NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
553355 |
2lyf   |
18723 | 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 -12.300 -1.232 1.748
2 HA2 GLY 1 2HA GLY 1 -12.973 -3.516 1.828
3 HA3 GLY 1 1HA GLY 1 -14.389 -3.085 0.879
4 H PHE 2 H PHE 2 -12.239 -1.464 -0.726
5 HA PHE 2 HA PHE 2 -11.730 -3.635 -2.598
6 HB2 PHE 2 2HB PHE 2 -12.832 -1.593 -3.475
7 HB3 PHE 2 1HB PHE 2 -11.483 -0.625 -2.902
8 HD1 PHE 2 1HD PHE 2 -12.390 -3.337 -5.248
9 HD2 PHE 2 2HD PHE 2 -9.586 -0.307 -4.224
10 HE1 PHE 2 1HE PHE 2 -11.231 -3.691 -7.389
11 HE2 PHE 2 2HE PHE 2 -8.424 -0.652 -6.350
12 HZ PHE 2 HZ PHE 2 -9.246 -2.351 -7.942
13 H CYS 3 H CYS 3 -9.669 -4.321 -2.975
14 HA CYS 3 HA CYS 3 -7.652 -3.018 -1.331
15 HB2 CYS 3 2HB CYS 3 -7.821 -5.910 -2.146
16 HB3 CYS 3 1HB CYS 3 -6.546 -5.190 -1.163
17 H ARG 4 H ARG 4 -5.842 -2.368 -2.108
18 HA ARG 4 HA ARG 4 -5.137 -2.935 -4.882
19 HB2 ARG 4 2HB ARG 4 -4.624 -0.452 -5.086
20 HB3 ARG 4 1HB ARG 4 -6.333 -0.860 -5.041
21 HG2 ARG 4 2HG ARG 4 -6.373 -0.324 -2.637
22 HG3 ARG 4 1HG ARG 4 -4.683 0.161 -2.749
23 HD2 ARG 4 2HD ARG 4 -5.241 1.937 -4.245
24 HD3 ARG 4 1HD ARG 4 -6.924 1.401 -4.327
25 HE ARG 4 HE ARG 4 -6.841 1.812 -1.802
26 HH11 ARG 4 1HH1 ARG 4 -5.108 3.820 -4.166
27 HH12 ARG 4 2HH1 ARG 4 -5.252 5.244 -3.255
28 HH21 ARG 4 1HH2 ARG 4 -7.045 3.708 -0.588
29 HH22 ARG 4 2HH2 ARG 4 -6.415 5.193 -1.140
30 H CYS 5 H CYS 5 -2.810 -2.512 -5.225
31 HA CYS 5 HA CYS 5 -1.464 -2.535 -2.649
32 HB2 CYS 5 2HB CYS 5 -0.657 -4.167 -5.062
33 HB3 CYS 5 1HB CYS 5 0.210 -4.081 -3.526
34 H LEU 6 H LEU 6 0.220 -1.379 -2.291
35 HA LEU 6 HA LEU 6 1.188 0.343 -4.480
36 HB2 LEU 6 2HB LEU 6 -0.131 1.578 -2.789
37 HB3 LEU 6 1HB LEU 6 0.910 0.961 -1.528
38 HG LEU 6 HG LEU 6 2.816 2.197 -2.555
39 HD11 LEU 6 1HD1 LEU 6 2.007 2.363 -4.830
40 HD12 LEU 6 2HD1 LEU 6 2.337 3.965 -4.171
41 HD13 LEU 6 3HD1 LEU 6 0.676 3.392 -4.303
42 HD21 LEU 6 3HD2 LEU 6 2.101 4.402 -1.775
43 HD22 LEU 6 1HD2 LEU 6 1.592 3.128 -0.669
44 HD23 LEU 6 2HD2 LEU 6 0.424 3.854 -1.771
45 H CYS 7 H CYS 7 3.386 0.274 -4.764
46 HA CYS 7 HA CYS 7 4.802 -1.263 -2.746
47 HB2 CYS 7 2HB CYS 7 5.384 -1.160 -5.712
