -0.449 0.973 -1.025
85 HG1 THR 13 HG1 THR 13 0.903 2.770 -0.967
86 HG21 THR 13 HG21 THR 13 -2.180 3.244 -0.079
87 HG22 THR 13 HG22 THR 13 -2.538 2.021 -1.299
88 HG23 THR 13 HG23 THR 13 -1.356 3.286 -1.637
89 H CYS 14 H CYS 14 -3.454 1.974 1.341
90 HA CYS 14 HA CYS 14 -4.692 -0.576 0.529
91 HB2 CYS 14 HB2 CYS 14 -5.509 1.387 2.669
92 HB3 CYS 14 HB1 CYS 14 -6.621 0.185 2.023
93 H THR 15 H THR 15 -7.057 -0.222 -0.145
94 HA THR 15 HA THR 15 -7.304 2.258 -1.712
95 HB THR 15 HB THR 15 -8.323 0.975 -3.553
96 HG1 THR 15 HG1 THR 15 -7.902 -1.124 -1.751
97 HG21 THR 15 HG21 THR 15 -5.725 1.370 -3.159
98 HG22 THR 15 HG22 THR 15 -6.327 0.456 -4.543
99 HG23 THR 15 HG23 THR 15 -5.718 -0.393 -3.122
100 HA PRO 16 HA PRO 16 -11.361 2.609 -0.065
101 HB2 PRO 16 HB2 PRO 16 -12.636 3.866 -2.106
102 HB3 PRO 16 HB1 PRO 16 -11.455 4.674 -1.069
103 HG2 PRO 16 HG2 PRO 16 -11.092 3.508 -3.802
104 HG3 PRO 16 HG1 PRO 16 -10.486 5.041 -3.150
105 HD2 PRO 16 HD2 PRO 16 -8.933 2.833 -3.360
106 HD3 PRO 16 HD1 PRO 16 -8.722 4.028 -2.065
107 H ASP 17 H ASP 17 -10.784 0.869 -2.986
108 HA ASP 17 HA ASP 17 -13.429 -0.003 -3.511
109 HB2 ASP 17 HB2 ASP 17 -10.701 -0.953 -4.323
110 HB3 ASP 17 HB1 ASP 17 -12.120 -1.927 -4.698
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -10.856 -2.055 -2.213
2 HA2 GLY 1 HA2 GLY 1 -11.397 -2.097 0.499
3 HA3 GLY 1 HA1 GLY 1 -12.461 -3.301 -0.214
4 H ASP 2 H ASP 2 -9.105 -2.369 -0.943
5 HA ASP 2 HA ASP 2 -8.097 -4.878 0.075
6 HB2 ASP 2 HB2 ASP 2 -8.310 -4.316 -2.865
7 HB3 ASP 2 HB1 ASP 2 -6.984 -5.297 -2.246
8 H CYS 3 H CYS 3 -5.775 -4.975 0.102
9 HA CYS 3 HA CYS 3 -4.465 -2.381 -0.365
10 HB2 CYS 3 HB2 CYS 3 -3.841 -4.187 1.972
11 HB3 CYS 3 HB1 CYS 3 -3.272 -2.543 1.699
12 H TYR 4 H TYR 4 -1.993 -2.657 -0.243
13 HA TYR 4 HA TYR 4 -1.065 -5.251 -1.182
14 HB2 TYR 4 HB2 TYR 4 0.086 -4.120 -3.146
15 HB3 TYR 4 HB1 TYR 4 -1.657 -4.319 -3.283
16 HD1 TYR 4 HD1 TYR 4 -3.151 -2.355 -2.960
17 HD2 TYR 4 HD2 TYR 4 1.082 -1.958 -3.122
18 HE1 TYR 4 HE1 TYR 4 -3.400 0.056 -3.383
19 HE2 TYR 4 HE2 TYR 4 0.846 0.454 -3.544
20 HH TYR 4 HH TYR 4 -0.876 1.999 -4.472
21 H TRP 5 H TRP 5 1.238 -5.464 -1.165
22 HA TRP 5 HA TRP 5 2.471 -3.784 0.858
23 HB2 TRP 5 HB2 TRP 5 2.893 -6.052 1.256
24 HB3 TRP 5 HB1 TRP 5 3.194 -6.393 -0.446
25 HD1 TRP 5 HD TRP 5 5.661 -6.610 -1.093
26 HE1 TRP 5 HE1 TRP 5 7.910 -5.934 -0.038
27 HE3 TRP 5 HE3 TRP 5 3.913 -4.002 2.942
28 HZ2 TRP 5 HZ2 TRP 5 8.821 -4.488 2.208
29 HZ3 TRP 5 HZ3 TRP 5 5.539 -3.004 4.496
30 HH2 TRP 5 HH TRP 5 7.941 -3.244 4.136
31 H THR 6 H THR 6 4.336 -2.576 0.586
32 HA THR 6 HA THR 6 5.477 -2.354 -2.094
33 HB THR 6 HB THR 6 5.340 0.105 -2.071
34 HG1 THR 6 HG1 THR 6 4.216 1.160 -0.490
35 HG21 THR 6 HG21 THR 6 3.236 0.201 -2.983
36 HG22 THR 6 HG22 THR 6 2.518 -0.778 -1.704
37 HG23 THR 6 HG23 THR 6 3.482 -1.544 -2.965
38 H SER 7 H SER 7 7.541 -1.321 -2.145
39 HA SER 7 HA SER 7 9.088 -1.820 0.220
40 HB2 SER 7 HB2 SER 7 10.285 -2.356 -1.697
41 HB3 SER 7 HB1 SER 7 9.701 -0.946 -2.581
42 HG SER 7 HG SER 7 11.737 -1.119 -0.647
43 H THR 8 H THR 8 8.772 1.096 -1.815
44 HA THR 8 HA THR 8 9.864 2.822 0.152
45 HB THR 8 HB THR 8 9.082 4.664 -1.287
46 HG1 THR 8 HG1 THR 8 7.262 4.166 -2.288
47 HG21 THR 8 HG21 THR 8 10.601 4.286 -2.982
48 HG22 THR 8 HG22 THR 8 10.130 2.596 -3.173
49 HG23 THR 8 HG23 THR 8 11.114 3.088 -1.794
50 HA PRO 9 HA PRO 9 6.421 3.727 2.726
51 HB2 PRO 9 HB2 PRO 9 6.926 6.316 3.370
52 HB3 PRO 9 HB1 PRO 9 7.866 4.964 4.014
53 HG2 PRO 9 HG2 PRO 9 8.512 6.811 1.748
54 HG3 PRO 9 HG1 PRO 9 9.568 6.215 3.042
55 HD2 PRO 9 HD2 PRO 9 9.582 5.161 0.548
56 HD3 PRO 9 HD1 PRO 9 9.917 4.191 1.996
57 HA PRO 10 HA PRO 10 4.706 4.335 3.770
58 HB2 PRO 10 HB2 PRO 10 2.208 3.365 3.336
59 HB3 PRO 10 HB1 PRO 10 2.516 5.026 3.859
60 HG2 PRO 10 HG2 PRO 10 1.938 3.979 1.114
61 HG3 PRO 10 HG1 PRO 10 1.307 5.430 1.914
62 HD2 PRO 10 HD2 PRO 10 3.317 5.524 0.102
63 HD3 PRO 10 HD1 PRO 10 3.205 6.658 1.463
64 H PHE 11 H PHE 11 5.173 2.272 4.318
65 HA PHE 11 HA PHE 11 5.989 0.424 2.371
66 HB2 PHE 11 HB2 PHE 11 5.250 -0.270 5.214
67 HB3 PHE 11 HB1 PHE 11 6.419 -1.079 4.175
68 HD1 PHE 11 HD2 PHE 11 7.931 1.189 3.097
69 HD2 PHE 11 HD1 PHE 11 6.472 0.476 7.031
70 HE1 PHE 11 HE2 PHE 11 9.724 2.603 4.015
71 HE2 PHE 11 HE1 PHE 11 8.262 1.889 7.955
72 HZ PHE 11 HZ PHE 11 9.891 2.954 6.447
73 H PHE 12 H PHE 12 2.919 0.993 3.865
74 HA PHE 12 HA PHE 12 1.788 -1.221 2.298
75 HB2 PHE 12 HB2 PHE 12 2.006 -1.659 4.845
76 HB3 PHE 12 HB1 PHE 12 0.679 -0.513 5.001
77 HD1 PHE 12 HD1 PHE 12 1.642 -3.662 3.280
78 HD2 PHE 12 HD2 PHE 12 -1.513 -1.233 4.786
79 HE1 PHE 12 HE1 PHE 12 0.037 -5.468 2.820
80 HE2 PHE 12 HE2 PHE 12 -3.123 -3.037 4.330
81 HZ PHE 12 HZ PHE 12 -2.350 -5.157 3.345
82 H THR 13 H THR 13 0.163 -0.616 1.027
83 HA THR 13 HA THR 13 -1.254 1.890 1.661
84 HB THR 13 HB THR 13 -0.454 0.894 -1.080
85 HG1 THR 13 HG1 THR 13 1.291 1.968 -0.501
86 HG21 THR 13 HG21 THR 13 -1.351 3.202 -1.738
87 HG22 THR 13 HG22 THR 13 -2.184 3.183 -0.184
88 HG23 THR 13 HG23 THR 13 -2.532 1.943 -1.388
89 H CYS 14 H CYS 14 -3.451 1.962 1.267
90 HA CYS 14 HA CYS 14 -4.702 -0.591 0.490
91 HB2 CYS 14 HB2 CYS 14 -5.489 1.369 2.642
92 HB3 CYS 14 HB1 CYS 14 -6.610 0.167 2.010
93 H THR 15 H THR 15 -6.993 -0.310 -0.273
94 HA THR 15 HA THR 15 -7.259 2.181 -1.829
95 HB THR 15 HB THR 15 -8.363 0.876 -3.605
96 HG1 THR 15 HG1 THR 15 -7.898 -1.520 -3.373
97 HG21 THR 15 HG21 THR 15 -6.393 -0.083 -4.553
98 HG22 THR 15 HG22 THR 15 -5.669 -0.316 -2.961
99 HG23 THR 15 HG23 THR 15 -5.887 1.312 -3.601
100 HA PRO 16 HA PRO 16 -11.260 2.704 -0.092
101 HB2 PRO 16 HB2 PRO 16 -12.550 3.939 -2.137
102 HB3 PRO 16 HB1 PRO 16 -11.318 4.740 -1.153
103 HG2 PRO 16 HG2 PRO 16 -11.061 3.484 -3.859
104 HG3 PRO 16 HG1 PRO 16 -10.394 5.018 -3.269
105 HD2 PRO 16 HD2 PRO 16 -8.913 2.757 -3.452
106 HD3 PRO 16 HD1 PRO 16 -8.633 3.982 -2.199
107 H ASP 17 H ASP 17 -10.804 0.849 -2.959
108 HA ASP 17 HA ASP 17 -13.500 0.040 -3.363
109 HB2 ASP 17 HB2 ASP 17 -10.944 -1.356 -4.185
110 HB3 ASP 17 HB1 ASP 17 -12.552 -1.687 -4.821
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -10.865 -2.054 -2.212
2 HA2 GLY 1 HA2 GLY 1 -11.384 -2.098 0.505
3 HA3 GLY 1 HA1 GLY 1 -12.453 -3.299 -0.204
4 H ASP 2 H ASP 2 -9.100 -2.366 -0.946
5 HA ASP 2 HA ASP 2 -8.092 -4.881 0.054
6 HB2 ASP 2 HB2 ASP 2 -8.311 -4.296 -2.881
7 HB3 ASP 2 HB1 ASP 2 -6.984 -5.284 -2.274
8 H CYS 3 H CYS 3 -5.775 -4.977 0.091
9 HA CYS 3 HA CYS 3 -4.459 -2.384 -0.373
10 HB2 CYS 3 HB2 CYS 3 -3.844 -4.191 1.967
11 HB3 CYS 3 HB1 CYS 3 -3.272 -2.548 1.696
12 H TYR 4 H TYR 4 -1.988 -2.665 -0.244
13 HA TYR 4 HA TYR 4 -1.058 -5.261 -1.174
14 HB2 TYR 4 HB2 TYR 4 0.094 -4.136 -3.141
15 HB3 TYR 4 HB1 TYR 4 -1.649 -4.337 -3.279
16 HD1 TYR 4 HD1 TYR 4 -3.143 -2.371 -2.965
17 HD2 TYR 4 HD2 TYR 4 1.090 -1.974 -3.120
18 HE1 TYR 4 HE1 TYR 4 -3.390 0.038 -3.398
19 HE2 TYR 4 HE2 TYR 4 0.856 0.435 -3.552
20 HH TYR 4 HH TYR 4 -2.315 1.915 -4.026
21 H TRP 5 H TRP 5 1.246 -5.471 -1.158
22 HA TRP 5 HA TRP 5 2.476 -3.789 0.864
23 HB2 TRP 5 HB2 TRP 5 2.901 -6.056 1.265
24 HB3 TRP 5 HB1 TRP 5 3.202 -6.397 -0.436
25 HD1 TRP 5 HD TRP 5 5.669 -6.611 -1.083
26 HE1 TRP 5 HE1 TRP 5 7.916 -5.933 -0.027
27 HE3 TRP 5 HE3 TRP 5 3.917 -4.002 2.949
28 HZ2 TRP 5 HZ2 TRP 5 8.825 -4.482 2.217
29 HZ3 TRP 5 HZ3 TRP 5 5.541 -3.001 4.502
30 HH2 TRP 5 HH TRP 5 7.944 -3.238 4.143
31 H THR 6 H THR 6 4.339 -2.578 0.592
32 HA THR 6 HA THR 6 5.481 -2.357 -2.087
33 HB THR 6 HB THR 6 5.341 0.102 -2.067
34 HG1 THR 6 HG1 THR 6 3.623 0.876 -0.487
35 HG21 THR 6 HG21 THR 6 3.237 0.196 -2.980
36 HG22 THR 6 HG22 THR 6 2.520 -0.784 -1.701
37 HG23 THR 6 HG23 THR 6 3.485 -1.549 -2.962
38 H SER 7 H SER 7 7.545 -1.324 -2.139
39 HA SER 7 HA SER 7 9.091 -1.818 0.227
40 HB2 SER 7 HB2 SER 7 10.147 -2.357 -1.838
41 HB3 SER 7 HB1 SER 7 9.789 -0.769 -2.517
42 HG SER 7 HG SER 7 11.652 -1.436 -0.496
43 H THR 8 H THR 8 8.772 1.095 -1.811
44 HA THR 8 HA THR 8 9.861 2.825 0.155
45 HB THR 8 HB THR 8 9.079 4.664 -1.288
46 HG1 THR 8 HG1 THR 8 7.325 4.239 -2.394
47 HG21 THR 8 HG21 THR 8 11.089 4.072 -2.147
48 HG22 THR 8 HG22 THR 8 10.107 3.527 -3.507
49 HG23 THR 8 HG23 THR 8 10.646 2.372 -2.289
50 HA PRO 9 HA PRO 9 6.416 3.730 2.725
51 HB2 PRO 9 HB2 PRO 9 6.919 6.319 3.366
52 HB3 PRO 9 HB1 PRO 9 7.859 4.970 4.012
53 HG2 PRO 9 HG2 PRO 9 8.505 6.815 1.745
54 HG3 PRO 9 HG1 PRO 9 9.561 6.221 3.040
55 HD2 PRO 9 HD2 PRO 9 9.577 5.165 0.547
56 HD3 PRO 9 HD1 PRO 9 9.912 4.196 1.996
57 HA PRO 10 HA PRO 10 4.700 4.338 3.767
58 HB2 PRO 10 HB2 PRO 10 2.202 3.366 3.334
59 HB3 PRO 10 HB1 PRO 10 2.510 5.027 3.854
60 HG2 PRO 10 HG2 PRO 10 1.934 3.976 1.110
61 HG3 PRO 10 HG1 PRO 10 1.301 5.428 1.908
62 HD2 PRO 10 HD2 PRO 10 3.312 5.520 0.096
63 HD3 PRO 10 HD1 PRO 10 3.198 6.656 1.457
64 H PHE 11 H PHE 11 5.167 2.275 4.319
65 HA PHE 11 HA PHE 11 5.987 0.426 2.375
66 HB2 PHE 11 HB2 PHE 11 5.246 -0.266 5.218
67 HB3 PHE 11 HB1 PHE 11 6.416 -1.075 4.182
68 HD1 PHE 11 HD2 PHE 11 7.928 1.194 3.101
69 HD2 PHE 11 HD1 PHE 11 6.468 0.482 7.035
70 HE1 PHE 11 HE2 PHE 11 9.718 2.610 4.017
71 HE2 PHE 11 HE1 PHE 11 8.256 1.898 7.958
72 HZ PHE 11 HZ PHE 11 9.884 2.965 6.449
73 H PHE 12 H PHE 12 2.915 0.996 3.862
74 HA PHE 12 HA PHE 12 1.788 -1.223 2.300
75 HB2 PHE 12 HB2 PHE 12 1.997 -1.678 4.832
76 HB3 PHE 12 HB1 PHE 12 0.700 -0.502 5.011
77 HD1 PHE 12 HD1 PHE 12 1.556 -3.632 3.191
78 HD2 PHE 12 HD2 PHE 12 -1.498 -1.199 4.884
79 HE1 PHE 12 HE1 PHE 12 -0.097 -5.398 2.739
80 HE2 PHE 12 HE2 PHE 12 -3.156 -2.960 4.435
81 HZ PHE 12 HZ PHE 12 -2.456 -5.064 3.361
82 H THR 13 H THR 13 0.168 -0.619 1.021
83 HA THR 13 HA THR 13 -1.251 1.888 1.646
84 HB THR 13 HB THR 13 -0.450 0.880 -1.091
85 HG1 THR 13 HG1 THR 13 0.302 3.331 0.116
86 HG21 THR 13 HG21 THR 13 -2.145 3.210 -0.216
87 HG22 THR 13 HG22 THR 13 -2.551 1.931 -1.360
88 HG23 THR 13 HG23 THR 13 -1.355 3.153 -1.791
89 H CYS 14 H CYS 14 -3.447 1.960 1.249
90 HA CYS 14 HA CYS 14 -4.700 -0.595 0.480
91 HB2 CYS 14 HB2 CYS 14 -5.484 1.368 2.631
92 HB3 CYS 14 HB1 CYS 14 -6.607 0.169 2.001
93 H THR 15 H THR 15 -7.000 -0.304 -0.269
94 HA THR 15 HA THR 15 -7.263 2.181 -1.833
95 HB THR 15 HB THR 15 -8.375 0.874 -3.602
96 HG1 THR 15 HG1 THR 15 -8.212 -1.435 -3.474
97 HG21 THR 15 HG21 THR 15 -6.421 0.359 -4.631
98 HG22 THR 15 HG22 THR 15 -5.841 -0.611 -3.276
99 HG23 THR 15 HG23 THR 15 -5.724 1.148 -3.218
100 HA PRO 16 HA PRO 16 -11.258 2.714 -0.086
101 HB2 PRO 16 HB2 PRO 16 -12.552 3.948 -2.129
102 HB3 PRO 16 HB1 PRO 16 -11.316 4.749 -1.152
103 HG2 PRO 16 HG2 PRO 16 -11.069 3.487 -3.855
104 HG3 PRO 16 HG1 PRO 16 -10.397 5.020 -3.271
105 HD2 PRO 16 HD2 PRO 16 -8.921 2.757 -3.452
106 HD3 PRO 16 HD1 PRO 16 -8.635 3.984 -2.202
107 H ASP 17 H ASP 17 -10.813 0.853 -2.950
108 HA ASP 17 HA ASP 17 -13.513 0.046 -3.341
109 HB2 ASP 17 HB2 ASP 17 -10.875 -1.106 -4.243
110 HB3 ASP 17 HB1 ASP 17 -12.420 -1.840 -4.663
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -10.827 -1.972 -2.208
2 HA2 GLY 1 HA2 GLY 1 -11.401 -2.114 0.459
3 HA3 GLY 1 HA1 GLY 1 -12.469 -3.308 -0.264
4 H ASP 2 H ASP 2 -9.090 -2.352 -0.876
5 HA ASP 2 HA ASP 2 -8.093 -4.875 0.082
6 HB2 ASP 2 HB2 ASP 2 -8.899 -5.537 -2.142
7 HB3 ASP 2 HB1 ASP 2 -7.937 -4.257 -2.876
8 H CYS 3 H CYS 3 -5.773 -4.973 0.109
9 HA CYS 3 HA CYS 3 -4.459 -2.379 -0.357
10 HB2 CYS 3 HB2 CYS 3 -3.838 -4.187 1.980
11 HB3 CYS 3 HB1 CYS 3 -3.268 -2.543 1.708
12 H TYR 4 H TYR 4 -1.989 -2.658 -0.235
13 HA TYR 4 HA TYR 4 -1.061 -5.252 -1.172
14 HB2 TYR 4 HB2 TYR 4 0.088 -4.121 -3.139
15 HB3 TYR 4 HB1 TYR 4 -1.654 -4.323 -3.274
16 HD1 TYR 4 HD1 TYR 4 -3.150 -2.359 -2.953
17 HD2 TYR 4 HD2 TYR 4 1.082 -1.959 -3.116
18 HE1 TYR 4 HE1 TYR 4 -3.400 0.050 -3.378
19 HE2 TYR 4 HE2 TYR 4 0.844 0.452 -3.540
20 HH TYR 4 HH TYR 4 -2.239 1.903 -4.214
21 H TRP 5 H TRP 5 1.241 -5.464 -1.156
22 HA TRP 5 HA TRP 5 2.476 -3.784 0.865
23 HB2 TRP 5 HB2 TRP 5 2.897 -6.051 1.266
24 HB3 TRP 5 HB1 TRP 5 3.197 -6.393 -0.435
25 HD1 TRP 5 HD TRP 5 5.664 -6.613 -1.083
26 HE1 TRP 5 HE1 TRP 5 7.913 -5.936 -0.029
27 HE3 TRP 5 HE3 TRP 5 3.918 -3.998 2.948
28 HZ2 TRP 5 HZ2 TRP 5 8.825 -4.486 2.215
29 HZ3 TRP 5 HZ3 TRP 5 5.544 -2.998 4.501
30 HH2 TRP 5 HH TRP 5 7.946 -3.239 4.139
31 H THR 6 H THR 6 4.342 -2.578 0.591
32 HA THR 6 HA THR 6 5.482 -2.360 -2.090
33 HB THR 6 HB THR 6 5.344 0.101 -2.071
34 HG1 THR 6 HG1 THR 6 3.789 1.004 -0.521
35 HG21 THR 6 HG21 THR 6 2.519 -0.759 -1.705
36 HG22 THR 6 HG22 THR 6 3.477 -1.563 -2.948
37 HG23 THR 6 HG23 THR 6 3.254 0.185 -3.001
38 H SER 7 H SER 7 7.548 -1.331 -2.143
39 HA SER 7 HA SER 7 9.093 -1.823 0.224
40 HB2 SER 7 HB2 SER 7 10.164 -2.366 -1.823
41 HB3 SER 7 HB1 SER 7 9.781 -0.796 -2.530
42 HG SER 7 HG SER 7 11.995 -1.421 -1.380
43 H THR 8 H THR 8 8.778 1.089 -1.817
44 HA THR 8 HA THR 8 9.869 2.820 0.146
45 HB THR 8 HB THR 8 9.087 4.658 -1.298
46 HG1 THR 8 HG1 THR 8 7.239 4.115 -2.250
47 HG21 THR 8 HG21 THR 8 10.530 2.317 -2.476
48 HG22 THR 8 HG22 THR 8 11.151 3.903 -2.019
49 HG23 THR 8 HG23 THR 8 10.179 3.724 -3.479
50 HA PRO 9 HA PRO 9 6.426 3.729 2.718
51 HB2 PRO 9 HB2 PRO 9 6.933 6.319 3.358
52 HB3 PRO 9 HB1 PRO 9 7.873 4.969 4.004
53 HG2 PRO 9 HG2 PRO 9 8.518 6.811 1.734
54 HG3 PRO 9 HG1 PRO 9 9.575 6.218 3.028
55 HD2 PRO 9 HD2 PRO 9 9.587 5.159 0.537
56 HD3 PRO 9 HD1 PRO 9 9.923 4.191 1.986
57 HA PRO 10 HA PRO 10 4.712 4.340 3.762
58 HB2 PRO 10 HB2 PRO 10 2.214 3.370 3.331
59 HB3 PRO 10 HB1 PRO 10 2.522 5.031 3.849
60 HG2 PRO 10 HG2 PRO 10 1.944 3.979 1.107
61 HG3 PRO 10 HG1 PRO 10 1.313 5.432 1.904
62 HD2 PRO 10 HD2 PRO 10 3.323 5.521 0.092
63 HD3 PRO 10 HD1 PRO 10 3.211 6.658 1.451
64 H PHE 11 H PHE 11 5.178 2.278 4.314
65 HA PHE 11 HA PHE 11 5.995 0.425 2.371
66 HB2 PHE 11 HB2 PHE 11 5.255 -0.264 5.215
67 HB3 PHE 11 HB1 PHE 11 6.424 -1.074 4.177
68 HD1 PHE 11 HD2 PHE 11 7.936 1.192 3.094
69 HD2 PHE 11 HD1 PHE 11 6.479 0.486 7.030
70 HE1 PHE 11 HE2 PHE 11 9.730 2.608 4.008
71 HE2 PHE 11 HE1 PHE 11 8.269 1.900 7.951
72 HZ PHE 11 HZ PHE 11 9.898 2.964 6.440
73 H PHE 12 H PHE 12 2.925 0.998 3.861
74 HA PHE 12 HA PHE 12 1.792 -1.217 2.299
75 HB2 PHE 12 HB2 PHE 12 2.009 -1.676 4.832
76 HB3 PHE 12 HB1 PHE 12 0.709 -0.502 5.014
77 HD1 PHE 12 HD1 PHE 12 1.559 -3.608 3.145
78 HD2 PHE 12 HD2 PHE 12 -1.477 -1.224 4.934
79 HE1 PHE 12 HE1 PHE 12 -0.091 -5.376 2.692
80 HE2 PHE 12 HE2 PHE 12 -3.132 -2.989 4.486
81 HZ PHE 12 HZ PHE 12 -2.441 -5.068 3.363
82 H THR 13 H THR 13 0.162 -0.616 1.032
83 HA THR 13 HA THR 13 -1.253 1.891 1.664
84 HB THR 13 HB THR 13 -0.456 0.893 -1.077
85 HG1 THR 13 HG1 THR 13 1.273 2.016 -0.600
86 HG21 THR 13 HG21 THR 13 -2.501 1.943 -1.447
87 HG22 THR 13 HG22 THR 13 -1.343 3.251 -1.685
88 HG23 THR 13 HG23 THR 13 -2.234 3.128 -0.169
89 H CYS 14 H CYS 14 -3.450 1.963 1.274
90 HA CYS 14 HA CYS 14 -4.702 -0.592 0.500
91 HB2 CYS 14 HB2 CYS 14 -5.486 1.370 2.652
92 HB3 CYS 14 HB1 CYS 14 -6.608 0.170 2.022
93 H THR 15 H THR 15 -7.004 -0.302 -0.246
94 HA THR 15 HA THR 15 -7.275 2.188 -1.802
95 HB THR 15 HB THR 15 -8.369 0.885 -3.584
96 HG1 THR 15 HG1 THR 15 -9.018 -1.055 -3.063
97 HG21 THR 15 HG21 THR 15 -5.802 1.278 -3.372
98 HG22 THR 15 HG22 THR 15 -6.412 0.161 -4.594
99 HG23 THR 15 HG23 THR 15 -5.743 -0.460 -3.086
100 HA PRO 16 HA PRO 16 -11.279 2.682 -0.066
101 HB2 PRO 16 HB2 PRO 16 -12.574 3.919 -2.106
102 HB3 PRO 16 HB1 PRO 16 -11.348 4.723 -1.119
103 HG2 PRO 16 HG2 PRO 16 -11.082 3.480 -3.830
104 HG3 PRO 16 HG1 PRO 16 -10.422 5.014 -3.232
105 HD2 PRO 16 HD2 PRO 16 -8.930 2.762 -3.424
106 HD3 PRO 16 HD1 PRO 16 -8.658 3.984 -2.164
107 H ASP 17 H ASP 17 -10.839 0.889 -2.991
108 HA ASP 17 HA ASP 17 -13.521 0.054 -3.381
109 HB2 ASP 17 HB2 ASP 17 -11.757 -0.071 -5.129
110 HB3 ASP 17 HB1 ASP 17 -10.979 -1.359 -4.213
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -10.839 -1.998 -2.201
2 HA2 GLY 1 HA2 GLY 1 -11.390 -2.112 0.484
3 HA3 GLY 1 HA1 GLY 1 -12.460 -3.307 -0.234
4 H ASP 2 H ASP 2 -9.092 -2.357 -0.897
5 HA ASP 2 HA ASP 2 -8.089 -4.881 0.067
6 HB2 ASP 2 HB2 ASP 2 -8.868 -5.580 -2.129
7 HB3 ASP 2 HB1 ASP 2 -8.003 -4.249 -2.890
8 H CYS 3 H CYS 3 -5.772 -4.975 0.102
9 HA CYS 3 HA CYS 3 -4.457 -2.382 -0.365
10 HB2 CYS 3 HB2 CYS 3 -3.839 -4.189 1.974
11 HB3 CYS 3 HB1 CYS 3 -3.267 -2.546 1.702
12 H TYR 4 H TYR 4 -1.985 -2.662 -0.239
13 HA TYR 4 HA TYR 4 -1.058 -5.256 -1.173
14 HB2 TYR 4 HB2 TYR 4 0.093 -4.131 -3.140
15 HB3 TYR 4 HB1 TYR 4 -1.650 -4.333 -3.276
16 HD1 TYR 4 HD1 TYR 4 -3.145 -2.368 -2.960
17 HD2 TYR 4 HD2 TYR 4 1.087 -1.968 -3.120
18 HE1 TYR 4 HE1 TYR 4 -3.396 0.041 -3.389
19 HE2 TYR 4 HE2 TYR 4 0.849 0.443 -3.548
20 HH TYR 4 HH TYR 4 -0.727 2.026 -4.328
21 H TRP 5 H TRP 5 1.245 -5.470 -1.155
22 HA TRP 5 HA TRP 5 2.477 -3.788 0.865
23 HB2 TRP 5 HB2 TRP 5 2.901 -6.055 1.266
24 HB3 TRP 5 HB1 TRP 5 3.202 -6.397 -0.435
25 HD1 TRP 5 HD TRP 5 5.669 -6.614 -1.083
26 HE1 TRP 5 HE1 TRP 5 7.916 -5.936 -0.028
27 HE3 TRP 5 HE3 TRP 5 3.920 -4.001 2.949
28 HZ2 TRP 5 HZ2 TRP 5 8.828 -4.486 2.216
29 HZ3 TRP 5 HZ3 TRP 5 5.544 -3.001 4.502
30 HH2 TRP 5 HH TRP 5 7.948 -3.240 4.141
31 H THR 6 H THR 6 4.341 -2.579 0.592
32 HA THR 6 HA THR 6 5.482 -2.360 -2.088
33 HB THR 6 HB THR 6 5.344 0.100 -2.068
34 HG1 THR 6 HG1 THR 6 4.989 0.859 -0.105
35 HG21 THR 6 HG21 THR 6 3.479 -1.561 -2.949
36 HG22 THR 6 HG22 THR 6 3.249 0.187 -2.992
37 HG23 THR 6 HG23 THR 6 2.521 -0.767 -1.701
38 H SER 7 H SER 7 7.546 -1.324 -2.141
39 HA SER 7 HA SER 7 9.093 -1.820 0.224
40 HB2 SER 7 HB2 SER 7 9.814 -2.164 -2.229
41 HB3 SER 7 HB1 SER 7 10.116 -0.426 -2.243
42 HG SER 7 HG SER 7 11.293 -2.352 -0.521
43 H THR 8 H THR 8 8.776 1.094 -1.813
44 HA THR 8 HA THR 8 9.864 2.824 0.153
45 HB THR 8 HB THR 8 9.082 4.663 -1.290
46 HG1 THR 8 HG1 THR 8 8.127 3.726 -3.390
47 HG21 THR 8 HG21 THR 8 10.619 4.291 -2.962
48 HG22 THR 8 HG22 THR 8 10.127 2.612 -3.190
49 HG23 THR 8 HG23 THR 8 11.109 3.063 -1.796
50 HA PRO 9 HA PRO 9 6.420 3.729 2.723
51 HB2 PRO 9 HB2 PRO 9 6.923 6.319 3.363
52 HB3 PRO 9 HB1 PRO 9 7.864 4.969 4.010
53 HG2 PRO 9 HG2 PRO 9 8.509 6.813 1.742
54 HG3 PRO 9 HG1 PRO 9 9.566 6.220 3.038
55 HD2 PRO 9 HD2 PRO 9 9.582 5.163 0.544
56 HD3 PRO 9 HD1 PRO 9 9.916 4.194 1.994
57 HA PRO 10 HA PRO 10 4.704 4.338 3.765
58 HB2 PRO 10 HB2 PRO 10 2.206 3.366 3.332
59 HB3 PRO 10 HB1 PRO 10 2.514 5.028 3.852
60 HG2 PRO 10 HG2 PRO 10 1.938 3.977 1.108
61 HG3 PRO 10 HG1 PRO 10 1.305 5.429 1.906
62 HD2 PRO 10 HD2 PRO 10 3.316 5.521 0.095
63 HD3 PRO 10 HD1 PRO 10 3.203 6.657 1.455
64 H PHE 11 H PHE 11 5.171 2.276 4.317
65 HA PHE 11 HA PHE 11 5.991 0.426 2.373
66 HB2 PHE 11 HB2 PHE 11 5.248 -0.265 5.216
67 HB3 PHE 11 HB1 PHE 11 6.419 -1.075 4.180
68 HD1 PHE 11 HD2 PHE 11 7.931 1.194 3.099
69 HD2 PHE 11 HD1 PHE 11 6.471 0.483 7.033
70 HE1 PHE 11 HE2 PHE 11 9.723 2.609 4.015
71 HE2 PHE 11 HE1 PHE 11 8.260 1.899 7.957
72 HZ PHE 11 HZ PHE 11 9.888 2.965 6.446
73 H PHE 12 H PHE 12 2.918 0.998 3.859
74 HA PHE 12 HA PHE 12 1.789 -1.220 2.296
75 HB2 PHE 12 HB2 PHE 12 2.003 -1.673 4.831
76 HB3 PHE 12 HB1 PHE 12 0.698 -0.504 5.008
77 HD1 PHE 12 HD1 PHE 12 1.578 -3.636 3.205
78 HD2 PHE 12 HD2 PHE 12 -1.499 -1.206 4.862
79 HE1 PHE 12 HE1 PHE 12 -0.064 -5.411 2.750
80 HE2 PHE 12 HE2 PHE 12 -3.145 -2.977 4.410
81 HZ PHE 12 HZ PHE 12 -2.430 -5.083 3.354
82 H THR 13 H THR 13 0.162 -0.618 1.025
83 HA THR 13 HA THR 13 -1.254 1.889 1.653
84 HB THR 13 HB THR 13 -0.454 0.886 -1.086
85 HG1 THR 13 HG1 THR 13 0.892 2.698 -1.078
86 HG21 THR 13 HG21 THR 13 -2.247 3.109 -0.181
87 HG22 THR 13 HG22 THR 13 -2.487 1.937 -1.478
88 HG23 THR 13 HG23 THR 13 -1.336 3.257 -1.683
89 H CYS 14 H CYS 14 -3.450 1.960 1.260
90 HA CYS 14 HA CYS 14 -4.702 -0.594 0.490
91 HB2 CYS 14 HB2 CYS 14 -5.486 1.371 2.638
92 HB3 CYS 14 HB1 CYS 14 -6.610 0.171 2.009
93 H THR 15 H THR 15 -7.004 -0.305 -0.257
94 HA THR 15 HA THR 15 -7.267 2.179 -1.825
95 HB THR 15 HB THR 15 -8.376 0.871 -3.595
96 HG1 THR 15 HG1 THR 15 -7.432 -1.520 -2.463
97 HG21 THR 15 HG21 THR 15 -5.816 1.259 -3.418
98 HG22 THR 15 HG22 THR 15 -6.424 0.100 -4.600
99 HG23 THR 15 HG23 THR 15 -5.746 -0.469 -3.075
100 HA PRO 16 HA PRO 16 -11.264 2.709 -0.081
101 HB2 PRO 16 HB2 PRO 16 -12.557 3.941 -2.126
102 HB3 PRO 16 HB1 PRO 16 -11.323 4.744 -1.147
103 HG2 PRO 16 HG2 PRO 16 -11.072 3.481 -3.850
104 HG3 PRO 16 HG1 PRO 16 -10.401 5.015 -3.265
105 HD2 PRO 16 HD2 PRO 16 -8.924 2.753 -3.446
106 HD3 PRO 16 HD1 PRO 16 -8.640 3.981 -2.195
107 H ASP 17 H ASP 17 -10.827 0.869 -2.968
108 HA ASP 17 HA ASP 17 -13.523 0.053 -3.351
109 HB2 ASP 17 HB2 ASP 17 -11.501 -0.090 -4.980
110 HB3 ASP 17 HB1 ASP 17 -11.162 -1.615 -4.166
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -10.861 -2.039 -2.214
2 HA2 GLY 1 HA2 GLY 1 -11.381 -2.093 0.496
3 HA3 GLY 1 HA1 GLY 1 -12.454 -3.293 -0.208
4 H ASP 2 H ASP 2 -9.094 -2.358 -0.923
5 HA ASP 2 HA ASP 2 -8.092 -4.879 0.062
6 HB2 ASP 2 HB2 ASP 2 -8.415 -4.330 -2.855
7 HB3 ASP 2 HB1 ASP 2 -6.970 -5.187 -2.323
8 H CYS 3 H CYS 3 -5.776 -4.975 0.100
9 HA CYS 3 HA CYS 3 -4.455 -2.385 -0.365
10 HB2 CYS 3 HB2 CYS 3 -3.843 -4.192 1.975
11 HB3 CYS 3 HB1 CYS 3 -3.269 -2.549 1.703
12 H TYR 4 H TYR 4 -1.986 -2.668 -0.236
13 HA TYR 4 HA TYR 4 -1.058 -5.265 -1.165
14 HB2 TYR 4 HB2 TYR 4 0.093 -4.145 -3.134
15 HB3 TYR 4 HB1 TYR 4 -1.650 -4.346 -3.271
16 HD1 TYR 4 HD1 TYR 4 -3.144 -2.379 -2.959
17 HD2 TYR 4 HD2 TYR 4 1.089 -1.982 -3.118
18 HE1 TYR 4 HE1 TYR 4 -3.392 0.028 -3.396
19 HE2 TYR 4 HE2 TYR 4 0.853 0.427 -3.554
20 HH TYR 4 HH TYR 4 -1.005 1.938 -4.582
21 H TRP 5 H TRP 5 1.248 -5.472 -1.158
22 HA TRP 5 HA TRP 5 2.480 -3.792 0.865
23 HB2 TRP 5 HB2 TRP 5 2.909 -6.059 1.261
24 HB3 TRP 5 HB1 TRP 5 3.207 -6.397 -0.442
25 HD1 TRP 5 HD TRP 5 5.674 -6.608 -1.093
26 HE1 TRP 5 HE1 TRP 5 7.922 -5.927 -0.041
27 HE3 TRP 5 HE3 TRP 5 3.925 -4.007 2.946
28 HZ2 TRP 5 HZ2 TRP 5 8.834 -4.479 2.205
29 HZ3 TRP 5 HZ3 TRP 5 5.551 -3.005 4.498
30 HH2 TRP 5 HH TRP 5 7.954 -3.239 4.134
31 H THR 6 H THR 6 4.340 -2.579 0.590
32 HA THR 6 HA THR 6 5.477 -2.352 -2.091
33 HB THR 6 HB THR 6 5.334 0.107 -2.067
34 HG1 THR 6 HG1 THR 6 3.783 1.005 -0.512