48 HB3 CYS 7 1HB CYS 7 6.285 -2.092 -4.519
49 H ARG 8 H ARG 8 6.733 -0.567 -2.040
50 HA ARG 8 HA ARG 8 7.655 2.033 -3.028
51 HB2 ARG 8 2HB ARG 8 6.349 2.155 -0.858
52 HB3 ARG 8 1HB ARG 8 7.605 1.160 -0.136
53 HG2 ARG 8 2HG ARG 8 9.256 2.913 -0.753
54 HG3 ARG 8 1HG ARG 8 7.910 3.917 -1.292
55 HD2 ARG 8 2HD ARG 8 8.470 2.927 1.497
56 HD3 ARG 8 1HD ARG 8 8.499 4.586 0.923
57 HE ARG 8 HE ARG 8 6.093 2.930 1.236
58 HH11 ARG 8 1HH1 ARG 8 7.590 6.143 1.068
59 HH12 ARG 8 2HH1 ARG 8 6.213 6.984 1.588
60 HH21 ARG 8 1HH2 ARG 8 4.186 4.095 2.044
61 HH22 ARG 8 2HH2 ARG 8 4.232 5.778 2.196
62 H ARG 9 H ARG 9 9.485 1.385 -4.040
63 HA ARG 9 HA ARG 9 11.612 0.725 -4.369
64 HB2 ARG 9 2HB ARG 9 11.910 2.126 -2.320
65 HB3 ARG 9 1HB ARG 9 11.746 0.668 -1.356
66 HG2 ARG 9 2HG ARG 9 13.804 -0.211 -2.256
67 HG3 ARG 9 1HG ARG 9 13.942 1.156 -3.366
68 HD2 ARG 9 2HD ARG 9 13.945 1.324 -0.361
69 HD3 ARG 9 1HD ARG 9 15.385 1.391 -1.384
70 HE ARG 9 HE ARG 9 14.002 3.342 -2.425
71 HH11 ARG 9 1HH1 ARG 9 14.541 2.636 0.999
72 HH12 ARG 9 2HH1 ARG 9 14.356 4.257 1.502
73 HH21 ARG 9 1HH2 ARG 9 13.735 5.527 -1.742
74 HH22 ARG 9 2HH2 ARG 9 13.889 5.956 -0.100
75 H GLY 10 H GLY 10 9.620 -1.227 -4.364
76 HA2 GLY 10 2HA GLY 10 9.840 -3.475 -4.978
77 HA3 GLY 10 1HA GLY 10 11.297 -3.556 -3.992
78 H VAL 11 H VAL 11 9.487 -2.099 -1.888
79 HA VAL 11 HA VAL 11 8.557 -4.593 -0.706
80 HB VAL 11 HB VAL 11 8.700 -1.797 0.474
81 HG11 VAL 11 1HG1 VAL 11 8.221 -4.449 1.828
82 HG12 VAL 11 2HG1 VAL 11 7.018 -3.185 1.569
83 HG13 VAL 11 3HG1 VAL 11 8.394 -2.891 2.638
84 HG21 VAL 11 3HG2 VAL 11 10.647 -2.623 1.721
85 HG22 VAL 11 1HG2 VAL 11 10.920 -2.644 -0.022
86 HG23 VAL 11 2HG2 VAL 11 10.560 -4.146 0.835
87 H CYS 12 H CYS 12 6.497 -5.130 -1.068
88 HA CYS 12 HA CYS 12 4.724 -2.998 -1.883
89 HB2 CYS 12 2HB CYS 12 4.411 -5.960 -2.290
90 HB3 CYS 12 1HB CYS 12 3.249 -4.709 -2.747
91 H ARG 13 H ARG 13 3.075 -2.396 -0.907
92 HA ARG 13 HA ARG 13 2.175 -3.863 1.472
93 HB2 ARG 13 2HB ARG 13 3.286 -1.812 2.158
94 HB3 ARG 13 1HB ARG 13 2.338 -0.882 1.004
95 HG2 ARG 13 2HG ARG 13 0.284 -1.584 2.242
96 HG3 ARG 13 1HG ARG 13 1.331 -2.298 3.460
97 HD2 ARG 13 2HD ARG 13 2.267 -0.160 3.991