35 HG21 THR 6 HG21 THR 6 3.464 -1.566 -2.935
36 HG22 THR 6 HG22 THR 6 3.247 0.183 -3.001
37 HG23 THR 6 HG23 THR 6 2.510 -0.748 -1.699
38 H SER 7 H SER 7 7.540 -1.323 -2.146
39 HA SER 7 HA SER 7 9.090 -1.815 0.217
40 HB2 SER 7 HB2 SER 7 9.785 -2.126 -2.269
41 HB3 SER 7 HB1 SER 7 10.143 -0.400 -2.218
42 HG SER 7 HG SER 7 11.485 -0.902 -0.356
43 H THR 8 H THR 8 8.766 1.099 -1.817
44 HA THR 8 HA THR 8 9.857 2.829 0.148
45 HB THR 8 HB THR 8 9.070 4.668 -1.291
46 HG1 THR 8 HG1 THR 8 7.449 4.326 -2.597
47 HG21 THR 8 HG21 THR 8 11.047 2.920 -1.835
48 HG22 THR 8 HG22 THR 8 10.693 4.329 -2.836
49 HG23 THR 8 HG23 THR 8 10.073 2.743 -3.295
50 HA PRO 9 HA PRO 9 6.415 3.727 2.726
51 HB2 PRO 9 HB2 PRO 9 6.918 6.317 3.370
52 HB3 PRO 9 HB1 PRO 9 7.862 4.967 4.012
53 HG2 PRO 9 HG2 PRO 9 8.501 6.815 1.746
54 HG3 PRO 9 HG1 PRO 9 9.559 6.221 3.037
55 HD2 PRO 9 HD2 PRO 9 9.573 5.167 0.543
56 HD3 PRO 9 HD1 PRO 9 9.910 4.197 1.992
57 HA PRO 10 HA PRO 10 4.702 4.334 3.774
58 HB2 PRO 10 HB2 PRO 10 2.204 3.361 3.345
59 HB3 PRO 10 HB1 PRO 10 2.511 5.023 3.865
60 HG2 PRO 10 HG2 PRO 10 1.931 3.973 1.122
61 HG3 PRO 10 HG1 PRO 10 1.299 5.423 1.922
62 HD2 PRO 10 HD2 PRO 10 3.305 5.519 0.107
63 HD3 PRO 10 HD1 PRO 10 3.194 6.654 1.467
64 H PHE 11 H PHE 11 5.173 2.272 4.321
65 HA PHE 11 HA PHE 11 5.989 0.424 2.375
66 HB2 PHE 11 HB2 PHE 11 5.253 -0.269 5.219
67 HB3 PHE 11 HB1 PHE 11 6.421 -1.078 4.180
68 HD1 PHE 11 HD2 PHE 11 7.930 1.193 3.097
69 HD2 PHE 11 HD1 PHE 11 6.481 0.476 7.035
70 HE1 PHE 11 HE2 PHE 11 9.722 2.609 4.010
71 HE2 PHE 11 HE1 PHE 11 8.271 1.891 7.954
72 HZ PHE 11 HZ PHE 11 9.894 2.961 6.442
73 H PHE 12 H PHE 12 2.917 1.000 3.855
74 HA PHE 12 HA PHE 12 1.789 -1.222 2.299
75 HB2 PHE 12 HB2 PHE 12 2.002 -1.660 4.840
76 HB3 PHE 12 HB1 PHE 12 0.687 -0.500 5.003
77 HD1 PHE 12 HD1 PHE 12 1.594 -3.620 3.186
78 HD2 PHE 12 HD2 PHE 12 -1.495 -1.237 4.887
79 HE1 PHE 12 HE1 PHE 12 -0.032 -5.410 2.732
80 HE2 PHE 12 HE2 PHE 12 -3.126 -3.024 4.437
81 HZ PHE 12 HZ PHE 12 -2.395 -5.114 3.359
82 H THR 13 H THR 13 0.166 -0.622 1.023
83 HA THR 13 HA THR 13 -1.250 1.888 1.644
84 HB THR 13 HB THR 13 -0.453 0.874 -1.092
85 HG1 THR 13 HG1 THR 13 0.851 2.754 -1.088
86 HG21 THR 13 HG21 THR 13 -2.554 1.925 -1.360
87 HG22 THR 13 HG22 THR 13 -1.357 3.144 -1.798
88 HG23 THR 13 HG23 THR 13 -2.144 3.207 -0.220
89 H CYS 14 H CYS 14 -3.447 1.961 1.249
90 HA CYS 14 HA CYS 14 -4.701 -0.595 0.484
91 HB2 CYS 14 HB2 CYS 14 -5.481 1.371 2.635
92 HB3 CYS 14 HB1 CYS 14 -6.605 0.169 2.007
93 H THR 15 H THR 15 -6.991 -0.314 -0.278
94 HA THR 15 HA THR 15 -7.258 2.173 -1.839
95 HB THR 15 HB THR 15 -8.373 0.864 -3.605
96 HG1 THR 15 HG1 THR 15 -8.785 -1.213 -3.345
97 HG21 THR 15 HG21 THR 15 -5.829 -0.609 -3.253
98 HG22 THR 15 HG22 THR 15 -5.732 1.151 -3.248
99 HG23 THR 15 HG23 THR 15 -6.424 0.309 -4.634
100 HA PRO 16 HA PRO 16 -11.250 2.716 -0.089
101 HB2 PRO 16 HB2 PRO 16 -12.544 3.946 -2.134
102 HB3 PRO 16 HB1 PRO 16 -11.307 4.748 -1.160
103 HG2 PRO 16 HG2 PRO 16 -11.064 3.479 -3.860
104 HG3 PRO 16 HG1 PRO 16 -10.389 5.012 -3.281
105 HD2 PRO 16 HD2 PRO 16 -8.917 2.747 -3.459
106 HD3 PRO 16 HD1 PRO 16 -8.628 3.977 -2.212
107 H ASP 17 H ASP 17 -10.819 0.861 -2.964
108 HA ASP 17 HA ASP 17 -13.519 0.053 -3.344
109 HB2 ASP 17 HB2 ASP 17 -11.493 -0.101 -4.971
110 HB3 ASP 17 HB1 ASP 17 -11.168 -1.629 -4.158
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -10.850 -2.021 -2.220
2 HA2 GLY 1 HA2 GLY 1 -11.393 -2.115 0.477
3 HA3 GLY 1 HA1 GLY 1 -12.461 -3.311 -0.242
4 H ASP 2 H ASP 2 -9.093 -2.359 -0.904
5 HA ASP 2 HA ASP 2 -8.089 -4.882 0.063
6 HB2 ASP 2 HB2 ASP 2 -8.929 -5.478 -2.195
7 HB3 ASP 2 HB1 ASP 2 -7.865 -4.256 -2.888
8 H CYS 3 H CYS 3 -5.773 -4.974 0.102
9 HA CYS 3 HA CYS 3 -4.460 -2.381 -0.364
10 HB2 CYS 3 HB2 CYS 3 -3.839 -4.191 1.972
11 HB3 CYS 3 HB1 CYS 3 -3.269 -2.546 1.702
12 H TYR 4 H TYR 4 -1.988 -2.658 -0.239
13 HA TYR 4 HA TYR 4 -1.058 -5.251 -1.178
14 HB2 TYR 4 HB2 TYR 4 0.092 -4.121 -3.142
15 HB3 TYR 4 HB1 TYR 4 -1.652 -4.323 -3.278
16 HD1 TYR 4 HD1 TYR 4 -3.148 -2.359 -2.959
17 HD2 TYR 4 HD2 TYR 4 1.085 -1.958 -3.116
18 HE1 TYR 4 HE1 TYR 4 -3.398 0.051 -3.384
19 HE2 TYR 4 HE2 TYR 4 0.847 0.453 -3.541
20 HH TYR 4 HH TYR 4 -2.117 1.888 -4.378
21 H TRP 5 H TRP 5 1.242 -5.467 -1.154
22 HA TRP 5 HA TRP 5 2.475 -3.783 0.865
23 HB2 TRP 5 HB2 TRP 5 2.897 -6.051 1.268
24 HB3 TRP 5 HB1 TRP 5 3.198 -6.394 -0.433
25 HD1 TRP 5 HD TRP 5 5.665 -6.613 -1.078
26 HE1 TRP 5 HE1 TRP 5 7.912 -5.936 -0.023
27 HE3 TRP 5 HE3 TRP 5 3.915 -3.997 2.950
28 HZ2 TRP 5 HZ2 TRP 5 8.823 -4.486 2.221
29 HZ3 TRP 5 HZ3 TRP 5 5.540 -2.998 4.504
30 HH2 TRP 5 HH TRP 5 7.943 -3.238 4.145
31 H THR 6 H THR 6 4.340 -2.577 0.592
32 HA THR 6 HA THR 6 5.484 -2.360 -2.087
33 HB THR 6 HB THR 6 5.347 0.099 -2.069
34 HG1 THR 6 HG1 THR 6 3.789 1.002 -0.521
35 HG21 THR 6 HG21 THR 6 3.260 0.180 -3.007
36 HG22 THR 6 HG22 THR 6 2.520 -0.754 -1.707
37 HG23 THR 6 HG23 THR 6 3.478 -1.568 -2.942
38 H SER 7 H SER 7 7.549 -1.332 -2.139
39 HA SER 7 HA SER 7 9.092 -1.823 0.230
40 HB2 SER 7 HB2 SER 7 9.749 -2.078 -2.312
41 HB3 SER 7 HB1 SER 7 10.220 -0.387 -2.142
42 HG SER 7 HG SER 7 11.736 -2.320 -1.582
43 H THR 8 H THR 8 8.780 1.087 -1.812
44 HA THR 8 HA THR 8 9.869 2.819 0.151
45 HB THR 8 HB THR 8 9.089 4.657 -1.294
46 HG1 THR 8 HG1 THR 8 7.742 4.284 -2.970
47 HG21 THR 8 HG21 THR 8 11.009 2.780 -1.875
48 HG22 THR 8 HG22 THR 8 10.791 4.315 -2.716
49 HG23 THR 8 HG23 THR 8 10.069 2.843 -3.366
50 HA PRO 9 HA PRO 9 6.424 3.730 2.720
51 HB2 PRO 9 HB2 PRO 9 6.930 6.320 3.358
52 HB3 PRO 9 HB1 PRO 9 7.870 4.969 4.006
53 HG2 PRO 9 HG2 PRO 9 8.518 6.811 1.736
54 HG3 PRO 9 HG1 PRO 9 9.573 6.218 3.032
55 HD2 PRO 9 HD2 PRO 9 9.588 5.158 0.540
56 HD3 PRO 9 HD1 PRO 9 9.921 4.191 1.990
57 HA PRO 10 HA PRO 10 4.710 4.341 3.761
58 HB2 PRO 10 HB2 PRO 10 2.211 3.371 3.328
59 HB3 PRO 10 HB1 PRO 10 2.519 5.032 3.846
60 HG2 PRO 10 HG2 PRO 10 1.943 3.979 1.104
61 HG3 PRO 10 HG1 PRO 10 1.312 5.433 1.899
62 HD2 PRO 10 HD2 PRO 10 3.324 5.521 0.089
63 HD3 PRO 10 HD1 PRO 10 3.211 6.659 1.447
64 H PHE 11 H PHE 11 5.175 2.279 4.314
65 HA PHE 11 HA PHE 11 5.992 0.426 2.372
66 HB2 PHE 11 HB2 PHE 11 5.251 -0.261 5.216
67 HB3 PHE 11 HB1 PHE 11 6.420 -1.073 4.181
68 HD1 PHE 11 HD2 PHE 11 7.935 1.193 3.098
69 HD2 PHE 11 HD1 PHE 11 6.472 0.489 7.033
70 HE1 PHE 11 HE2 PHE 11 9.727 2.608 4.013
71 HE2 PHE 11 HE1 PHE 11 8.261 1.904 7.955
72 HZ PHE 11 HZ PHE 11 9.892 2.964 6.445
73 H PHE 12 H PHE 12 2.921 1.000 3.861
74 HA PHE 12 HA PHE 12 1.790 -1.217 2.298
75 HB2 PHE 12 HB2 PHE 12 2.007 -1.661 4.839
76 HB3 PHE 12 HB1 PHE 12 0.691 -0.503 5.006
77 HD1 PHE 12 HD1 PHE 12 1.607 -3.634 3.218
78 HD2 PHE 12 HD2 PHE 12 -1.498 -1.224 4.851
79 HE1 PHE 12 HE1 PHE 12 -0.018 -5.424 2.761
80 HE2 PHE 12 HE2 PHE 12 -3.128 -3.011 4.398
81 HZ PHE 12 HZ PHE 12 -2.389 -5.115 3.353
82 H THR 13 H THR 13 0.158 -0.617 1.032
83 HA THR 13 HA THR 13 -1.257 1.890 1.663
84 HB THR 13 HB THR 13 -0.456 0.893 -1.078
85 HG1 THR 13 HG1 THR 13 0.290 3.352 0.105
86 HG21 THR 13 HG21 THR 13 -1.325 3.381 -1.524
87 HG22 THR 13 HG22 THR 13 -2.369 2.967 -0.164
88 HG23 THR 13 HG23 THR 13 -2.384 1.976 -1.622
89 H CYS 14 H CYS 14 -3.454 1.962 1.267
90 HA CYS 14 HA CYS 14 -4.703 -0.593 0.491
91 HB2 CYS 14 HB2 CYS 14 -5.491 1.367 2.645
92 HB3 CYS 14 HB1 CYS 14 -6.612 0.166 2.012
93 H THR 15 H THR 15 -7.008 -0.301 -0.253
94 HA THR 15 HA THR 15 -7.274 2.187 -1.812
95 HB THR 15 HB THR 15 -8.375 0.884 -3.590
96 HG1 THR 15 HG1 THR 15 -9.081 -1.010 -2.944
97 HG21 THR 15 HG21 THR 15 -5.794 1.259 -3.354
98 HG22 THR 15 HG22 THR 15 -6.421 0.185 -4.606
99 HG23 THR 15 HG23 THR 15 -5.763 -0.488 -3.115
100 HA PRO 16 HA PRO 16 -11.275 2.695 -0.072
101 HB2 PRO 16 HB2 PRO 16 -12.569 3.932 -2.112
102 HB3 PRO 16 HB1 PRO 16 -11.339 4.734 -1.128
103 HG2 PRO 16 HG2 PRO 16 -11.080 3.486 -3.837
104 HG3 PRO 16 HG1 PRO 16 -10.415 5.019 -3.243
105 HD2 PRO 16 HD2 PRO 16 -8.930 2.763 -3.432
106 HD3 PRO 16 HD1 PRO 16 -8.652 3.986 -2.175
107 H ASP 17 H ASP 17 -10.829 0.872 -2.968
108 HA ASP 17 HA ASP 17 -13.519 0.050 -3.362
109 HB2 ASP 17 HB2 ASP 17 -10.882 -1.121 -4.253
110 HB3 ASP 17 HB1 ASP 17 -12.438 -1.809 -4.708
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -10.828 -2.007 -2.207
2 HA2 GLY 1 HA2 GLY 1 -11.404 -2.109 0.471
3 HA3 GLY 1 HA1 GLY 1 -12.467 -3.310 -0.250
4 H ASP 2 H ASP 2 -9.099 -2.365 -0.915
5 HA ASP 2 HA ASP 2 -8.096 -4.875 0.086
6 HB2 ASP 2 HB2 ASP 2 -8.423 -4.366 -2.834
7 HB3 ASP 2 HB1 ASP 2 -6.965 -5.195 -2.297
8 H CYS 3 H CYS 3 -5.773 -4.971 0.110
9 HA CYS 3 HA CYS 3 -4.465 -2.376 -0.361
10 HB2 CYS 3 HB2 CYS 3 -3.837 -4.182 1.976
11 HB3 CYS 3 HB1 CYS 3 -3.269 -2.539 1.702
12 H TYR 4 H TYR 4 -1.993 -2.650 -0.241
13 HA TYR 4 HA TYR 4 -1.064 -5.242 -1.184
14 HB2 TYR 4 HB2 TYR 4 0.085 -4.106 -3.147
15 HB3 TYR 4 HB1 TYR 4 -1.657 -4.308 -3.283
16 HD1 TYR 4 HD1 TYR 4 -3.154 -2.344 -2.956
17 HD2 TYR 4 HD2 TYR 4 1.079 -1.943 -3.118
18 HE1 TYR 4 HE1 TYR 4 -3.405 0.066 -3.375
19 HE2 TYR 4 HE2 TYR 4 0.840 0.469 -3.535
20 HH TYR 4 HH TYR 4 -0.617 2.211 -3.482
21 H TRP 5 H TRP 5 1.236 -5.458 -1.162
22 HA TRP 5 HA TRP 5 2.471 -3.779 0.860
23 HB2 TRP 5 HB2 TRP 5 2.890 -6.047 1.260
24 HB3 TRP 5 HB1 TRP 5 3.191 -6.389 -0.441
25 HD1 TRP 5 HD TRP 5 5.658 -6.609 -1.088
26 HE1 TRP 5 HE1 TRP 5 7.907 -5.936 -0.033
27 HE3 TRP 5 HE3 TRP 5 3.911 -3.997 2.945
28 HZ2 TRP 5 HZ2 TRP 5 8.819 -4.489 2.213
29 HZ3 TRP 5 HZ3 TRP 5 5.539 -3.000 4.499
30 HH2 TRP 5 HH TRP 5 7.941 -3.243 4.139
31 H THR 6 H THR 6 4.340 -2.575 0.588
32 HA THR 6 HA THR 6 5.482 -2.357 -2.090
33 HB THR 6 HB THR 6 5.347 0.103 -2.074
34 HG1 THR 6 HG1 THR 6 4.736 1.078 -0.306
35 HG21 THR 6 HG21 THR 6 3.525 -1.494 -3.034
36 HG22 THR 6 HG22 THR 6 3.193 0.235 -2.923
37 HG23 THR 6 HG23 THR 6 2.539 -0.869 -1.713
38 H SER 7 H SER 7 7.551 -1.337 -2.142
39 HA SER 7 HA SER 7 9.091 -1.828 0.227
40 HB2 SER 7 HB2 SER 7 10.202 -2.375 -1.778
41 HB3 SER 7 HB1 SER 7 9.760 -0.847 -2.543
42 HG SER 7 HG SER 7 11.666 -1.302 -0.500
43 H THR 8 H THR 8 8.781 1.084 -1.814
44 HA THR 8 HA THR 8 9.872 2.815 0.149
45 HB THR 8 HB THR 8 9.091 4.653 -1.296
46 HG1 THR 8 HG1 THR 8 7.311 4.204 -2.361
47 HG21 THR 8 HG21 THR 8 10.258 3.883 -3.413
48 HG22 THR 8 HG22 THR 8 10.429 2.310 -2.633
49 HG23 THR 8 HG23 THR 8 11.183 3.736 -1.920
50 HA PRO 9 HA PRO 9 6.430 3.726 2.721
51 HB2 PRO 9 HB2 PRO 9 6.938 6.316 3.360
52 HB3 PRO 9 HB1 PRO 9 7.877 4.965 4.006
53 HG2 PRO 9 HG2 PRO 9 8.523 6.807 1.737
54 HG3 PRO 9 HG1 PRO 9 9.580 6.212 3.032
55 HD2 PRO 9 HD2 PRO 9 9.593 5.154 0.539
56 HD3 PRO 9 HD1 PRO 9 9.927 4.185 1.989
57 HA PRO 10 HA PRO 10 4.716 4.338 3.763
58 HB2 PRO 10 HB2 PRO 10 2.216 3.369 3.332
59 HB3 PRO 10 HB1 PRO 10 2.526 5.030 3.851
60 HG2 PRO 10 HG2 PRO 10 1.948 3.979 1.108
61 HG3 PRO 10 HG1 PRO 10 1.318 5.432 1.906
62 HD2 PRO 10 HD2 PRO 10 3.328 5.521 0.093
63 HD3 PRO 10 HD1 PRO 10 3.217 6.658 1.452
64 H PHE 11 H PHE 11 5.180 2.276 4.315
65 HA PHE 11 HA PHE 11 5.995 0.423 2.372
66 HB2 PHE 11 HB2 PHE 11 5.255 -0.266 5.216
67 HB3 PHE 11 HB1 PHE 11 6.424 -1.078 4.179
68 HD1 PHE 11 HD2 PHE 11 7.939 1.187 3.096
69 HD2 PHE 11 HD1 PHE 11 6.478 0.483 7.031
70 HE1 PHE 11 HE2 PHE 11 9.733 2.601 4.012
71 HE2 PHE 11 HE1 PHE 11 8.269 1.896 7.953
72 HZ PHE 11 HZ PHE 11 9.900 2.957 6.442
73 H PHE 12 H PHE 12 2.925 1.000 3.860
74 HA PHE 12 HA PHE 12 1.791 -1.215 2.297
75 HB2 PHE 12 HB2 PHE 12 2.010 -1.675 4.830
76 HB3 PHE 12 HB1 PHE 12 0.707 -0.504 5.012
77 HD1 PHE 12 HD1 PHE 12 1.556 -3.592 3.107
78 HD2 PHE 12 HD2 PHE 12 -1.470 -1.244 4.965
79 HE1 PHE 12 HE1 PHE 12 -0.090 -5.362 2.652
80 HE2 PHE 12 HE2 PHE 12 -3.122 -3.012 4.513
81 HZ PHE 12 HZ PHE 12 -2.433 -5.073 3.355
82 H THR 13 H THR 13 0.158 -0.613 1.034
83 HA THR 13 HA THR 13 -1.257 1.894 1.672
84 HB THR 13 HB THR 13 -0.457 0.906 -1.073
85 HG1 THR 13 HG1 THR 13 1.268 2.038 -0.609
86 HG21 THR 13 HG21 THR 13 -2.252 3.121 -0.154
87 HG22 THR 13 HG22 THR 13 -2.488 1.960 -1.461
88 HG23 THR 13 HG23 THR 13 -1.339 3.283 -1.654
89 H CYS 14 H CYS 14 -3.454 1.965 1.279
90 HA CYS 14 HA CYS 14 -4.703 -0.589 0.500
91 HB2 CYS 14 HB2 CYS 14 -5.495 1.375 2.647
92 HB3 CYS 14 HB1 CYS 14 -6.613 0.171 2.015
93 H THR 15 H THR 15 -7.016 -0.289 -0.235
94 HA THR 15 HA THR 15 -7.280 2.198 -1.797
95 HB THR 15 HB THR 15 -8.365 0.896 -3.585
96 HG1 THR 15 HG1 THR 15 -9.035 -1.029 -3.023
97 HG21 THR 15 HG21 THR 15 -5.835 1.322 -3.443
98 HG22 THR 15 HG22 THR 15 -6.397 0.088 -4.571
99 HG23 THR 15 HG23 THR 15 -5.706 -0.384 -3.019
100 HA PRO 16 HA PRO 16 -11.291 2.679 -0.075
101 HB2 PRO 16 HB2 PRO 16 -12.582 3.917 -2.117
102 HB3 PRO 16 HB1 PRO 16 -11.361 4.721 -1.124
103 HG2 PRO 16 HG2 PRO 16 -11.083 3.485 -3.835
104 HG3 PRO 16 HG1 PRO 16 -10.429 5.019 -3.233
105 HD2 PRO 16 HD2 PRO 16 -8.930 2.771 -3.423
106 HD3 PRO 16 HD1 PRO 16 -8.666 3.992 -2.161
107 H ASP 17 H ASP 17 -10.822 0.870 -2.977
108 HA ASP 17 HA ASP 17 -13.505 0.036 -3.390
109 HB2 ASP 17 HB2 ASP 17 -10.932 -1.331 -4.209
110 HB3 ASP 17 HB1 ASP 17 -12.536 -1.680 -4.852
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -10.801 -1.934 -2.263
2 HA2 GLY 1 HA2 GLY 1 -11.446 -2.148 0.365
3 HA3 GLY 1 HA1 GLY 1 -12.500 -3.330 -0.396
4 H ASP 2 H ASP 2 -9.086 -2.347 -0.735
5 HA ASP 2 HA ASP 2 -8.103 -4.859 0.172
6 HB2 ASP 2 HB2 ASP 2 -8.999 -5.319 -2.202
7 HB3 ASP 2 HB1 ASP 2 -7.623 -4.369 -2.759
8 H CYS 3 H CYS 3 -5.773 -4.962 0.174
9 HA CYS 3 HA CYS 3 -4.473 -2.367 -0.324
10 HB2 CYS 3 HB2 CYS 3 -3.823 -4.159 2.018
11 HB3 CYS 3 HB1 CYS 3 -3.260 -2.516 1.731
12 H TYR 4 H TYR 4 -2.000 -2.636 -0.221
13 HA TYR 4 HA TYR 4 -1.077 -5.231 -1.165
14 HB2 TYR 4 HB2 TYR 4 0.066 -4.096 -3.131
15 HB3 TYR 4 HB1 TYR 4 -1.679 -4.293 -3.259
16 HD1 TYR 4 HD1 TYR 4 -3.167 -2.326 -2.923
17 HD2 TYR 4 HD2 TYR 4 1.067 -1.936 -3.102
18 HE1 TYR 4 HE1 TYR 4 -3.413 0.086 -3.338
19 HE2 TYR 4 HE2 TYR 4 0.832 0.477 -3.516
20 HH TYR 4 HH TYR 4 -2.346 1.971 -3.931
21 H TRP 5 H TRP 5 1.225 -5.447 -1.159
22 HA TRP 5 HA TRP 5 2.471 -3.774 0.861
23 HB2 TRP 5 HB2 TRP 5 2.888 -6.043 1.258
24 HB3 TRP 5 HB1 TRP 5 3.180 -6.384 -0.445
25 HD1 TRP 5 HD TRP 5 5.644 -6.608 -1.102
26 HE1 TRP 5 HE1 TRP 5 7.899 -5.939 -0.055
27 HE3 TRP 5 HE3 TRP 5 3.919 -3.996 2.940
28 HZ2 TRP 5 HZ2 TRP 5 8.823 -4.496 2.189
29 HZ3 TRP 5 HZ3 TRP 5 5.553 -3.004 4.488
30 HH2 TRP 5 HH TRP 5 7.954 -3.250 4.118
31 H THR 6 H THR 6 4.341 -2.574 0.582
32 HA THR 6 HA THR 6 5.471 -2.355 -2.101
33 HB THR 6 HB THR 6 5.341 0.104 -2.081
34 HG1 THR 6 HG1 THR 6 4.459 1.165 -0.435
35 HG21 THR 6 HG21 THR 6 2.524 -0.815 -1.706
36 HG22 THR 6 HG22 THR 6 3.494 -1.514 -3.002
37 HG23 THR 6 HG23 THR 6 3.210 0.225 -2.953
38 H SER 7 H SER 7 7.540 -1.335 -2.161
39 HA SER 7 HA SER 7 9.092 -1.832 0.201
40 HB2 SER 7 HB2 SER 7 10.233 -2.378 -1.768
41 HB3 SER 7 HB1 SER 7 9.725 -0.902 -2.587
42 HG SER 7 HG SER 7 11.498 -0.986 -0.373
43 H THR 8 H THR 8 8.777 1.082 -1.836
44 HA THR 8 HA THR 8 9.880 2.809 0.124
45 HB THR 8 HB THR 8 9.095 4.650 -1.315
46 HG1 THR 8 HG1 THR 8 7.945 2.610 -2.938
47 HG21 THR 8 HG21 THR 8 10.160 2.518 -3.138
48 HG22 THR 8 HG22 THR 8 11.146 3.160 -1.823
49 HG23 THR 8 HG23 THR 8 10.553 4.236 -3.088
50 HA PRO 9 HA PRO 9 6.451 3.724 2.712
51 HB2 PRO 9 HB2 PRO 9 6.966 6.311 3.352
52 HB3 PRO 9 HB1 PRO 9 7.906 4.958 3.993
53 HG2 PRO 9 HG2 PRO 9 8.546 6.802 1.723
54 HG3 PRO 9 HG1 PRO 9 9.607 6.204 3.011
55 HD2 PRO 9 HD2 PRO 9 9.606 5.148 0.517
56 HD3 PRO 9 HD1 PRO 9 9.945 4.178 1.965
57 HA PRO 10 HA PRO 10 4.743 4.336 3.764
58 HB2 PRO 10 HB2 PRO 10 2.240 3.372 3.341
59 HB3 PRO 10 HB1 PRO 10 2.555 5.032 3.860
60 HG2 PRO 10 HG2 PRO 10 1.963 3.986 1.119
61 HG3 PRO 10 HG1 PRO 10 1.338 5.438 1.921
62 HD2 PRO 10 HD2 PRO 10 3.341 5.526 0.101
63 HD3 PRO 10 HD1 PRO 10 3.237 6.661 1.462
64 H PHE 11 H PHE 11 5.205 2.272 4.310
65 HA PHE 11 HA PHE 11 6.010 0.421 2.360
66 HB2 PHE 11 HB2 PHE 11 5.282 -0.271 5.206
67 HB3 PHE 11 HB1 PHE 11 6.445 -1.083 4.163
68 HD1 PHE 11 HD2 PHE 11 7.958 1.181 3.076
69 HD2 PHE 11 HD1 PHE 11 6.514 0.475 7.018
70 HE1 PHE 11 HE2 PHE 11 9.758 2.592 3.987
71 HE2 PHE 11 HE1 PHE 11 8.310 1.884 7.933
72 HZ PHE 11 HZ PHE 11 9.935 2.946 6.417
73 H PHE 12 H PHE 12 2.948 0.997 3.868
74 HA PHE 12 HA PHE 12 1.804 -1.212 2.305
75 HB2 PHE 12 HB2 PHE 12 2.039 -1.649 4.854
76 HB3 PHE 12 HB1 PHE 12 0.705 -0.512 5.012
77 HD1 PHE 12 HD1 PHE 12 1.668 -3.616 3.199
78 HD2 PHE 12 HD2 PHE 12 -1.465 -1.283 4.890
79 HE1 PHE 12 HE1 PHE 12 0.073 -5.434 2.742
80 HE2 PHE 12 HE2 PHE 12 -3.065 -3.098 4.436
81 HZ PHE 12 HZ PHE 12 -2.297 -5.175 3.361
82 H THR 13 H THR 13 0.170 -0.602 1.047
83 HA THR 13 HA THR 13 -1.243 1.901 1.700
84 HB THR 13 HB THR 13 -0.450 0.925 -1.050
85 HG1 THR 13 HG1 THR 13 0.295 3.396 0.086
86 HG21 THR 13 HG21 THR 13 -1.365 3.194 -1.732
87 HG22 THR 13 HG22 THR 13 -2.139 3.249 -0.148
88 HG23 THR 13 HG23 THR 13 -2.558 1.974 -1.290
89 H CYS 14 H CYS 14 -3.440 1.975 1.315
90 HA CYS 14 HA CYS 14 -4.692 -0.579 0.540
91 HB2 CYS 14 HB2 CYS 14 -5.479 1.397 2.677
92 HB3 CYS 14 HB1 CYS 14 -6.605 0.200 2.046
93 H THR 15 H THR 15 -7.043 -0.243 -0.142
94 HA THR 15 HA THR 15 -7.307 2.234 -1.713
95 HB THR 15 HB THR 15 -8.341 0.939 -3.537
96 HG1 THR 15 HG1 THR 15 -7.911 -1.147 -1.724
97 HG21 THR 15 HG21 THR 15 -5.731 1.322 -3.146
98 HG22 THR 15 HG22 THR 15 -6.353 0.438 -4.539
99 HG23 THR 15 HG23 THR 15 -5.743 -0.441 -3.137
100 HA PRO 16 HA PRO 16 -11.350 2.600 -0.037
101 HB2 PRO 16 HB2 PRO 16 -12.641 3.845 -2.076
102 HB3 PRO 16 HB1 PRO 16 -11.450 4.659 -1.054
103 HG2 PRO 16 HG2 PRO 16 -11.110 3.474 -3.782
104 HG3 PRO 16 HG1 PRO 16 -10.497 5.012 -3.144
105 HD2 PRO 16 HD2 PRO 16 -8.948 2.800 -3.353
106 HD3 PRO 16 HD1 PRO 16 -8.726 4.003 -2.066
107 H ASP 17 H ASP 17 -10.872 0.956 -3.066
108 HA ASP 17 HA ASP 17 -13.502 0.046 -3.504
109 HB2 ASP 17 HB2 ASP 17 -11.935 -0.101 -5.301
110 HB3 ASP 17 HB1 ASP 17 -10.821 -1.063 -4.335
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -10.821 -1.963 -2.221
2 HA2 GLY 1 HA2 GLY 1 -11.409 -2.112 0.437
3 HA3 GLY 1 HA1 GLY 1 -12.476 -3.305 -0.288
4 H ASP 2 H ASP 2 -9.088 -2.348 -0.854
5 HA ASP 2 HA ASP 2 -8.098 -4.869 0.101
6 HB2 ASP 2 HB2 ASP 2 -8.984 -5.341 -2.243
7 HB3 ASP 2 HB1 ASP 2 -7.688 -4.303 -2.834
8 H CYS 3 H CYS 3 -5.774 -4.970 0.122
9 HA CYS 3 HA CYS 3 -4.462 -2.376 -0.348
10 HB2 CYS 3 HB2 CYS 3 -3.837 -4.184 1.989
11 HB3 CYS 3 HB1 CYS 3 -3.266 -2.541 1.716
12 H TYR 4 H TYR 4 -1.991 -2.655 -0.229
13 HA TYR 4 HA TYR 4 -1.065 -5.249 -1.169
14 HB2 TYR 4 HB2 TYR 4 0.082 -4.119 -3.135
15 HB3 TYR 4 HB1 TYR 4 -1.662 -4.319 -3.268
16 HD1 TYR 4 HD1 TYR 4 -3.155 -2.355 -2.945
17 HD2 TYR 4 HD2 TYR 4 1.078 -1.956 -3.113
18 HE1 TYR 4 HE1 TYR 4 -3.404 0.056 -3.369
19 HE2 TYR 4 HE2 TYR 4 0.840 0.454 -3.536
20 HH TYR 4 HH TYR 4 -1.710 1.888 -4.624
21 H TRP 5 H TRP 5 1.238 -5.462 -1.156
22 HA TRP 5 HA TRP 5 2.476 -3.783 0.864
23 HB2 TRP 5 HB2 TRP 5 2.898 -6.050 1.262
24 HB3 TRP 5 HB1 TRP 5 3.195 -6.391 -0.440
25 HD1 TRP 5 HD TRP 5 5.661 -6.610 -1.091
26 HE1 TRP 5 HE1 TRP 5 7.911 -5.934 -0.040
27 HE3 TRP 5 HE3 TRP 5 3.920 -3.999 2.946
28 HZ2 TRP 5 HZ2 TRP 5 8.827 -4.486 2.204
29 HZ3 TRP 5 HZ3 TRP 5 5.549 -3.001 4.496
30 HH2 TRP 5 HH TRP 5 7.952 -3.241 4.131
31 H THR 6 H THR 6 4.341 -2.577 0.588
32 HA THR 6 HA THR 6 5.477 -2.356 -2.093
33 HB THR 6 HB THR 6 5.340 0.104 -2.073
34 HG1 THR 6 HG1 THR 6 3.796 -0.355 0.276
35 HG21 THR 6 HG21 THR 6 2.903 0.293 -2.510
36 HG22 THR 6 HG22 THR 6 2.689 -1.322 -1.837
37 HG23 THR 6 HG23 THR 6 3.643 -1.097 -3.303
38 H SER 7 H SER 7 7.543 -1.331 -2.150
39 HA SER 7 HA SER 7 9.092 -1.824 0.215
40 HB2 SER 7 HB2 SER 7 9.959 -2.299 -2.059
41 HB3 SER 7 HB1 SER 7 9.943 -0.571 -2.408
42 HG SER 7 HG SER 7 11.943 -0.814 -1.695
43 H THR 8 H THR 8 8.774 1.089 -1.823
44 HA THR 8 HA THR 8 9.869 2.819 0.138
45 HB THR 8 HB THR 8 9.084 4.658 -1.302
46 HG1 THR 8 HG1 THR 8 7.242 4.128 -2.266
47 HG21 THR 8 HG21 THR 8 11.183 3.490 -1.840
48 HG22 THR 8 HG22 THR 8 10.374 4.082 -3.291
49 HG23 THR 8 HG23 THR 8 10.288 2.372 -2.869
50 HA PRO 9 HA PRO 9 6.432 3.727 2.717
51 HB2 PRO 9 HB2 PRO 9 6.940 6.317 3.357
52 HB3 PRO 9 HB1 PRO 9 7.881 4.965 4.001
53 HG2 PRO 9 HG2 PRO 9 8.522 6.810 1.732
54 HG3 PRO 9 HG1 PRO 9 9.582 6.214 3.023
55 HD2 PRO 9 HD2 PRO 9 9.589 5.157 0.531
56 HD3 PRO 9 HD1 PRO 9 9.927 4.188 1.979
57 HA PRO 10 HA PRO 10 4.720 4.338 3.765
58 HB2 PRO 10 HB2 PRO 10 2.220 3.368 3.338
59 HB3 PRO 10 HB1 PRO 10 2.530 5.029 3.856
60 HG2 PRO 10 HG2 PRO 10 1.947 3.980 1.115
61 HG3 PRO 10 HG1 PRO 10 1.317 5.432 1.914
62 HD2 PRO 10 HD2 PRO 10 3.324 5.522 0.098
63 HD3 PRO 10 HD1 PRO 10 3.215 6.658 1.458
64 H PHE 11 H PHE 11 5.186 2.276 4.314
65 HA PHE 11 HA PHE 11 5.999 0.424 2.368
66 HB2 PHE 11 HB2 PHE 11 5.264 -0.266 5.213
67 HB3 PHE 11 HB1 PHE 11 6.431 -1.077 4.174
68 HD1 PHE 11 HD2 PHE 11 7.942 1.190 3.088
69 HD2 PHE 11 HD1 PHE 11 6.492 0.481 7.027
70 HE1 PHE 11 HE2 PHE 11 9.737 2.603 4.001
71 HE2 PHE 11 HE1 PHE 11 8.284 1.894 7.945
72 HZ PHE 11 HZ PHE 11 9.910 2.958 6.431
73 H PHE 12 H PHE 12 2.931 0.999 3.863
74 HA PHE 12 HA PHE 12 1.796 -1.217 2.303
75 HB2 PHE 12 HB2 PHE 12 2.020 -1.645 4.853
76 HB3 PHE 12 HB1 PHE 12 0.685 -0.508 5.003
77 HD1 PHE 12 HD1 PHE 12 1.654 -3.613 3.194
78 HD2 PHE 12 HD2 PHE 12 -1.482 -1.285 4.884
79 HE1 PHE 12 HE1 PHE 12 0.062 -5.433 2.736
80 HE2 PHE 12 HE2 PHE 12 -3.080 -3.101 4.430
81 HZ PHE 12 HZ PHE 12 -2.309 -5.178 3.355
82 H THR 13 H THR 13 0.163 -0.615 1.038
83 HA THR 13 HA THR 13 -1.250 1.893 1.672
84 HB THR 13 HB THR 13 -0.455 0.896 -1.071
85 HG1 THR 13 HG1 THR 13 1.155 2.269 -0.900
86 HG21 THR 13 HG21 THR 13 -2.532 1.945 -1.380
87 HG22 THR 13 HG22 THR 13 -1.352 3.210 -1.724
88 HG23 THR 13 HG23 THR 13 -2.187 3.180 -0.171
89 H CYS 14 H CYS 14 -3.447 1.965 1.282
90 HA CYS 14 HA CYS 14 -4.700 -0.589 0.510
91 HB2 CYS 14 HB2 CYS 14 -5.487 1.377 2.659
92 HB3 CYS 14 HB1 CYS 14 -6.605 0.170 2.032
93 H THR 15 H THR 15 -7.006 -0.296 -0.232
94 HA THR 15 HA THR 15 -7.278 2.194 -1.786
95 HB THR 15 HB THR 15 -8.361 0.893 -3.576
96 HG1 THR 15 HG1 THR 15 -7.400 -1.494 -2.437
97 HG21 THR 15 HG21 THR 15 -5.822 1.320 -3.413