98 HD3 ARG 13 1HD ARG 13 1.426 0.591 2.632
99 HE ARG 13 HE ARG 13 -0.310 -0.733 4.472
100 HH11 ARG 13 1HH1 ARG 13 1.347 2.335 3.837
101 HH12 ARG 13 2HH1 ARG 13 0.224 3.276 4.695
102 HH21 ARG 13 1HH2 ARG 13 -1.856 0.534 5.600
103 HH22 ARG 13 2HH2 ARG 13 -1.667 2.227 5.732
104 H CYS 14 H CYS 14 0.075 -4.419 1.310
105 HA CYS 14 HA CYS 14 -1.358 -3.115 -0.810
106 HB2 CYS 14 2HB CYS 14 -1.964 -5.733 0.579
107 HB3 CYS 14 1HB CYS 14 -2.954 -5.029 -0.698
108 H ILE 15 H ILE 15 -3.205 -2.052 -0.472
109 HA ILE 15 HA ILE 15 -3.940 -1.657 2.306
110 HB ILE 15 HB ILE 15 -2.527 0.221 1.720
111 HG12 ILE 15 2HG1 ILE 15 -4.101 2.152 1.973
112 HG13 ILE 15 1HG1 ILE 15 -5.439 1.042 1.705
113 HG21 ILE 15 1HG2 ILE 15 -4.279 0.689 -0.669
114 HG22 ILE 15 2HG2 ILE 15 -2.605 0.135 -0.677
115 HG23 ILE 15 3HG2 ILE 15 -2.991 1.763 -0.120
116 HD11 ILE 15 3HD1 ILE 15 -3.466 0.922 3.978
117 HD12 ILE 15 1HD1 ILE 15 -4.816 -0.185 3.720
118 HD13 ILE 15 2HD1 ILE 15 -5.126 1.517 4.062
119 H CYS 16 H CYS 16 -6.005 -1.907 2.614
120 HA CYS 16 HA CYS 16 -7.741 -1.927 0.298
121 HB2 CYS 16 2HB CYS 16 -8.254 -2.939 3.102
122 HB3 CYS 16 1HB CYS 16 -9.325 -3.135 1.718
123 H THR 17 H THR 17 -9.225 -0.536 -0.014
124 HA THR 17 HA THR 17 -9.820 1.455 2.032
125 HB THR 17 HB THR 17 -9.392 1.978 -0.931
126 HG1 THR 17 1HG THR 17 -7.704 1.944 1.254
127 HG21 THR 17 3HG2 THR 17 -10.948 3.540 0.184
128 HG22 THR 17 1HG2 THR 17 -9.437 4.343 -0.255
129 HG23 THR 17 2HG2 THR 17 -9.724 3.866 1.417
130 H ARG 18 H ARG 18 -11.932 1.415 2.358
131 HA ARG 18 HA ARG 18 -14.102 1.007 2.294
132 HB2 ARG 18 2HB ARG 18 -15.460 1.723 0.415
133 HB3 ARG 18 1HB ARG 18 -14.123 2.841 0.580
134 HG2 ARG 18 2HG ARG 18 -13.022 1.913 -1.334
135 HG3 ARG 18 1HG ARG 18 -14.171 0.582 -1.414
136 HD2 ARG 18 2HD ARG 18 -15.965 2.266 -1.855
137 HD3 ARG 18 1HD ARG 18 -14.704 3.498 -1.943
138 HE ARG 18 HE ARG 18 -13.746 2.270 -3.789
139 HH11 ARG 18 1HH1 ARG 18 -17.124 1.520 -3.004
140 HH12 ARG 18 2HH1 ARG 18 -17.539 0.965 -4.541
141 HH21 ARG 18 1HH2 ARG 18 -14.308 1.536 -5.963
142 HH22 ARG 18 2HH2 ARG 18 -15.883 0.992 -6.293
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -12.658 -1.572 1.890