98 HG22 THR 15 HG22 THR 15 -6.393 0.116 -4.570
99 HG23 THR 15 HG23 THR 15 -5.707 -0.398 -3.029
100 HA PRO 16 HA PRO 16 -11.290 2.662 -0.061
101 HB2 PRO 16 HB2 PRO 16 -12.585 3.901 -2.100
102 HB3 PRO 16 HB1 PRO 16 -11.366 4.707 -1.106
103 HG2 PRO 16 HG2 PRO 16 -11.085 3.476 -3.820
104 HG3 PRO 16 HG1 PRO 16 -10.434 5.010 -3.215
105 HD2 PRO 16 HD2 PRO 16 -8.931 2.766 -3.411
106 HD3 PRO 16 HD1 PRO 16 -8.669 3.984 -2.146
107 H ASP 17 H ASP 17 -10.847 0.905 -3.013
108 HA ASP 17 HA ASP 17 -13.517 0.053 -3.410
109 HB2 ASP 17 HB2 ASP 17 -10.957 -1.334 -4.234
110 HB3 ASP 17 HB1 ASP 17 -12.562 -1.634 -4.897
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -10.849 -2.021 -2.194
2 HA2 GLY 1 HA2 GLY 1 -11.380 -2.087 0.506
3 HA3 GLY 1 HA1 GLY 1 -12.452 -3.289 -0.196
4 H ASP 2 H ASP 2 -9.100 -2.361 -0.949
5 HA ASP 2 HA ASP 2 -8.094 -4.880 0.050
6 HB2 ASP 2 HB2 ASP 2 -8.384 -4.313 -2.871
7 HB3 ASP 2 HB1 ASP 2 -6.973 -5.211 -2.316
8 H CYS 3 H CYS 3 -5.777 -4.978 0.088
9 HA CYS 3 HA CYS 3 -4.457 -2.386 -0.369
10 HB2 CYS 3 HB2 CYS 3 -3.848 -4.198 1.968
11 HB3 CYS 3 HB1 CYS 3 -3.273 -2.556 1.699
12 H TYR 4 H TYR 4 -1.987 -2.672 -0.237
13 HA TYR 4 HA TYR 4 -1.059 -5.266 -1.169
14 HB2 TYR 4 HB2 TYR 4 0.093 -4.143 -3.137
15 HB3 TYR 4 HB1 TYR 4 -1.650 -4.344 -3.274
16 HD1 TYR 4 HD1 TYR 4 -3.145 -2.378 -2.962
17 HD2 TYR 4 HD2 TYR 4 1.089 -1.981 -3.121
18 HE1 TYR 4 HE1 TYR 4 -3.393 0.030 -3.396
19 HE2 TYR 4 HE2 TYR 4 0.852 0.429 -3.555
20 HH TYR 4 HH TYR 4 -1.195 1.907 -4.660
21 H TRP 5 H TRP 5 1.247 -5.472 -1.158
22 HA TRP 5 HA TRP 5 2.478 -3.791 0.864
23 HB2 TRP 5 HB2 TRP 5 2.906 -6.058 1.262
24 HB3 TRP 5 HB1 TRP 5 3.207 -6.397 -0.441
25 HD1 TRP 5 HD TRP 5 5.673 -6.609 -1.089
26 HE1 TRP 5 HE1 TRP 5 7.921 -5.927 -0.035
27 HE3 TRP 5 HE3 TRP 5 3.921 -4.005 2.946
28 HZ2 TRP 5 HZ2 TRP 5 8.830 -4.478 2.210
29 HZ3 TRP 5 HZ3 TRP 5 5.545 -3.003 4.499
30 HH2 TRP 5 HH TRP 5 7.948 -3.236 4.137
31 H THR 6 H THR 6 4.339 -2.579 0.591
32 HA THR 6 HA THR 6 5.478 -2.353 -2.090
33 HB THR 6 HB THR 6 5.334 0.107 -2.066
34 HG1 THR 6 HG1 THR 6 5.087 0.606 0.077
35 HG21 THR 6 HG21 THR 6 3.629 -1.166 -3.268
36 HG22 THR 6 HG22 THR 6 2.939 0.299 -2.568
37 HG23 THR 6 HG23 THR 6 2.656 -1.264 -1.802
38 H SER 7 H SER 7 7.541 -1.323 -2.143
39 HA SER 7 HA SER 7 9.089 -1.815 0.221
40 HB2 SER 7 HB2 SER 7 10.368 -2.331 -1.612
41 HB3 SER 7 HB1 SER 7 9.659 -1.054 -2.599
42 HG SER 7 HG SER 7 11.878 -0.688 -1.956
43 H THR 8 H THR 8 8.765 1.099 -1.815
44 HA THR 8 HA THR 8 9.855 2.829 0.149
45 HB THR 8 HB THR 8 9.069 4.668 -1.291
46 HG1 THR 8 HG1 THR 8 7.454 4.327 -2.606
47 HG21 THR 8 HG21 THR 8 11.131 3.204 -1.792
48 HG22 THR 8 HG22 THR 8 10.524 4.253 -3.075
49 HG23 THR 8 HG23 THR 8 10.156 2.528 -3.096
50 HA PRO 9 HA PRO 9 6.414 3.729 2.726
51 HB2 PRO 9 HB2 PRO 9 6.916 6.319 3.367
52 HB3 PRO 9 HB1 PRO 9 7.858 4.970 4.011
53 HG2 PRO 9 HG2 PRO 9 8.500 6.817 1.743
54 HG3 PRO 9 HG1 PRO 9 9.558 6.223 3.036
55 HD2 PRO 9 HD2 PRO 9 9.571 5.167 0.543
56 HD3 PRO 9 HD1 PRO 9 9.908 4.198 1.991
57 HA PRO 10 HA PRO 10 4.699 4.337 3.771
58 HB2 PRO 10 HB2 PRO 10 2.202 3.363 3.341
59 HB3 PRO 10 HB1 PRO 10 2.509 5.024 3.861
60 HG2 PRO 10 HG2 PRO 10 1.930 3.974 1.118
61 HG3 PRO 10 HG1 PRO 10 1.297 5.425 1.917
62 HD2 PRO 10 HD2 PRO 10 3.304 5.520 0.103
63 HD3 PRO 10 HD1 PRO 10 3.192 6.655 1.464
64 H PHE 11 H PHE 11 5.170 2.275 4.320
65 HA PHE 11 HA PHE 11 5.986 0.426 2.375
66 HB2 PHE 11 HB2 PHE 11 5.250 -0.267 5.219
67 HB3 PHE 11 HB1 PHE 11 6.419 -1.075 4.181
68 HD1 PHE 11 HD2 PHE 11 7.927 1.195 3.097
69 HD2 PHE 11 HD1 PHE 11 6.476 0.480 7.035
70 HE1 PHE 11 HE2 PHE 11 9.719 2.611 4.012
71 HE2 PHE 11 HE1 PHE 11 8.265 1.895 7.956
72 HZ PHE 11 HZ PHE 11 9.889 2.964 6.443
73 H PHE 12 H PHE 12 2.915 0.998 3.859
74 HA PHE 12 HA PHE 12 1.788 -1.224 2.302
75 HB2 PHE 12 HB2 PHE 12 2.002 -1.650 4.850
76 HB3 PHE 12 HB1 PHE 12 0.674 -0.504 4.999
77 HD1 PHE 12 HD1 PHE 12 1.634 -3.644 3.254
78 HD2 PHE 12 HD2 PHE 12 -1.509 -1.241 4.822
79 HE1 PHE 12 HE1 PHE 12 0.030 -5.453 2.799
80 HE2 PHE 12 HE2 PHE 12 -3.119 -3.046 4.369
81 HZ PHE 12 HZ PHE 12 -2.350 -5.156 3.356
82 H THR 13 H THR 13 0.166 -0.624 1.025
83 HA THR 13 HA THR 13 -1.251 1.886 1.644
84 HB THR 13 HB THR 13 -0.454 0.871 -1.091
85 HG1 THR 13 HG1 THR 13 1.300 1.921 -0.450
86 HG21 THR 13 HG21 THR 13 -2.583 1.927 -1.300
87 HG22 THR 13 HG22 THR 13 -1.374 3.094 -1.837
88 HG23 THR 13 HG23 THR 13 -2.101 3.248 -0.237
89 H CYS 14 H CYS 14 -3.447 1.959 1.248
90 HA CYS 14 HA CYS 14 -4.703 -0.596 0.482
91 HB2 CYS 14 HB2 CYS 14 -5.485 1.364 2.636
92 HB3 CYS 14 HB1 CYS 14 -6.604 0.158 2.009
93 H THR 15 H THR 15 -6.980 -0.325 -0.296
94 HA THR 15 HA THR 15 -7.253 2.168 -1.846
95 HB THR 15 HB THR 15 -8.373 0.860 -3.610
96 HG1 THR 15 HG1 THR 15 -7.434 -1.533 -2.481
97 HG21 THR 15 HG21 THR 15 -6.431 0.198 -4.638
98 HG22 THR 15 HG22 THR 15 -5.789 -0.561 -3.182
99 HG23 THR 15 HG23 THR 15 -5.768 1.195 -3.344
100 HA PRO 16 HA PRO 16 -11.241 2.719 -0.089
101 HB2 PRO 16 HB2 PRO 16 -12.537 3.951 -2.131
102 HB3 PRO 16 HB1 PRO 16 -11.295 4.750 -1.160
103 HG2 PRO 16 HG2 PRO 16 -11.061 3.481 -3.860
104 HG3 PRO 16 HG1 PRO 16 -10.381 5.013 -3.282
105 HD2 PRO 16 HD2 PRO 16 -8.914 2.745 -3.463
106 HD3 PRO 16 HD1 PRO 16 -8.620 3.974 -2.217
107 H ASP 17 H ASP 17 -10.814 0.855 -2.957
108 HA ASP 17 HA ASP 17 -13.517 0.054 -3.334
109 HB2 ASP 17 HB2 ASP 17 -10.878 -1.068 -4.259
110 HB3 ASP 17 HB1 ASP 17 -12.408 -1.856 -4.637
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -10.851 -2.045 -2.223
2 HA2 GLY 1 HA2 GLY 1 -11.405 -2.118 0.479
3 HA3 GLY 1 HA1 GLY 1 -12.466 -3.316 -0.245
4 H ASP 2 H ASP 2 -9.099 -2.368 -0.913
5 HA ASP 2 HA ASP 2 -8.093 -4.879 0.082
6 HB2 ASP 2 HB2 ASP 2 -7.037 -5.465 -2.145
7 HB3 ASP 2 HB1 ASP 2 -8.779 -5.706 -2.044
8 H CYS 3 H CYS 3 -5.771 -4.973 0.105
9 HA CYS 3 HA CYS 3 -4.465 -2.377 -0.366
10 HB2 CYS 3 HB2 CYS 3 -3.837 -4.180 1.972
11 HB3 CYS 3 HB1 CYS 3 -3.270 -2.536 1.697
12 H TYR 4 H TYR 4 -1.993 -2.650 -0.246
13 HA TYR 4 HA TYR 4 -1.063 -5.243 -1.186
14 HB2 TYR 4 HB2 TYR 4 0.089 -4.106 -3.147
15 HB3 TYR 4 HB1 TYR 4 -1.654 -4.308 -3.286
16 HD1 TYR 4 HD1 TYR 4 -3.148 -2.344 -2.961
17 HD2 TYR 4 HD2 TYR 4 1.084 -1.944 -3.115
18 HE1 TYR 4 HE1 TYR 4 -3.398 0.066 -3.379
19 HE2 TYR 4 HE2 TYR 4 0.847 0.468 -3.534
20 HH TYR 4 HH TYR 4 -1.785 1.900 -4.595
21 H TRP 5 H TRP 5 1.239 -5.457 -1.166
22 HA TRP 5 HA TRP 5 2.472 -3.779 0.859
23 HB2 TRP 5 HB2 TRP 5 2.889 -6.046 1.260
24 HB3 TRP 5 HB1 TRP 5 3.192 -6.390 -0.441
25 HD1 TRP 5 HD TRP 5 5.659 -6.611 -1.084
26 HE1 TRP 5 HE1 TRP 5 7.906 -5.938 -0.025
27 HE3 TRP 5 HE3 TRP 5 3.908 -3.996 2.945
28 HZ2 TRP 5 HZ2 TRP 5 8.817 -4.491 2.221
29 HZ3 TRP 5 HZ3 TRP 5 5.533 -2.999 4.501
30 HH2 TRP 5 HH TRP 5 7.936 -3.243 4.145
31 H THR 6 H THR 6 4.341 -2.576 0.589
32 HA THR 6 HA THR 6 5.486 -2.358 -2.089
33 HB THR 6 HB THR 6 5.352 0.101 -2.072
34 HG1 THR 6 HG1 THR 6 5.061 0.738 -0.017
35 HG21 THR 6 HG21 THR 6 3.629 -1.247 -3.233
36 HG22 THR 6 HG22 THR 6 3.010 0.301 -2.657
37 HG23 THR 6 HG23 THR 6 2.634 -1.181 -1.779
38 H SER 7 H SER 7 7.553 -1.334 -2.138
39 HA SER 7 HA SER 7 9.093 -1.828 0.232
40 HB2 SER 7 HB2 SER 7 10.371 -2.352 -1.601
41 HB3 SER 7 HB1 SER 7 9.676 -1.068 -2.589
42 HG SER 7 HG SER 7 11.089 0.336 -1.797
43 H THR 8 H THR 8 8.784 1.084 -1.810
44 HA THR 8 HA THR 8 9.874 2.814 0.154
45 HB THR 8 HB THR 8 9.095 4.652 -1.291
46 HG1 THR 8 HG1 THR 8 7.742 4.285 -2.958
47 HG21 THR 8 HG21 THR 8 10.073 2.857 -3.373
48 HG22 THR 8 HG22 THR 8 11.005 2.757 -1.879
49 HG23 THR 8 HG23 THR 8 10.810 4.308 -2.695
50 HA PRO 9 HA PRO 9 6.430 3.728 2.722
51 HB2 PRO 9 HB2 PRO 9 6.938 6.316 3.361
52 HB3 PRO 9 HB1 PRO 9 7.876 4.965 4.009
53 HG2 PRO 9 HG2 PRO 9 8.526 6.806 1.741
54 HG3 PRO 9 HG1 PRO 9 9.580 6.211 3.036
55 HD2 PRO 9 HD2 PRO 9 9.595 5.153 0.544
56 HD3 PRO 9 HD1 PRO 9 9.927 4.184 1.995
57 HA PRO 10 HA PRO 10 4.714 4.339 3.763
58 HB2 PRO 10 HB2 PRO 10 2.215 3.372 3.328
59 HB3 PRO 10 HB1 PRO 10 2.525 5.032 3.846
60 HG2 PRO 10 HG2 PRO 10 1.950 3.981 1.103
61 HG3 PRO 10 HG1 PRO 10 1.319 5.435 1.900
62 HD2 PRO 10 HD2 PRO 10 3.331 5.523 0.090
63 HD3 PRO 10 HD1 PRO 10 3.219 6.660 1.449
64 H PHE 11 H PHE 11 5.178 2.277 4.315
65 HA PHE 11 HA PHE 11 5.995 0.424 2.372
66 HB2 PHE 11 HB2 PHE 11 5.251 -0.265 5.215
67 HB3 PHE 11 HB1 PHE 11 6.420 -1.077 4.180
68 HD1 PHE 11 HD2 PHE 11 7.938 1.189 3.099
69 HD2 PHE 11 HD1 PHE 11 6.472 0.483 7.032
70 HE1 PHE 11 HE2 PHE 11 9.730 2.601 4.017
71 HE2 PHE 11 HE1 PHE 11 8.263 1.895 7.957
72 HZ PHE 11 HZ PHE 11 9.895 2.956 6.448
73 H PHE 12 H PHE 12 2.923 0.998 3.861
74 HA PHE 12 HA PHE 12 1.791 -1.214 2.294
75 HB2 PHE 12 HB2 PHE 12 2.009 -1.668 4.831
76 HB3 PHE 12 HB1 PHE 12 0.697 -0.507 5.005
77 HD1 PHE 12 HD1 PHE 12 1.595 -3.630 3.192
78 HD2 PHE 12 HD2 PHE 12 -1.492 -1.226 4.867
79 HE1 PHE 12 HE1 PHE 12 -0.037 -5.412 2.732
80 HE2 PHE 12 HE2 PHE 12 -3.129 -3.005 4.411
81 HZ PHE 12 HZ PHE 12 -2.402 -5.102 3.342
82 H THR 13 H THR 13 0.156 -0.613 1.032
83 HA THR 13 HA THR 13 -1.260 1.893 1.671
84 HB THR 13 HB THR 13 -0.454 0.909 -1.074
85 HG1 THR 13 HG1 THR 13 0.874 2.745 -1.051
86 HG21 THR 13 HG21 THR 13 -1.327 3.390 -1.521
87 HG22 THR 13 HG22 THR 13 -2.362 2.987 -0.150
88 HG23 THR 13 HG23 THR 13 -2.392 1.988 -1.603
89 H CYS 14 H CYS 14 -3.455 1.963 1.277
90 HA CYS 14 HA CYS 14 -4.702 -0.591 0.496
91 HB2 CYS 14 HB2 CYS 14 -5.495 1.375 2.639
92 HB3 CYS 14 HB1 CYS 14 -6.619 0.179 2.003
93 H THR 15 H THR 15 -7.031 -0.278 -0.221
94 HA THR 15 HA THR 15 -7.283 2.199 -1.798
95 HB THR 15 HB THR 15 -8.370 0.894 -3.584
96 HG1 THR 15 HG1 THR 15 -8.819 -1.162 -3.305
97 HG21 THR 15 HG21 THR 15 -5.939 -0.662 -3.484
98 HG22 THR 15 HG22 THR 15 -5.643 1.005 -2.985
99 HG23 THR 15 HG23 THR 15 -6.373 0.670 -4.555
100 HA PRO 16 HA PRO 16 -11.296 2.690 -0.080
101 HB2 PRO 16 HB2 PRO 16 -12.584 3.926 -2.127
102 HB3 PRO 16 HB1 PRO 16 -11.362 4.731 -1.134
103 HG2 PRO 16 HG2 PRO 16 -11.083 3.488 -3.843
104 HG3 PRO 16 HG1 PRO 16 -10.428 5.022 -3.244
105 HD2 PRO 16 HD2 PRO 16 -8.933 2.772 -3.428
106 HD3 PRO 16 HD1 PRO 16 -8.667 3.994 -2.168
107 H ASP 17 H ASP 17 -10.819 0.860 -2.964
108 HA ASP 17 HA ASP 17 -13.506 0.033 -3.381
109 HB2 ASP 17 HB2 ASP 17 -11.688 -0.092 -5.098
110 HB3 ASP 17 HB1 ASP 17 -10.980 -1.421 -4.183
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -10.871 -2.052 -2.212
2 HA2 GLY 1 HA2 GLY 1 -11.376 -2.089 0.508
3 HA3 GLY 1 HA1 GLY 1 -12.450 -3.291 -0.192
4 H ASP 2 H ASP 2 -9.098 -2.360 -0.945
5 HA ASP 2 HA ASP 2 -8.092 -4.880 0.048
6 HB2 ASP 2 HB2 ASP 2 -8.165 -4.253 -2.902
7 HB3 ASP 2 HB1 ASP 2 -7.024 -5.402 -2.210
8 H CYS 3 H CYS 3 -5.776 -4.977 0.089
9 HA CYS 3 HA CYS 3 -4.455 -2.387 -0.371
10 HB2 CYS 3 HB2 CYS 3 -3.846 -4.196 1.968
11 HB3 CYS 3 HB1 CYS 3 -3.272 -2.553 1.699
12 H TYR 4 H TYR 4 -1.985 -2.671 -0.237
13 HA TYR 4 HA TYR 4 -1.057 -5.267 -1.167
14 HB2 TYR 4 HB2 TYR 4 0.095 -4.147 -3.136
15 HB3 TYR 4 HB1 TYR 4 -1.648 -4.349 -3.273
16 HD1 TYR 4 HD1 TYR 4 -3.143 -2.382 -2.962
17 HD2 TYR 4 HD2 TYR 4 1.091 -1.983 -3.121
18 HE1 TYR 4 HE1 TYR 4 -3.391 0.026 -3.399
19 HE2 TYR 4 HE2 TYR 4 0.854 0.425 -3.557
20 HH TYR 4 HH TYR 4 -0.602 2.061 -4.118
21 H TRP 5 H TRP 5 1.250 -5.474 -1.157
22 HA TRP 5 HA TRP 5 2.480 -3.793 0.865
23 HB2 TRP 5 HB2 TRP 5 2.909 -6.059 1.264
24 HB3 TRP 5 HB1 TRP 5 3.208 -6.399 -0.438
25 HD1 TRP 5 HD TRP 5 5.674 -6.608 -1.089
26 HE1 TRP 5 HE1 TRP 5 7.922 -5.927 -0.036
27 HE3 TRP 5 HE3 TRP 5 3.924 -4.006 2.948
28 HZ2 TRP 5 HZ2 TRP 5 8.833 -4.479 2.209
29 HZ3 TRP 5 HZ3 TRP 5 5.549 -3.004 4.501
30 HH2 TRP 5 HH TRP 5 7.953 -3.237 4.137
31 H THR 6 H THR 6 4.341 -2.580 0.592
32 HA THR 6 HA THR 6 5.479 -2.354 -2.089
33 HB THR 6 HB THR 6 5.335 0.105 -2.066
34 HG1 THR 6 HG1 THR 6 4.533 1.145 -0.387
35 HG21 THR 6 HG21 THR 6 2.722 -1.389 -1.870
36 HG22 THR 6 HG22 THR 6 3.649 -1.024 -3.326
37 HG23 THR 6 HG23 THR 6 2.856 0.276 -2.437
38 H SER 7 H SER 7 7.542 -1.322 -2.143
39 HA SER 7 HA SER 7 9.091 -1.815 0.222
40 HB2 SER 7 HB2 SER 7 9.805 -2.150 -2.240
41 HB3 SER 7 HB1 SER 7 10.118 -0.414 -2.238
42 HG SER 7 HG SER 7 11.846 -2.077 -1.575
43 H THR 8 H THR 8 8.767 1.099 -1.814
44 HA THR 8 HA THR 8 9.856 2.830 0.151
45 HB THR 8 HB THR 8 9.070 4.668 -1.289
46 HG1 THR 8 HG1 THR 8 7.816 4.231 -3.082
47 HG21 THR 8 HG21 THR 8 10.663 4.321 -2.879
48 HG22 THR 8 HG22 THR 8 10.087 2.699 -3.259
49 HG23 THR 8 HG23 THR 8 11.065 2.972 -1.818
50 HA PRO 9 HA PRO 9 6.414 3.729 2.727
51 HB2 PRO 9 HB2 PRO 9 6.915 6.318 3.369
52 HB3 PRO 9 HB1 PRO 9 7.858 4.969 4.013
53 HG2 PRO 9 HG2 PRO 9 8.499 6.816 1.746
54 HG3 PRO 9 HG1 PRO 9 9.557 6.222 3.039
55 HD2 PRO 9 HD2 PRO 9 9.571 5.168 0.545
56 HD3 PRO 9 HD1 PRO 9 9.908 4.198 1.994
57 HA PRO 10 HA PRO 10 4.699 4.335 3.773
58 HB2 PRO 10 HB2 PRO 10 2.201 3.361 3.342
59 HB3 PRO 10 HB1 PRO 10 2.508 5.022 3.862
60 HG2 PRO 10 HG2 PRO 10 1.930 3.972 1.119
61 HG3 PRO 10 HG1 PRO 10 1.296 5.423 1.918
62 HD2 PRO 10 HD2 PRO 10 3.305 5.519 0.105
63 HD3 PRO 10 HD1 PRO 10 3.191 6.653 1.465
64 H PHE 11 H PHE 11 5.169 2.273 4.321
65 HA PHE 11 HA PHE 11 5.987 0.425 2.376
66 HB2 PHE 11 HB2 PHE 11 5.251 -0.268 5.219
67 HB3 PHE 11 HB1 PHE 11 6.420 -1.076 4.180
68 HD1 PHE 11 HD2 PHE 11 7.928 1.194 3.098
69 HD2 PHE 11 HD1 PHE 11 6.474 0.481 7.035
70 HE1 PHE 11 HE2 PHE 11 9.720 2.611 4.014
71 HE2 PHE 11 HE1 PHE 11 8.262 1.897 7.956
72 HZ PHE 11 HZ PHE 11 9.889 2.964 6.445
73 H PHE 12 H PHE 12 2.915 1.001 3.853
74 HA PHE 12 HA PHE 12 1.788 -1.222 2.299
75 HB2 PHE 12 HB2 PHE 12 1.997 -1.672 4.832
76 HB3 PHE 12 HB1 PHE 12 0.699 -0.497 5.008
77 HD1 PHE 12 HD1 PHE 12 1.564 -3.643 3.225
78 HD2 PHE 12 HD2 PHE 12 -1.504 -1.183 4.851
79 HE1 PHE 12 HE1 PHE 12 -0.087 -5.411 2.775
80 HE2 PHE 12 HE2 PHE 12 -3.160 -2.946 4.404
81 HZ PHE 12 HZ PHE 12 -2.452 -5.064 3.366
82 H THR 13 H THR 13 0.165 -0.624 1.021
83 HA THR 13 HA THR 13 -1.251 1.887 1.640
84 HB THR 13 HB THR 13 -0.454 0.871 -1.095
85 HG1 THR 13 HG1 THR 13 0.301 3.324 0.105
86 HG21 THR 13 HG21 THR 13 -2.323 3.003 -0.190
87 HG22 THR 13 HG22 THR 13 -2.415 1.942 -1.596
88 HG23 THR 13 HG23 THR 13 -1.319 3.323 -1.603
89 H CYS 14 H CYS 14 -3.448 1.959 1.245
90 HA CYS 14 HA CYS 14 -4.703 -0.596 0.480
91 HB2 CYS 14 HB2 CYS 14 -5.490 1.368 2.629
92 HB3 CYS 14 HB1 CYS 14 -6.603 0.156 2.006
93 H THR 15 H THR 15 -6.986 -0.321 -0.291
94 HA THR 15 HA THR 15 -7.256 2.169 -1.847
95 HB THR 15 HB THR 15 -8.377 0.860 -3.610
96 HG1 THR 15 HG1 THR 15 -9.133 -0.977 -2.785
97 HG21 THR 15 HG21 THR 15 -5.814 -0.592 -3.221
98 HG22 THR 15 HG22 THR 15 -5.752 1.169 -3.300
99 HG23 THR 15 HG23 THR 15 -6.434 0.249 -4.641
100 HA PRO 16 HA PRO 16 -11.243 2.722 -0.090
101 HB2 PRO 16 HB2 PRO 16 -12.539 3.953 -2.133
102 HB3 PRO 16 HB1 PRO 16 -11.298 4.753 -1.162
103 HG2 PRO 16 HG2 PRO 16 -11.062 3.481 -3.863
104 HG3 PRO 16 HG1 PRO 16 -10.383 5.013 -3.285
105 HD2 PRO 16 HD2 PRO 16 -8.916 2.745 -3.464
106 HD3 PRO 16 HD1 PRO 16 -8.622 3.975 -2.219
107 H ASP 17 H ASP 17 -10.816 0.854 -2.954
108 HA ASP 17 HA ASP 17 -13.521 0.054 -3.329
109 HB2 ASP 17 HB2 ASP 17 -11.479 -0.107 -4.952
110 HB3 ASP 17 HB1 ASP 17 -11.192 -1.649 -4.152
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -10.840 -1.990 -2.244
2 HA2 GLY 1 HA2 GLY 1 -11.406 -2.120 0.435
3 HA3 GLY 1 HA1 GLY 1 -12.476 -3.310 -0.295
4 H ASP 2 H ASP 2 -9.086 -2.347 -0.839
5 HA ASP 2 HA ASP 2 -8.095 -4.873 0.093
6 HB2 ASP 2 HB2 ASP 2 -9.003 -5.231 -2.314
7 HB3 ASP 2 HB1 ASP 2 -7.576 -4.330 -2.816
8 H CYS 3 H CYS 3 -5.774 -4.971 0.120
9 HA CYS 3 HA CYS 3 -4.460 -2.378 -0.349
10 HB2 CYS 3 HB2 CYS 3 -3.837 -4.185 1.988
11 HB3 CYS 3 HB1 CYS 3 -3.267 -2.542 1.715
12 H TYR 4 H TYR 4 -1.989 -2.656 -0.228
13 HA TYR 4 HA TYR 4 -1.063 -5.251 -1.166
14 HB2 TYR 4 HB2 TYR 4 0.085 -4.123 -3.133
15 HB3 TYR 4 HB1 TYR 4 -1.658 -4.323 -3.267
16 HD1 TYR 4 HD1 TYR 4 -3.152 -2.358 -2.945
17 HD2 TYR 4 HD2 TYR 4 1.081 -1.960 -3.110
18 HE1 TYR 4 HE1 TYR 4 -3.400 0.052 -3.372
19 HE2 TYR 4 HE2 TYR 4 0.844 0.451 -3.536
20 HH TYR 4 HH TYR 4 -1.267 1.925 -4.646
21 H TRP 5 H TRP 5 1.240 -5.463 -1.153
22 HA TRP 5 HA TRP 5 2.477 -3.782 0.866
23 HB2 TRP 5 HB2 TRP 5 2.899 -6.050 1.268
24 HB3 TRP 5 HB1 TRP 5 3.197 -6.392 -0.435
25 HD1 TRP 5 HD TRP 5 5.663 -6.611 -1.085
26 HE1 TRP 5 HE1 TRP 5 7.912 -5.934 -0.033
27 HE3 TRP 5 HE3 TRP 5 3.920 -3.998 2.949
28 HZ2 TRP 5 HZ2 TRP 5 8.827 -4.485 2.210
29 HZ3 TRP 5 HZ3 TRP 5 5.549 -2.998 4.500
30 HH2 TRP 5 HH TRP 5 7.950 -3.238 4.136
31 H THR 6 H THR 6 4.342 -2.576 0.591
32 HA THR 6 HA THR 6 5.480 -2.358 -2.091
33 HB THR 6 HB THR 6 5.343 0.102 -2.072
34 HG1 THR 6 HG1 THR 6 5.073 0.699 0.010
35 HG21 THR 6 HG21 THR 6 3.007 0.299 -2.664
36 HG22 THR 6 HG22 THR 6 2.621 -1.170 -1.766
37 HG23 THR 6 HG23 THR 6 3.614 -1.261 -3.220
38 H SER 7 H SER 7 7.545 -1.333 -2.147
39 HA SER 7 HA SER 7 9.093 -1.824 0.219
40 HB2 SER 7 HB2 SER 7 9.756 -2.097 -2.309
41 HB3 SER 7 HB1 SER 7 10.198 -0.395 -2.174
42 HG SER 7 HG SER 7 11.858 -2.074 -1.670
43 H THR 8 H THR 8 8.774 1.087 -1.823
44 HA THR 8 HA THR 8 9.869 2.819 0.137
45 HB THR 8 HB THR 8 9.085 4.656 -1.305
46 HG1 THR 8 HG1 THR 8 7.838 4.210 -3.107
47 HG21 THR 8 HG21 THR 8 10.086 3.428 -3.530
48 HG22 THR 8 HG22 THR 8 10.698 2.392 -2.240
49 HG23 THR 8 HG23 THR 8 11.062 4.117 -2.233
50 HA PRO 9 HA PRO 9 6.432 3.729 2.715
51 HB2 PRO 9 HB2 PRO 9 6.940 6.319 3.353
52 HB3 PRO 9 HB1 PRO 9 7.880 4.969 3.998
53 HG2 PRO 9 HG2 PRO 9 8.522 6.810 1.728
54 HG3 PRO 9 HG1 PRO 9 9.580 6.216 3.020
55 HD2 PRO 9 HD2 PRO 9 9.589 5.157 0.528
56 HD3 PRO 9 HD1 PRO 9 9.926 4.190 1.978
57 HA PRO 10 HA PRO 10 4.718 4.341 3.762
58 HB2 PRO 10 HB2 PRO 10 2.219 3.370 3.334
59 HB3 PRO 10 HB1 PRO 10 2.529 5.033 3.852
60 HG2 PRO 10 HG2 PRO 10 1.947 3.980 1.111
61 HG3 PRO 10 HG1 PRO 10 1.317 5.433 1.909
62 HD2 PRO 10 HD2 PRO 10 3.323 5.522 0.093
63 HD3 PRO 10 HD1 PRO 10 3.214 6.659 1.452
64 H PHE 11 H PHE 11 5.185 2.279 4.314
65 HA PHE 11 HA PHE 11 5.998 0.426 2.369
66 HB2 PHE 11 HB2 PHE 11 5.263 -0.262 5.215
67 HB3 PHE 11 HB1 PHE 11 6.430 -1.074 4.176
68 HD1 PHE 11 HD2 PHE 11 7.941 1.192 3.090
69 HD2 PHE 11 HD1 PHE 11 6.490 0.486 7.027
70 HE1 PHE 11 HE2 PHE 11 9.737 2.606 4.001
71 HE2 PHE 11 HE1 PHE 11 8.282 1.900 7.945
72 HZ PHE 11 HZ PHE 11 9.907 2.963 6.432
73 H PHE 12 H PHE 12 2.930 1.000 3.863
74 HA PHE 12 HA PHE 12 1.796 -1.216 2.304
75 HB2 PHE 12 HB2 PHE 12 2.016 -1.666 4.840
76 HB3 PHE 12 HB1 PHE 12 0.708 -0.500 5.016
77 HD1 PHE 12 HD1 PHE 12 1.590 -3.622 3.192
78 HD2 PHE 12 HD2 PHE 12 -1.481 -1.219 4.898
79 HE1 PHE 12 HE1 PHE 12 -0.048 -5.402 2.740
80 HE2 PHE 12 HE2 PHE 12 -3.124 -2.995 4.450
81 HZ PHE 12 HZ PHE 12 -2.409 -5.090 3.371
82 H THR 13 H THR 13 0.164 -0.616 1.038
83 HA THR 13 HA THR 13 -1.250 1.892 1.670
84 HB THR 13 HB THR 13 -0.455 0.893 -1.072
85 HG1 THR 13 HG1 THR 13 1.296 1.949 -0.443
86 HG21 THR 13 HG21 THR 13 -2.534 1.942 -1.379
87 HG22 THR 13 HG22 THR 13 -1.351 3.204 -1.729
88 HG23 THR 13 HG23 THR 13 -2.184 3.181 -0.174
89 H CYS 14 H CYS 14 -3.447 1.965 1.279
90 HA CYS 14 HA CYS 14 -4.699 -0.589 0.508
91 HB2 CYS 14 HB2 CYS 14 -5.485 1.374 2.657
92 HB3 CYS 14 HB1 CYS 14 -6.604 0.168 2.030
93 H THR 15 H THR 15 -7.007 -0.296 -0.230
94 HA THR 15 HA THR 15 -7.280 2.195 -1.784
95 HB THR 15 HB THR 15 -8.365 0.895 -3.574
96 HG1 THR 15 HG1 THR 15 -7.971 -1.474 -3.410
97 HG21 THR 15 HG21 THR 15 -5.757 -0.483 -3.125
98 HG22 THR 15 HG22 THR 15 -5.775 1.272 -3.296
99 HG23 THR 15 HG23 THR 15 -6.404 0.253 -4.591
100 HA PRO 16 HA PRO 16 -11.291 2.664 -0.055
101 HB2 PRO 16 HB2 PRO 16 -12.587 3.903 -2.093
102 HB3 PRO 16 HB1 PRO 16 -11.367 4.709 -1.099
103 HG2 PRO 16 HG2 PRO 16 -11.089 3.479 -3.815
104 HG3 PRO 16 HG1 PRO 16 -10.437 5.013 -3.209
105 HD2 PRO 16 HD2 PRO 16 -8.935 2.769 -3.407
106 HD3 PRO 16 HD1 PRO 16 -8.671 3.987 -2.142
107 H ASP 17 H ASP 17 -10.851 0.910 -3.012
108 HA ASP 17 HA ASP 17 -13.523 0.058 -3.405
109 HB2 ASP 17 HB2 ASP 17 -10.927 -1.250 -4.248
110 HB3 ASP 17 HB1 ASP 17 -12.525 -1.688 -4.848
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -10.805 -1.957 -2.257
2 HA2 GLY 1 HA2 GLY 1 -11.442 -2.133 0.382
3 HA3 GLY 1 HA1 GLY 1 -12.496 -3.324 -0.366
4 H ASP 2 H ASP 2 -9.090 -2.349 -0.785
5 HA ASP 2 HA ASP 2 -8.105 -4.858 0.160
6 HB2 ASP 2 HB2 ASP 2 -8.995 -5.318 -2.214
7 HB3 ASP 2 HB1 ASP 2 -7.622 -4.365 -2.770
8 H CYS 3 H CYS 3 -5.772 -4.962 0.162
9 HA CYS 3 HA CYS 3 -4.474 -2.364 -0.326
10 HB2 CYS 3 HB2 CYS 3 -3.824 -4.165 2.009
11 HB3 CYS 3 HB1 CYS 3 -3.262 -2.520 1.728
12 H TYR 4 H TYR 4 -2.001 -2.632 -0.226
13 HA TYR 4 HA TYR 4 -1.077 -5.224 -1.178
14 HB2 TYR 4 HB2 TYR 4 0.066 -4.081 -3.140
15 HB3 TYR 4 HB1 TYR 4 -1.678 -4.281 -3.270
16 HD1 TYR 4 HD1 TYR 4 -3.169 -2.317 -2.929
17 HD2 TYR 4 HD2 TYR 4 1.063 -1.920 -3.104
18 HE1 TYR 4 HE1 TYR 4 -3.418 0.096 -3.336
19 HE2 TYR 4 HE2 TYR 4 0.826 0.494 -3.512
20 HH TYR 4 HH TYR 4 -0.775 2.080 -4.297
21 H TRP 5 H TRP 5 1.223 -5.444 -1.162
22 HA TRP 5 HA TRP 5 2.467 -3.770 0.858
23 HB2 TRP 5 HB2 TRP 5 2.882 -6.040 1.256
24 HB3 TRP 5 HB1 TRP 5 3.177 -6.382 -0.447
25 HD1 TRP 5 HD TRP 5 5.641 -6.608 -1.102
26 HE1 TRP 5 HE1 TRP 5 7.894 -5.942 -0.053
27 HE3 TRP 5 HE3 TRP 5 3.914 -3.994 2.939
28 HZ2 TRP 5 HZ2 TRP 5 8.818 -4.499 2.192
29 HZ3 TRP 5 HZ3 TRP 5 5.547 -3.003 4.489
30 HH2 TRP 5 HH TRP 5 7.949 -3.252 4.121
31 H THR 6 H THR 6 4.340 -2.573 0.581
32 HA THR 6 HA THR 6 5.475 -2.356 -2.101
33 HB THR 6 HB THR 6 5.345 0.104 -2.082
34 HG1 THR 6 HG1 THR 6 4.914 0.960 -0.196
35 HG21 THR 6 HG21 THR 6 2.707 -1.346 -1.864
36 HG22 THR 6 HG22 THR 6 3.649 -1.054 -3.327
37 HG23 THR 6 HG23 THR 6 2.887 0.294 -2.485
38 H SER 7 H SER 7 7.544 -1.337 -2.158
39 HA SER 7 HA SER 7 9.091 -1.834 0.206
40 HB2 SER 7 HB2 SER 7 9.938 -2.300 -2.089
41 HB3 SER 7 HB1 SER 7 9.964 -0.565 -2.401
42 HG SER 7 HG SER 7 11.842 -0.548 -1.485
43 H THR 8 H THR 8 8.781 1.079 -1.832
44 HA THR 8 HA THR 8 9.882 2.807 0.129
45 HB THR 8 HB THR 8 9.100 4.648 -1.311
46 HG1 THR 8 HG1 THR 8 7.360 4.246 -2.441
47 HG21 THR 8 HG21 THR 8 10.434 4.125 -3.244
48 HG22 THR 8 HG22 THR 8 10.256 2.394 -2.953
49 HG23 THR 8 HG23 THR 8 11.187 3.386 -1.832