2 HA2 GLY 1 2HA GLY 1 -12.982 -3.791 1.281
3 HA3 GLY 1 1HA GLY 1 -14.277 -3.281 0.204
4 H PHE 2 H PHE 2 -12.153 -1.187 -0.719
5 HA PHE 2 HA PHE 2 -11.326 -2.802 -2.945
6 HB2 PHE 2 2HB PHE 2 -12.270 -0.673 -3.504
7 HB3 PHE 2 1HB PHE 2 -11.207 0.173 -2.401
8 HD1 PHE 2 2HD PHE 2 -11.155 -1.932 -5.472
9 HD2 PHE 2 1HD PHE 2 -9.244 1.124 -3.210
10 HE1 PHE 2 2HE PHE 2 -9.552 -1.565 -7.315
11 HE2 PHE 2 1HE PHE 2 -7.647 1.495 -5.048
12 HZ PHE 2 HZ PHE 2 -7.804 0.149 -7.099
13 H CYS 3 H CYS 3 -9.514 -3.812 -2.869
14 HA CYS 3 HA CYS 3 -7.421 -2.798 -1.141
15 HB2 CYS 3 2HB CYS 3 -7.691 -5.489 -2.460
16 HB3 CYS 3 1HB CYS 3 -6.331 -4.932 -1.471
17 H ARG 4 H ARG 4 -5.847 -1.805 -1.796
18 HA ARG 4 HA ARG 4 -5.156 -1.835 -4.636
19 HB2 ARG 4 2HB ARG 4 -5.895 0.353 -4.054
20 HB3 ARG 4 1HB ARG 4 -5.037 0.326 -2.531
21 HG2 ARG 4 2HG ARG 4 -3.974 1.843 -4.113
22 HG3 ARG 4 1HG ARG 4 -2.901 0.509 -3.714
23 HD2 ARG 4 2HD ARG 4 -3.545 -0.586 -5.833
24 HD3 ARG 4 1HD ARG 4 -4.547 0.811 -6.228
25 HE ARG 4 HE ARG 4 -2.200 1.977 -5.788
26 HH11 ARG 4 1HH1 ARG 4 -2.980 -0.867 -7.754
27 HH12 ARG 4 2HH1 ARG 4 -1.715 -0.615 -8.859
28 HH21 ARG 4 1HH2 ARG 4 -0.435 2.287 -7.299
29 HH22 ARG 4 2HH2 ARG 4 -0.229 1.214 -8.596
30 H CYS 5 H CYS 5 -3.368 -2.987 -4.953
31 HA CYS 5 HA CYS 5 -1.411 -3.003 -2.822
32 HB2 CYS 5 2HB CYS 5 -1.636 -4.819 -5.224
33 HB3 CYS 5 1HB CYS 5 -0.297 -4.759 -4.063
34 H LEU 6 H LEU 6 0.316 -2.017 -2.943
35 HA LEU 6 HA LEU 6 1.212 -1.043 -5.538
36 HB2 LEU 6 2HB LEU 6 1.675 1.218 -4.538
37 HB3 LEU 6 1HB LEU 6 -0.015 0.836 -4.741
38 HG LEU 6 HG LEU 6 0.026 0.250 -2.223
39 HD11 LEU 6 1HD1 LEU 6 1.670 1.443 -0.873
40 HD12 LEU 6 2HD1 LEU 6 2.530 1.913 -2.337
41 HD13 LEU 6 3HD1 LEU 6 2.429 0.211 -1.884
42 HD21 LEU 6 3HD2 LEU 6 -1.137 2.170 -3.134
43 HD22 LEU 6 1HD2 LEU 6 0.364 3.094 -3.152
44 HD23 LEU 6 2HD2 LEU 6 -0.346 2.601 -1.617
45 H CYS 7 H CYS 7 3.433 -0.785 -5.724
46 HA CYS 7 HA CYS 7 4.775 -1.883 -3.431
47 HB2 CYS 7 2HB CYS 7 5.754 -1.921 -6.297
48 HB3 CYS 7 1HB CYS 7 6.569 -2.606 -4.886
49 H ARG 8 H ARG 8 6.295 -0.915 -2.440
50 HA ARG 8 HA ARG 8 6.970 1.800 -3.261