50 HA PRO 9 HA PRO 9 6.450 3.723 2.712
51 HB2 PRO 9 HB2 PRO 9 6.965 6.311 3.352
52 HB3 PRO 9 HB1 PRO 9 7.903 4.957 3.995
53 HG2 PRO 9 HG2 PRO 9 8.547 6.800 1.725
54 HG3 PRO 9 HG1 PRO 9 9.605 6.202 3.016
55 HD2 PRO 9 HD2 PRO 9 9.608 5.146 0.522
56 HD3 PRO 9 HD1 PRO 9 9.944 4.176 1.970
57 HA PRO 10 HA PRO 10 4.739 4.337 3.761
58 HB2 PRO 10 HB2 PRO 10 2.237 3.373 3.335
59 HB3 PRO 10 HB1 PRO 10 2.552 5.033 3.855
60 HG2 PRO 10 HG2 PRO 10 1.964 3.986 1.113
61 HG3 PRO 10 HG1 PRO 10 1.338 5.439 1.914
62 HD2 PRO 10 HD2 PRO 10 3.343 5.526 0.095
63 HD3 PRO 10 HD1 PRO 10 3.238 6.661 1.456
64 H PHE 11 H PHE 11 5.201 2.273 4.309
65 HA PHE 11 HA PHE 11 6.008 0.421 2.362
66 HB2 PHE 11 HB2 PHE 11 5.274 -0.270 5.206
67 HB3 PHE 11 HB1 PHE 11 6.439 -1.082 4.165
68 HD1 PHE 11 HD2 PHE 11 7.954 1.181 3.080
69 HD2 PHE 11 HD1 PHE 11 6.505 0.475 7.020
70 HE1 PHE 11 HE2 PHE 11 9.753 2.590 3.992
71 HE2 PHE 11 HE1 PHE 11 8.301 1.884 7.937
72 HZ PHE 11 HZ PHE 11 9.928 2.944 6.423
73 H PHE 12 H PHE 12 2.945 0.994 3.868
74 HA PHE 12 HA PHE 12 1.801 -1.211 2.300
75 HB2 PHE 12 HB2 PHE 12 2.033 -1.680 4.832
76 HB3 PHE 12 HB1 PHE 12 0.729 -0.512 5.023
77 HD1 PHE 12 HD1 PHE 12 1.577 -3.588 3.099
78 HD2 PHE 12 HD2 PHE 12 -1.447 -1.260 4.985
79 HE1 PHE 12 HE1 PHE 12 -0.067 -5.361 2.643
80 HE2 PHE 12 HE2 PHE 12 -3.096 -3.030 4.533
81 HZ PHE 12 HZ PHE 12 -2.406 -5.084 3.362
82 H THR 13 H THR 13 0.160 -0.602 1.049
83 HA THR 13 HA THR 13 -1.252 1.900 1.708
84 HB THR 13 HB THR 13 -0.457 0.933 -1.045
85 HG1 THR 13 HG1 THR 13 1.089 2.417 -0.933
86 HG21 THR 13 HG21 THR 13 -2.235 3.161 -0.111
87 HG22 THR 13 HG22 THR 13 -2.507 1.983 -1.396
88 HG23 THR 13 HG23 THR 13 -1.350 3.293 -1.630
89 H CYS 14 H CYS 14 -3.449 1.973 1.325
90 HA CYS 14 HA CYS 14 -4.699 -0.579 0.539
91 HB2 CYS 14 HB2 CYS 14 -5.488 1.389 2.684
92 HB3 CYS 14 HB1 CYS 14 -6.613 0.191 2.051
93 H THR 15 H THR 15 -7.027 -0.265 -0.174
94 HA THR 15 HA THR 15 -7.298 2.223 -1.730
95 HB THR 15 HB THR 15 -8.341 0.928 -3.549
96 HG1 THR 15 HG1 THR 15 -8.690 -1.168 -3.354
97 HG21 THR 15 HG21 THR 15 -5.959 -0.599 -3.625
98 HG22 THR 15 HG22 THR 15 -5.581 0.922 -2.816
99 HG23 THR 15 HG23 THR 15 -6.295 0.934 -4.428
100 HA PRO 16 HA PRO 16 -11.336 2.608 -0.047
101 HB2 PRO 16 HB2 PRO 16 -12.626 3.854 -2.086
102 HB3 PRO 16 HB1 PRO 16 -11.430 4.665 -1.067
103 HG2 PRO 16 HG2 PRO 16 -11.101 3.473 -3.793
104 HG3 PRO 16 HG1 PRO 16 -10.480 5.009 -3.161
105 HD2 PRO 16 HD2 PRO 16 -8.941 2.791 -3.367
106 HD3 PRO 16 HD1 PRO 16 -8.712 3.996 -2.084
107 H ASP 17 H ASP 17 -10.858 0.936 -3.053
108 HA ASP 17 HA ASP 17 -13.498 0.041 -3.490
109 HB2 ASP 17 HB2 ASP 17 -11.035 -1.517 -4.257
110 HB3 ASP 17 HB1 ASP 17 -12.585 -1.441 -5.091
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -10.784 -2.045 -2.221
2 HA2 GLY 1 HA2 GLY 1 -11.502 -2.165 0.427
3 HA3 GLY 1 HA1 GLY 1 -12.509 -3.370 -0.361
4 H ASP 2 H ASP 2 -9.137 -2.411 -0.944
5 HA ASP 2 HA ASP 2 -8.126 -4.870 0.167
6 HB2 ASP 2 HB2 ASP 2 -8.234 -4.423 -2.807
7 HB3 ASP 2 HB1 ASP 2 -6.992 -5.440 -2.082
8 H CYS 3 H CYS 3 -5.778 -4.967 0.142
9 HA CYS 3 HA CYS 3 -4.512 -2.355 -0.348
10 HB2 CYS 3 HB2 CYS 3 -3.825 -4.151 1.979
11 HB3 CYS 3 HB1 CYS 3 -3.289 -2.499 1.700
12 H TYR 4 H TYR 4 -2.036 -2.593 -0.263
13 HA TYR 4 HA TYR 4 -1.098 -5.172 -1.245
14 HB2 TYR 4 HB2 TYR 4 0.049 -3.992 -3.180
15 HB3 TYR 4 HB1 TYR 4 -1.695 -4.185 -3.319
16 HD1 TYR 4 HD1 TYR 4 -3.183 -2.225 -2.939
17 HD2 TYR 4 HD2 TYR 4 1.050 -1.834 -3.101
18 HE1 TYR 4 HE1 TYR 4 -3.426 0.195 -3.300
19 HE2 TYR 4 HE2 TYR 4 0.819 0.588 -3.461
20 HH TYR 4 HH TYR 4 -1.314 2.094 -4.531
21 H TRP 5 H TRP 5 1.196 -5.397 -1.210
22 HA TRP 5 HA TRP 5 2.434 -3.737 0.830
23 HB2 TRP 5 HB2 TRP 5 2.822 -6.011 1.236
24 HB3 TRP 5 HB1 TRP 5 3.131 -6.358 -0.464
25 HD1 TRP 5 HD TRP 5 5.600 -6.610 -1.089
26 HE1 TRP 5 HE1 TRP 5 7.848 -5.961 -0.017
27 HE3 TRP 5 HE3 TRP 5 3.854 -3.968 2.924
28 HZ2 TRP 5 HZ2 TRP 5 8.760 -4.521 2.233
29 HZ3 TRP 5 HZ3 TRP 5 5.480 -2.988 4.489
30 HH2 TRP 5 HH TRP 5 7.882 -3.261 4.149
31 H THR 6 H THR 6 4.320 -2.560 0.568
32 HA THR 6 HA THR 6 5.483 -2.360 -2.103
33 HB THR 6 HB THR 6 5.377 0.101 -2.094
34 HG1 THR 6 HG1 THR 6 4.023 1.125 -0.560
35 HG21 THR 6 HG21 THR 6 3.655 -1.189 -3.286
36 HG22 THR 6 HG22 THR 6 3.011 0.326 -2.653
37 HG23 THR 6 HG23 THR 6 2.659 -1.194 -1.831
38 H SER 7 H SER 7 7.560 -1.349 -2.142
39 HA SER 7 HA SER 7 9.080 -1.856 0.238
40 HB2 SER 7 HB2 SER 7 9.740 -2.099 -2.316
41 HB3 SER 7 HB1 SER 7 10.264 -0.428 -2.106
42 HG SER 7 HG SER 7 11.451 -1.261 -0.220
43 H THR 8 H THR 8 8.813 1.055 -1.810
44 HA THR 8 HA THR 8 9.909 2.778 0.157
45 HB THR 8 HB THR 8 9.154 4.621 -1.294
46 HG1 THR 8 HG1 THR 8 8.156 2.785 -3.168
47 HG21 THR 8 HG21 THR 8 11.172 3.982 -2.119
48 HG22 THR 8 HG22 THR 8 10.190 3.498 -3.503
49 HG23 THR 8 HG23 THR 8 10.683 2.300 -2.307
50 HA PRO 9 HA PRO 9 6.462 3.727 2.708
51 HB2 PRO 9 HB2 PRO 9 6.991 6.313 3.346
52 HB3 PRO 9 HB1 PRO 9 7.913 4.953 3.999
53 HG2 PRO 9 HG2 PRO 9 8.591 6.785 1.732
54 HG3 PRO 9 HG1 PRO 9 9.634 6.183 3.033
55 HD2 PRO 9 HD2 PRO 9 9.650 5.120 0.542
56 HD3 PRO 9 HD1 PRO 9 9.967 4.151 1.996
57 HA PRO 10 HA PRO 10 4.746 4.351 3.737
58 HB2 PRO 10 HB2 PRO 10 2.241 3.403 3.288
59 HB3 PRO 10 HB1 PRO 10 2.562 5.062 3.809
60 HG2 PRO 10 HG2 PRO 10 1.994 4.016 1.062
61 HG3 PRO 10 HG1 PRO 10 1.371 5.474 1.856
62 HD2 PRO 10 HD2 PRO 10 3.394 5.547 0.058
63 HD3 PRO 10 HD1 PRO 10 3.283 6.684 1.417
64 H PHE 11 H PHE 11 5.189 2.284 4.291
65 HA PHE 11 HA PHE 11 6.002 0.425 2.352
66 HB2 PHE 11 HB2 PHE 11 5.238 -0.258 5.191
67 HB3 PHE 11 HB1 PHE 11 6.407 -1.078 4.161
68 HD1 PHE 11 HD2 PHE 11 7.949 1.173 3.091
69 HD2 PHE 11 HD1 PHE 11 6.453 0.483 7.015
70 HE1 PHE 11 HE2 PHE 11 9.747 2.572 4.018
71 HE2 PHE 11 HE1 PHE 11 8.248 1.882 7.950
72 HZ PHE 11 HZ PHE 11 9.899 2.928 6.451
73 H PHE 12 H PHE 12 2.944 0.949 3.937
74 HA PHE 12 HA PHE 12 1.790 -1.214 2.313
75 HB2 PHE 12 HB2 PHE 12 2.036 -1.697 4.850
76 HB3 PHE 12 HB1 PHE 12 0.706 -0.557 5.038
77 HD1 PHE 12 HD1 PHE 12 1.678 -3.713 3.351
78 HD2 PHE 12 HD2 PHE 12 -1.500 -1.239 4.728
79 HE1 PHE 12 HE1 PHE 12 0.073 -5.515 2.873
80 HE2 PHE 12 HE2 PHE 12 -3.110 -3.037 4.253
81 HZ PHE 12 HZ PHE 12 -2.326 -5.179 3.323
82 H THR 13 H THR 13 0.154 -0.583 1.069
83 HA THR 13 HA THR 13 -1.271 1.898 1.776
84 HB THR 13 HB THR 13 -0.456 1.005 -0.996
85 HG1 THR 13 HG1 THR 13 1.280 2.068 -0.372
86 HG21 THR 13 HG21 THR 13 -2.164 3.292 -0.036
87 HG22 THR 13 HG22 THR 13 -2.569 2.049 -1.220
88 HG23 THR 13 HG23 THR 13 -1.378 3.289 -1.615
89 H CYS 14 H CYS 14 -3.467 1.970 1.376
90 HA CYS 14 HA CYS 14 -4.696 -0.576 0.542
91 HB2 CYS 14 HB2 CYS 14 -5.525 1.375 2.687
92 HB3 CYS 14 HB1 CYS 14 -6.633 0.175 2.030
93 H THR 15 H THR 15 -7.058 -0.225 -0.141
94 HA THR 15 HA THR 15 -7.304 2.261 -1.698
95 HB THR 15 HB THR 15 -8.311 0.984 -3.549
96 HG1 THR 15 HG1 THR 15 -7.905 -1.118 -1.752
97 HG21 THR 15 HG21 THR 15 -6.268 0.944 -4.436
98 HG22 THR 15 HG22 THR 15 -5.884 -0.523 -3.534
99 HG23 THR 15 HG23 THR 15 -5.578 1.059 -2.817
100 HA PRO 16 HA PRO 16 -11.369 2.595 -0.068
101 HB2 PRO 16 HB2 PRO 16 -12.638 3.858 -2.109
102 HB3 PRO 16 HB1 PRO 16 -11.464 4.665 -1.063
103 HG2 PRO 16 HG2 PRO 16 -11.086 3.512 -3.799
104 HG3 PRO 16 HG1 PRO 16 -10.486 5.044 -3.138
105 HD2 PRO 16 HD2 PRO 16 -8.928 2.840 -3.352
106 HD3 PRO 16 HD1 PRO 16 -8.726 4.030 -2.049
107 H ASP 17 H ASP 17 -10.767 0.856 -2.980
108 HA ASP 17 HA ASP 17 -13.407 -0.013 -3.533
109 HB2 ASP 17 HB2 ASP 17 -10.674 -0.995 -4.305
110 HB3 ASP 17 HB1 ASP 17 -12.110 -1.925 -4.724
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -10.840 -1.983 -2.210
2 HA2 GLY 1 HA2 GLY 1 -11.391 -2.118 0.468
3 HA3 GLY 1 HA1 GLY 1 -12.463 -3.311 -0.252
4 H ASP 2 H ASP 2 -9.089 -2.352 -0.881
5 HA ASP 2 HA ASP 2 -8.089 -4.881 0.060
6 HB2 ASP 2 HB2 ASP 2 -8.940 -5.445 -2.215
7 HB3 ASP 2 HB1 ASP 2 -7.836 -4.247 -2.887
8 H CYS 3 H CYS 3 -5.773 -4.975 0.097
9 HA CYS 3 HA CYS 3 -4.456 -2.382 -0.361
10 HB2 CYS 3 HB2 CYS 3 -3.840 -4.194 1.973
11 HB3 CYS 3 HB1 CYS 3 -3.269 -2.551 1.706
12 H TYR 4 H TYR 4 -1.986 -2.662 -0.235
13 HA TYR 4 HA TYR 4 -1.056 -5.255 -1.173
14 HB2 TYR 4 HB2 TYR 4 0.094 -4.125 -3.138
15 HB3 TYR 4 HB1 TYR 4 -1.649 -4.329 -3.275
16 HD1 TYR 4 HD1 TYR 4 -3.147 -2.366 -2.957
17 HD2 TYR 4 HD2 TYR 4 1.086 -1.962 -3.116
18 HE1 TYR 4 HE1 TYR 4 -3.399 0.043 -3.384
19 HE2 TYR 4 HE2 TYR 4 0.845 0.449 -3.542
20 HH TYR 4 HH TYR 4 -2.353 1.941 -3.900
21 H TRP 5 H TRP 5 1.245 -5.469 -1.152
22 HA TRP 5 HA TRP 5 2.477 -3.784 0.867
23 HB2 TRP 5 HB2 TRP 5 2.900 -6.051 1.271
24 HB3 TRP 5 HB1 TRP 5 3.201 -6.395 -0.430
25 HD1 TRP 5 HD TRP 5 5.668 -6.613 -1.075
26 HE1 TRP 5 HE1 TRP 5 7.916 -5.935 -0.019
27 HE3 TRP 5 HE3 TRP 5 3.917 -3.996 2.952
28 HZ2 TRP 5 HZ2 TRP 5 8.825 -4.483 2.223
29 HZ3 TRP 5 HZ3 TRP 5 5.542 -2.995 4.506
30 HH2 TRP 5 HH TRP 5 7.945 -3.235 4.147
31 H THR 6 H THR 6 4.342 -2.577 0.594
32 HA THR 6 HA THR 6 5.485 -2.361 -2.085
33 HB THR 6 HB THR 6 5.347 0.098 -2.070
34 HG1 THR 6 HG1 THR 6 3.924 1.073 -0.526
35 HG21 THR 6 HG21 THR 6 3.554 -1.449 -3.080
36 HG22 THR 6 HG22 THR 6 3.149 0.253 -2.857
37 HG23 THR 6 HG23 THR 6 2.557 -0.951 -1.713
38 H SER 7 H SER 7 7.550 -1.333 -2.138
39 HA SER 7 HA SER 7 9.094 -1.822 0.230
40 HB2 SER 7 HB2 SER 7 10.130 -2.363 -1.856
41 HB3 SER 7 HB1 SER 7 9.811 -0.753 -2.505
42 HG SER 7 HG SER 7 11.694 -1.548 -0.566
43 H THR 8 H THR 8 8.779 1.087 -1.814
44 HA THR 8 HA THR 8 9.868 2.821 0.148
45 HB THR 8 HB THR 8 9.087 4.657 -1.298
46 HG1 THR 8 HG1 THR 8 7.975 2.634 -2.964
47 HG21 THR 8 HG21 THR 8 11.164 3.276 -1.794
48 HG22 THR 8 HG22 THR 8 10.496 4.199 -3.141
49 HG23 THR 8 HG23 THR 8 10.204 2.464 -3.030
50 HA PRO 9 HA PRO 9 6.424 3.731 2.718
51 HB2 PRO 9 HB2 PRO 9 6.929 6.322 3.354
52 HB3 PRO 9 HB1 PRO 9 7.869 4.972 4.003
53 HG2 PRO 9 HG2 PRO 9 8.515 6.813 1.731
54 HG3 PRO 9 HG1 PRO 9 9.571 6.221 3.028
55 HD2 PRO 9 HD2 PRO 9 9.586 5.160 0.537
56 HD3 PRO 9 HD1 PRO 9 9.921 4.194 1.988
57 HA PRO 10 HA PRO 10 4.709 4.343 3.759
58 HB2 PRO 10 HB2 PRO 10 2.211 3.372 3.328
59 HB3 PRO 10 HB1 PRO 10 2.519 5.034 3.844
60 HG2 PRO 10 HG2 PRO 10 1.943 3.979 1.103
61 HG3 PRO 10 HG1 PRO 10 1.310 5.432 1.897
62 HD2 PRO 10 HD2 PRO 10 3.321 5.520 0.087
63 HD3 PRO 10 HD1 PRO 10 3.208 6.658 1.445
64 H PHE 11 H PHE 11 5.175 2.282 4.313
65 HA PHE 11 HA PHE 11 5.993 0.428 2.372
66 HB2 PHE 11 HB2 PHE 11 5.252 -0.258 5.217
67 HB3 PHE 11 HB1 PHE 11 6.421 -1.070 4.181
68 HD1 PHE 11 HD2 PHE 11 7.935 1.196 3.097
69 HD2 PHE 11 HD1 PHE 11 6.473 0.493 7.032
70 HE1 PHE 11 HE2 PHE 11 9.727 2.612 4.011
71 HE2 PHE 11 HE1 PHE 11 8.263 1.909 7.953
72 HZ PHE 11 HZ PHE 11 9.894 2.969 6.442
73 H PHE 12 H PHE 12 2.922 1.003 3.858
74 HA PHE 12 HA PHE 12 1.792 -1.216 2.299
75 HB2 PHE 12 HB2 PHE 12 2.008 -1.661 4.838
76 HB3 PHE 12 HB1 PHE 12 0.696 -0.500 5.006
77 HD1 PHE 12 HD1 PHE 12 1.593 -3.618 3.183
78 HD2 PHE 12 HD2 PHE 12 -1.490 -1.229 4.889
79 HE1 PHE 12 HE1 PHE 12 -0.038 -5.404 2.729
80 HE2 PHE 12 HE2 PHE 12 -3.125 -3.012 4.438