51 HB2 ARG 8 2HB ARG 8 5.113 1.789 -1.684
52 HB3 ARG 8 1HB ARG 8 6.033 0.789 -0.588
53 HG2 ARG 8 2HG ARG 8 7.592 2.580 -0.174
54 HG3 ARG 8 1HG ARG 8 6.780 3.599 -1.368
55 HD2 ARG 8 2HD ARG 8 4.751 3.590 -0.066
56 HD3 ARG 8 1HD ARG 8 5.453 2.457 1.087
57 HE ARG 8 HE ARG 8 7.154 4.500 1.181
58 HH11 ARG 8 1HH1 ARG 8 3.613 4.509 1.304
59 HH12 ARG 8 2HH1 ARG 8 3.517 5.748 2.458
60 HH21 ARG 8 1HH2 ARG 8 7.001 6.193 2.800
61 HH22 ARG 8 2HH2 ARG 8 5.468 6.712 3.338
62 H ARG 9 H ARG 9 9.075 1.670 -3.604
63 HA ARG 9 HA ARG 9 11.299 1.456 -3.310
64 HB2 ARG 9 2HB ARG 9 10.703 2.725 -1.238
65 HB3 ARG 9 1HB ARG 9 10.585 1.195 -0.389
66 HG2 ARG 9 2HG ARG 9 12.956 0.803 -0.709
67 HG3 ARG 9 1HG ARG 9 13.090 2.290 -1.654
68 HD2 ARG 9 2HD ARG 9 12.466 3.607 0.268
69 HD3 ARG 9 1HD ARG 9 12.199 2.144 1.212
70 HE ARG 9 HE ARG 9 14.682 1.761 0.624
71 HH11 ARG 9 1HH1 ARG 9 13.218 4.891 1.438
72 HH12 ARG 9 2HH1 ARG 9 14.613 5.497 2.182
73 HH21 ARG 9 1HH2 ARG 9 16.595 2.629 1.653
74 HH22 ARG 9 2HH2 ARG 9 16.569 4.197 2.301
75 H GLY 10 H GLY 10 9.791 -0.859 -3.864
76 HA2 GLY 10 2HA GLY 10 10.655 -2.954 -4.467
77 HA3 GLY 10 1HA GLY 10 11.794 -2.812 -3.139
78 H VAL 11 H VAL 11 9.342 -1.944 -1.460
79 HA VAL 11 HA VAL 11 8.646 -4.683 -0.709
80 HB VAL 11 HB VAL 11 8.165 -2.073 0.776
81 HG11 VAL 11 1HG1 VAL 11 7.974 -4.927 1.728
82 HG12 VAL 11 2HG1 VAL 11 6.628 -3.830 1.433
83 HG13 VAL 11 3HG1 VAL 11 7.769 -3.491 2.731
84 HG21 VAL 11 3HG2 VAL 11 10.559 -2.468 0.547
85 HG22 VAL 11 1HG2 VAL 11 10.364 -4.104 1.176
86 HG23 VAL 11 2HG2 VAL 11 10.052 -2.718 2.219
87 H CYS 12 H CYS 12 6.538 -5.392 -1.090
88 HA CYS 12 HA CYS 12 4.853 -3.320 -2.150
89 HB2 CYS 12 2HB CYS 12 4.427 -6.301 -2.375
90 HB3 CYS 12 1HB CYS 12 3.463 -5.020 -3.120
91 H ARG 13 H ARG 13 3.111 -2.657 -1.375
92 HA ARG 13 HA ARG 13 2.361 -3.634 1.299
93 HB2 ARG 13 2HB ARG 13 3.842 -1.512 1.077
94 HB3 ARG 13 1HB ARG 13 2.430 -0.749 0.398
95 HG2 ARG 13 2HG ARG 13 2.608 -1.885 3.195
96 HG3 ARG 13 1HG ARG 13 2.848 -0.199 2.771
97 HD2 ARG 13 2HD ARG 13 0.485 -0.218 1.872
98 HD3 ARG 13 1HD ARG 13 0.311 -1.817 2.600
99 HE ARG 13 HE ARG 13 1.245 0.338 4.296
100 HH11 ARG 13 1HH1 ARG 13 -1.483 -1.807 3.447