81 HZ PHE 12 HZ PHE 12 -2.400 -5.103 3.358
82 H THR 13 H THR 13 0.156 -0.621 1.034
83 HA THR 13 HA THR 13 -1.258 1.889 1.660
84 HB THR 13 HB THR 13 -0.459 0.886 -1.079
85 HG1 THR 13 HG1 THR 13 1.285 1.965 -0.506
86 HG21 THR 13 HG21 THR 13 -2.238 3.125 -0.176
87 HG22 THR 13 HG22 THR 13 -2.504 1.936 -1.451
88 HG23 THR 13 HG23 THR 13 -1.346 3.243 -1.692
89 H CYS 14 H CYS 14 -3.455 1.960 1.268
90 HA CYS 14 HA CYS 14 -4.706 -0.595 0.494
91 HB2 CYS 14 HB2 CYS 14 -5.484 1.361 2.654
92 HB3 CYS 14 HB1 CYS 14 -6.611 0.166 2.020
93 H THR 15 H THR 15 -6.997 -0.315 -0.264
94 HA THR 15 HA THR 15 -7.270 2.177 -1.816
95 HB THR 15 HB THR 15 -8.378 0.874 -3.589
96 HG1 THR 15 HG1 THR 15 -9.134 -0.930 -2.572
97 HG21 THR 15 HG21 THR 15 -5.760 -0.491 -3.105
98 HG22 THR 15 HG22 THR 15 -5.804 1.251 -3.380
99 HG23 THR 15 HG23 THR 15 -6.428 0.148 -4.605
100 HA PRO 16 HA PRO 16 -11.266 2.696 -0.067
101 HB2 PRO 16 HB2 PRO 16 -12.563 3.933 -2.107
102 HB3 PRO 16 HB1 PRO 16 -11.329 4.734 -1.127
103 HG2 PRO 16 HG2 PRO 16 -11.079 3.481 -3.834
104 HG3 PRO 16 HG1 PRO 16 -10.410 5.014 -3.244
105 HD2 PRO 16 HD2 PRO 16 -8.929 2.754 -3.434
106 HD3 PRO 16 HD1 PRO 16 -8.647 3.979 -2.180
107 H ASP 17 H ASP 17 -10.841 0.885 -2.980
108 HA ASP 17 HA ASP 17 -13.532 0.062 -3.356
109 HB2 ASP 17 HB2 ASP 17 -11.958 -0.114 -5.180
110 HB3 ASP 17 HB1 ASP 17 -10.923 -1.184 -4.240
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -10.837 -2.039 -2.213
2 HA2 GLY 1 HA2 GLY 1 -11.410 -2.107 0.481
3 HA3 GLY 1 HA1 GLY 1 -12.468 -3.309 -0.241
4 H ASP 2 H ASP 2 -9.103 -2.371 -0.922
5 HA ASP 2 HA ASP 2 -8.099 -4.873 0.103
6 HB2 ASP 2 HB2 ASP 2 -8.945 -5.471 -2.171
7 HB3 ASP 2 HB1 ASP 2 -7.819 -4.301 -2.855
8 H CYS 3 H CYS 3 -5.774 -4.970 0.122
9 HA CYS 3 HA CYS 3 -4.469 -2.375 -0.361
10 HB2 CYS 3 HB2 CYS 3 -3.834 -4.174 1.981
11 HB3 CYS 3 HB1 CYS 3 -3.268 -2.530 1.700
12 H TYR 4 H TYR 4 -1.996 -2.648 -0.245
13 HA TYR 4 HA TYR 4 -1.069 -5.242 -1.183
14 HB2 TYR 4 HB2 TYR 4 0.081 -4.110 -3.147
15 HB3 TYR 4 HB1 TYR 4 -1.663 -4.308 -3.282
16 HD1 TYR 4 HD1 TYR 4 -3.154 -2.343 -2.955
17 HD2 TYR 4 HD2 TYR 4 1.079 -1.947 -3.118
18 HE1 TYR 4 HE1 TYR 4 -3.402 0.068 -3.376
19 HE2 TYR 4 HE2 TYR 4 0.843 0.464 -3.538
20 HH TYR 4 HH TYR 4 -0.996 1.987 -4.543
21 H TRP 5 H TRP 5 1.234 -5.457 -1.167
22 HA TRP 5 HA TRP 5 2.469 -3.781 0.856
23 HB2 TRP 5 HB2 TRP 5 2.890 -6.050 1.252
24 HB3 TRP 5 HB1 TRP 5 3.189 -6.389 -0.450
25 HD1 TRP 5 HD TRP 5 5.655 -6.607 -1.099
26 HE1 TRP 5 HE1 TRP 5 7.905 -5.935 -0.044
27 HE3 TRP 5 HE3 TRP 5 3.912 -4.002 2.939
28 HZ2 TRP 5 HZ2 TRP 5 8.819 -4.492 2.203
29 HZ3 TRP 5 HZ3 TRP 5 5.540 -3.008 4.493
30 HH2 TRP 5 HH TRP 5 7.942 -3.249 4.131
31 H THR 6 H THR 6 4.338 -2.577 0.584
32 HA THR 6 HA THR 6 5.477 -2.354 -2.096
33 HB THR 6 HB THR 6 5.342 0.106 -2.072
34 HG1 THR 6 HG1 THR 6 3.659 0.912 -0.498
35 HG21 THR 6 HG21 THR 6 2.595 -1.098 -1.749
36 HG22 THR 6 HG22 THR 6 3.595 -1.312 -3.186
37 HG23 THR 6 HG23 THR 6 3.048 0.300 -2.723
38 H SER 7 H SER 7 7.543 -1.325 -2.148
39 HA SER 7 HA SER 7 9.088 -1.825 0.217
40 HB2 SER 7 HB2 SER 7 9.857 -2.219 -2.177
41 HB3 SER 7 HB1 SER 7 10.054 -0.472 -2.305
42 HG SER 7 HG SER 7 11.850 -0.642 -1.243
43 H THR 8 H THR 8 8.773 1.091 -1.816
44 HA THR 8 HA THR 8 9.868 2.817 0.149
45 HB THR 8 HB THR 8 9.085 4.659 -1.290
46 HG1 THR 8 HG1 THR 8 7.787 4.260 -3.029
47 HG21 THR 8 HG21 THR 8 11.128 3.121 -1.796
48 HG22 THR 8 HG22 THR 8 10.580 4.268 -3.020
49 HG23 THR 8 HG23 THR 8 10.142 2.564 -3.148
50 HA PRO 9 HA PRO 9 6.429 3.723 2.726
51 HB2 PRO 9 HB2 PRO 9 6.938 6.312 3.371
52 HB3 PRO 9 HB1 PRO 9 7.877 4.959 4.013
53 HG2 PRO 9 HG2 PRO 9 8.522 6.806 1.747
54 HG3 PRO 9 HG1 PRO 9 9.579 6.209 3.039
55 HD2 PRO 9 HD2 PRO 9 9.589 5.155 0.544
56 HD3 PRO 9 HD1 PRO 9 9.925 4.184 1.992
57 HA PRO 10 HA PRO 10 4.716 4.332 3.773
58 HB2 PRO 10 HB2 PRO 10 2.216 3.364 3.341
59 HB3 PRO 10 HB1 PRO 10 2.526 5.024 3.863
60 HG2 PRO 10 HG2 PRO 10 1.946 3.979 1.118
61 HG3 PRO 10 HG1 PRO 10 1.316 5.430 1.921
62 HD2 PRO 10 HD2 PRO 10 3.324 5.524 0.106
63 HD3 PRO 10 HD1 PRO 10 3.214 6.658 1.468
64 H PHE 11 H PHE 11 5.181 2.268 4.318
65 HA PHE 11 HA PHE 11 5.994 0.421 2.369
66 HB2 PHE 11 HB2 PHE 11 5.258 -0.276 5.213
67 HB3 PHE 11 HB1 PHE 11 6.426 -1.084 4.173
68 HD1 PHE 11 HD2 PHE 11 7.939 1.183 3.094
69 HD2 PHE 11 HD1 PHE 11 6.482 0.472 7.029
70 HE1 PHE 11 HE2 PHE 11 9.734 2.596 4.011
71 HE2 PHE 11 HE1 PHE 11 8.273 1.884 7.952
72 HZ PHE 11 HZ PHE 11 9.903 2.947 6.443
73 H PHE 12 H PHE 12 2.926 0.996 3.859
74 HA PHE 12 HA PHE 12 1.791 -1.217 2.296
75 HB2 PHE 12 HB2 PHE 12 2.016 -1.644 4.850
76 HB3 PHE 12 HB1 PHE 12 0.671 -0.516 4.993
77 HD1 PHE 12 HD1 PHE 12 1.689 -3.659 3.294
78 HD2 PHE 12 HD2 PHE 12 -1.510 -1.265 4.760
79 HE1 PHE 12 HE1 PHE 12 0.113 -5.489 2.830
80 HE2 PHE 12 HE2 PHE 12 -3.092 -3.091 4.299
81 HZ PHE 12 HZ PHE 12 -2.282 -5.208 3.334
82 H THR 13 H THR 13 0.164 -0.609 1.028
83 HA THR 13 HA THR 13 -1.253 1.895 1.669
84 HB THR 13 HB THR 13 -0.452 0.909 -1.076
85 HG1 THR 13 HG1 THR 13 1.295 1.974 -0.470
86 HG21 THR 13 HG21 THR 13 -2.501 1.961 -1.434
87 HG22 THR 13 HG22 THR 13 -1.338 3.263 -1.682
88 HG23 THR 13 HG23 THR 13 -2.223 3.149 -0.161
89 H CYS 14 H CYS 14 -3.449 1.967 1.275
90 HA CYS 14 HA CYS 14 -4.699 -0.587 0.497
91 HB2 CYS 14 HB2 CYS 14 -5.493 1.384 2.638
92 HB3 CYS 14 HB1 CYS 14 -6.612 0.179 2.007
93 H THR 15 H THR 15 -7.020 -0.278 -0.229
94 HA THR 15 HA THR 15 -7.276 2.202 -1.802
95 HB THR 15 HB THR 15 -8.357 0.897 -3.591
96 HG1 THR 15 HG1 THR 15 -9.056 -1.005 -2.961
97 HG21 THR 15 HG21 THR 15 -5.720 1.206 -3.198
98 HG22 THR 15 HG22 THR 15 -6.391 0.380 -4.605
99 HG23 THR 15 HG23 THR 15 -5.803 -0.555 -3.231
100 HA PRO 16 HA PRO 16 -11.290 2.685 -0.088
101 HB2 PRO 16 HB2 PRO 16 -12.577 3.920 -2.135
102 HB3 PRO 16 HB1 PRO 16 -11.358 4.726 -1.141
103 HG2 PRO 16 HG2 PRO 16 -11.075 3.485 -3.850
104 HG3 PRO 16 HG1 PRO 16 -10.422 5.020 -3.248
105 HD2 PRO 16 HD2 PRO 16 -8.923 2.773 -3.433
106 HD3 PRO 16 HD1 PRO 16 -8.662 3.994 -2.172
107 H ASP 17 H ASP 17 -10.807 0.857 -2.971
108 HA ASP 17 HA ASP 17 -13.490 0.027 -3.398
109 HB2 ASP 17 HB2 ASP 17 -10.839 -1.142 -4.247
110 HB3 ASP 17 HB1 ASP 17 -12.388 -1.834 -4.723
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -10.845 -1.974 -2.244
2 HA2 GLY 1 HA2 GLY 1 -11.396 -2.108 0.435
3 HA3 GLY 1 HA1 GLY 1 -12.473 -3.295 -0.286
4 H ASP 2 H ASP 2 -9.081 -2.336 -0.828
5 HA ASP 2 HA ASP 2 -8.096 -4.870 0.084
6 HB2 ASP 2 HB2 ASP 2 -7.309 -5.770 -1.962
7 HB3 ASP 2 HB1 ASP 2 -8.985 -5.320 -2.260
8 H CYS 3 H CYS 3 -5.776 -4.973 0.113
9 HA CYS 3 HA CYS 3 -4.454 -2.383 -0.347
10 HB2 CYS 3 HB2 CYS 3 -3.842 -4.194 1.990
11 HB3 CYS 3 HB1 CYS 3 -3.267 -2.552 1.721
12 H TYR 4 H TYR 4 -1.985 -2.669 -0.220
13 HA TYR 4 HA TYR 4 -1.060 -5.266 -1.152
14 HB2 TYR 4 HB2 TYR 4 0.087 -4.147 -3.124
15 HB3 TYR 4 HB1 TYR 4 -1.657 -4.347 -3.256
16 HD1 TYR 4 HD1 TYR 4 -3.148 -2.379 -2.943
17 HD2 TYR 4 HD2 TYR 4 1.085 -1.985 -3.111
18 HE1 TYR 4 HE1 TYR 4 -3.395 0.029 -3.380
19 HE2 TYR 4 HE2 TYR 4 0.850 0.424 -3.548
20 HH TYR 4 HH TYR 4 -2.196 1.870 -4.282
21 H TRP 5 H TRP 5 1.247 -5.473 -1.146
22 HA TRP 5 HA TRP 5 2.483 -3.790 0.871
23 HB2 TRP 5 HB2 TRP 5 2.911 -6.056 1.269
24 HB3 TRP 5 HB1 TRP 5 3.207 -6.397 -0.433
25 HD1 TRP 5 HD TRP 5 5.672 -6.608 -1.089
26 HE1 TRP 5 HE1 TRP 5 7.923 -5.926 -0.043
27 HE3 TRP 5 HE3 TRP 5 3.931 -4.003 2.950
28 HZ2 TRP 5 HZ2 TRP 5 8.839 -4.477 2.199
29 HZ3 TRP 5 HZ3 TRP 5 5.560 -3.001 4.498
30 HH2 TRP 5 HH TRP 5 7.963 -3.234 4.128
31 H THR 6 H THR 6 4.342 -2.578 0.592
32 HA THR 6 HA THR 6 5.475 -2.354 -2.091
33 HB THR 6 HB THR 6 5.332 0.105 -2.070
34 HG1 THR 6 HG1 THR 6 4.637 1.115 -0.345
35 HG21 THR 6 HG21 THR 6 2.565 -1.031 -1.719
36 HG22 THR 6 HG22 THR 6 3.564 -1.383 -3.130
37 HG23 THR 6 HG23 THR 6 3.082 0.277 -2.782
38 H SER 7 H SER 7 7.538 -1.328 -2.151
39 HA SER 7 HA SER 7 9.091 -1.816 0.210
40 HB2 SER 7 HB2 SER 7 10.065 -2.339 -1.940
41 HB3 SER 7 HB1 SER 7 9.839 -0.680 -2.493
42 HG SER 7 HG SER 7 12.000 -1.426 -1.599
43 H THR 8 H THR 8 8.762 1.096 -1.828
44 HA THR 8 HA THR 8 9.858 2.828 0.131
45 HB THR 8 HB THR 8 9.067 4.665 -1.309
46 HG1 THR 8 HG1 THR 8 7.246 4.162 -2.302
47 HG21 THR 8 HG21 THR 8 10.455 4.199 -3.178
48 HG22 THR 8 HG22 THR 8 10.193 2.461 -3.027
49 HG23 THR 8 HG23 THR 8 11.149 3.317 -1.818
50 HA PRO 9 HA PRO 9 6.423 3.731 2.716
51 HB2 PRO 9 HB2 PRO 9 6.926 6.321 3.354
52 HB3 PRO 9 HB1 PRO 9 7.871 4.973 3.996
53 HG2 PRO 9 HG2 PRO 9 8.506 6.817 1.726
54 HG3 PRO 9 HG1 PRO 9 9.568 6.224 3.016
55 HD2 PRO 9 HD2 PRO 9 9.574 5.166 0.524
56 HD3 PRO 9 HD1 PRO 9 9.915 4.199 1.973
57 HA PRO 10 HA PRO 10 4.711 4.339 3.766
58 HB2 PRO 10 HB2 PRO 10 2.212 3.365 3.343
59 HB3 PRO 10 HB1 PRO 10 2.521 5.027 3.860
60 HG2 PRO 10 HG2 PRO 10 1.934 3.974 1.121
61 HG3 PRO 10 HG1 PRO 10 1.304 5.426 1.920
62 HD2 PRO 10 HD2 PRO 10 3.306 5.519 0.100
63 HD3 PRO 10 HD1 PRO 10 3.198 6.655 1.460
64 H PHE 11 H PHE 11 5.183 2.279 4.315
65 HA PHE 11 HA PHE 11 5.995 0.427 2.370
66 HB2 PHE 11 HB2 PHE 11 5.266 -0.262 5.216
67 HB3 PHE 11 HB1 PHE 11 6.431 -1.072 4.175
68 HD1 PHE 11 HD2 PHE 11 7.938 1.197 3.086
69 HD2 PHE 11 HD1 PHE 11 6.496 0.486 7.027
70 HE1 PHE 11 HE2 PHE 11 9.732 2.613 3.995
71 HE2 PHE 11 HE1 PHE 11 8.289 1.902 7.942
72 HZ PHE 11 HZ PHE 11 9.910 2.967 6.426
73 H PHE 12 H PHE 12 2.928 1.000 3.863
74 HA PHE 12 HA PHE 12 1.796 -1.222 2.310
75 HB2 PHE 12 HB2 PHE 12 2.015 -1.658 4.852
76 HB3 PHE 12 HB1 PHE 12 0.700 -0.498 5.015
77 HD1 PHE 12 HD1 PHE 12 1.600 -3.616 3.191
78 HD2 PHE 12 HD2 PHE 12 -1.480 -1.238 4.915
79 HE1 PHE 12 HE1 PHE 12 -0.027 -5.407 2.745
80 HE2 PHE 12 HE2 PHE 12 -3.113 -3.025 4.473
81 HZ PHE 12 HZ PHE 12 -2.387 -5.113 3.385
82 H THR 13 H THR 13 0.175 -0.621 1.033
83 HA THR 13 HA THR 13 -1.241 1.889 1.655
84 HB THR 13 HB THR 13 -0.453 0.869 -1.081
85 HG1 THR 13 HG1 THR 13 1.234 2.100 -0.786
86 HG21 THR 13 HG21 THR 13 -2.102 3.243 -0.223
87 HG22 THR 13 HG22 THR 13 -2.576 1.925 -1.296
88 HG23 THR 13 HG23 THR 13 -1.370 3.100 -1.822
89 H CYS 14 H CYS 14 -3.438 1.962 1.265
90 HA CYS 14 HA CYS 14 -4.697 -0.593 0.505
91 HB2 CYS 14 HB2 CYS 14 -5.471 1.370 2.661
92 HB3 CYS 14 HB1 CYS 14 -6.594 0.166 2.038
93 H THR 15 H THR 15 -6.980 -0.319 -0.261
94 HA THR 15 HA THR 15 -7.265 2.179 -1.803
95 HB THR 15 HB THR 15 -8.366 0.876 -3.581
96 HG1 THR 15 HG1 THR 15 -8.247 -1.413 -3.475
97 HG21 THR 15 HG21 THR 15 -5.761 1.230 -3.296
98 HG22 THR 15 HG22 THR 15 -6.412 0.248 -4.609
99 HG23 THR 15 HG23 THR 15 -5.772 -0.529 -3.162
100 HA PRO 16 HA PRO 16 -11.263 2.673 -0.054
101 HB2 PRO 16 HB2 PRO 16 -12.565 3.910 -2.090
102 HB3 PRO 16 HB1 PRO 16 -11.336 4.714 -1.107
103 HG2 PRO 16 HG2 PRO 16 -11.079 3.471 -3.819
104 HG3 PRO 16 HG1 PRO 16 -10.416 5.005 -3.223
105 HD2 PRO 16 HD2 PRO 16 -8.925 2.753 -3.419
106 HD3 PRO 16 HD1 PRO 16 -8.649 3.975 -2.162
107 H ASP 17 H ASP 17 -10.860 0.923 -3.024
108 HA ASP 17 HA ASP 17 -13.534 0.075 -3.388
109 HB2 ASP 17 HB2 ASP 17 -10.876 -0.978 -4.327
110 HB3 ASP 17 HB1 ASP 17 -12.374 -1.834 -4.686