101 HH12 ARG 13 2HH1 ARG 13 -2.425 -1.325 4.762
102 HH21 ARG 13 1HH2 ARG 13 -0.115 0.976 6.120
103 HH22 ARG 13 2HH2 ARG 13 -1.645 0.265 6.311
104 H CYS 14 H CYS 14 0.223 -4.172 1.237
105 HA CYS 14 HA CYS 14 -1.349 -2.957 -0.874
106 HB2 CYS 14 2HB CYS 14 -1.908 -5.470 0.729
107 HB3 CYS 14 1HB CYS 14 -2.965 -4.819 -0.516
108 H ILE 15 H ILE 15 -3.104 -1.763 -0.375
109 HA ILE 15 HA ILE 15 -3.799 -1.466 2.435
110 HB ILE 15 HB ILE 15 -2.448 0.430 1.901
111 HG12 ILE 15 2HG1 ILE 15 -4.047 2.364 2.063
112 HG13 ILE 15 1HG1 ILE 15 -5.363 1.228 1.796
113 HG21 ILE 15 1HG2 ILE 15 -4.106 0.889 -0.553
114 HG22 ILE 15 2HG2 ILE 15 -2.440 0.312 -0.486
115 HG23 ILE 15 3HG2 ILE 15 -2.826 1.952 0.046
116 HD11 ILE 15 3HD1 ILE 15 -3.441 1.207 4.111
117 HD12 ILE 15 1HD1 ILE 15 -4.739 0.046 3.845
118 HD13 ILE 15 2HD1 ILE 15 -5.121 1.742 4.148
119 H CYS 16 H CYS 16 -5.856 -1.871 2.740
120 HA CYS 16 HA CYS 16 -7.713 -1.747 0.482
121 HB2 CYS 16 2HB CYS 16 -8.050 -3.215 3.099
122 HB3 CYS 16 1HB CYS 16 -9.109 -3.310 1.703
123 H THR 17 H THR 17 -9.213 -0.371 0.436
124 HA THR 17 HA THR 17 -10.166 0.889 2.879
125 HB THR 17 HB THR 17 -9.354 2.419 0.377
126 HG1 THR 17 1HG THR 17 -7.952 1.565 2.513
127 HG21 THR 17 3HG2 THR 17 -10.256 3.383 3.108
128 HG22 THR 17 1HG2 THR 17 -11.225 3.437 1.633
129 HG23 THR 17 2HG2 THR 17 -9.759 4.409 1.765
130 H ARG 18 H ARG 18 -12.360 0.819 2.855
131 HA ARG 18 HA ARG 18 -14.535 0.627 2.190
132 HB2 ARG 18 2HB ARG 18 -13.921 2.681 0.832
133 HB3 ARG 18 1HB ARG 18 -13.558 1.614 -0.512
134 HG2 ARG 18 2HG ARG 18 -16.074 0.842 -0.037
135 HG3 ARG 18 1HG ARG 18 -16.163 2.510 0.552
136 HD2 ARG 18 2HD ARG 18 -16.727 2.487 -1.792
137 HD3 ARG 18 1HD ARG 18 -15.158 3.257 -1.572
138 HE ARG 18 HE ARG 18 -15.188 0.422 -2.156
139 HH11 ARG 18 1HH1 ARG 18 -14.506 3.702 -3.330
140 HH12 ARG 18 2HH1 ARG 18 -13.732 3.218 -4.758
141 HH21 ARG 18 1HH2 ARG 18 -14.129 -0.283 -4.157
142 HH22 ARG 18 2HH2 ARG 18 -13.530 0.875 -5.251
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -12.769 -2.106 1.912
2 HA2 GLY 1 2HA GLY 1 -12.822 -4.445 1.650
3 HA3 GLY 1 1HA GLY 1 -14.251 -4.261 0.645
4 H PHE 2 H PHE 2 -12.177 -2.076 -0.544
5 HA PHE 2 HA PHE 2 -11.200 -3.929 -2.566
6 HB2 PHE 2 2HB PHE 2 -12.587 -2.281 -3.563
7 HB3 PHE 2 1HB PHE 2 -11.871 -0.975 -2.634
8 HD1 PHE 2 1HD PHE 2 -10.989 -3.545 -5.195
9 HD2 PHE 2 2HD PHE 2 -10.252 0.349 -3.646
10 HE1 PHE 2 1HE PHE 2 -9.459 -3.096 -7.058
11 HE2 PHE 2 2HE PHE 2 -8.722 0.807 -5.515
12 HZ PHE 2 HZ PHE 2 -8.321 -0.915 -7.223
13 H CYS 3 H CYS 3 -9.087 -4.341 -2.606
14 HA CYS 3 HA CYS 3 -7.381 -2.578 -1.045
15 HB2 CYS 3 2HB CYS 3 -6.827 -5.390 -1.988
16 HB3 CYS 3 1HB CYS 3 -5.784 -4.391 -0.976
17 H ARG 4 H ARG 4 -5.984 -1.378 -1.856
18 HA ARG 4 HA ARG 4 -5.311 -1.603 -4.699
19 HB2 ARG 4 2HB ARG 4 -4.775 0.887 -4.500
20 HB3 ARG 4 1HB ARG 4 -6.474 0.467 -4.380
21 HG2 ARG 4 2HG ARG 4 -6.354 0.659 -1.935
22 HG3 ARG 4 1HG ARG 4 -4.645 1.057 -2.061
23 HD2 ARG 4 2HD ARG 4 -6.859 2.680 -3.309
24 HD3 ARG 4 1HD ARG 4 -6.167 3.017 -1.723
25 HE ARG 4 HE ARG 4 -4.371 2.896 -4.009
26 HH11 ARG 4 1HH1 ARG 4 -6.139 4.953 -1.729
27 HH12 ARG 4 2HH1 ARG 4 -5.151 6.316 -2.004
28 HH21 ARG 4 1HH2 ARG 4 -3.035 4.776 -4.373
29 HH22 ARG 4 2HH2 ARG 4 -3.330 6.210 -3.508
30 H CYS 5 H CYS 5 -3.233 -2.059 -5.131
31 HA CYS 5 HA CYS 5 -1.425 -2.049 -2.849
32 HB2 CYS 5 2HB CYS 5 -1.371 -3.724 -5.345
33 HB3 CYS 5 1HB CYS 5 -0.100 -3.706 -4.121
34 H LEU 6 H LEU 6 0.416 -1.099 -2.827
35 HA LEU 6 HA LEU 6 1.466 0.075 -5.298
36 HB2 LEU 6 2HB LEU 6 2.113 2.156 -4.176
37 HB3 LEU 6 1HB LEU 6 0.384 1.947 -4.142
38 HG LEU 6 HG LEU 6 2.157 1.366 -1.750
39 HD11 LEU 6 1HD1 LEU 6 1.462 3.562 -0.918
40 HD12 LEU 6 2HD1 LEU 6 0.665 3.891 -2.462
41 HD13 LEU 6 3HD1 LEU 6 2.412 3.699 -2.396
42 HD21 LEU 6 3HD2 LEU 6 -0.812 1.914 -1.976
43 HD22 LEU 6 1HD2 LEU 6 0.078 1.613 -0.484
44 HD23 LEU 6 2HD2 LEU 6 -0.081 0.335 -1.684
45 H CYS 7 H CYS 7 3.707 -0.006 -5.494
46 HA CYS 7 HA CYS 7 4.948 -1.446 -3.286
47 HB2 CYS 7 2HB CYS 7 5.645 -1.645 -6.219
48 HB3 CYS 7 1HB CYS 7 6.437 -2.519 -4.907
49 H ARG 8 H ARG 8 6.927 -0.847 -2.524
50 HA ARG 8 HA ARG 8 8.187 1.472 -3.757
51 HB2 ARG 8 2HB ARG 8 6.569 2.159 -2.039
52 HB3 ARG 8 1HB ARG 8 7.431 1.199 -0.864
53 HG2 ARG 8 2HG ARG 8 9.412 2.581 -1.112
54 HG3 ARG 8 1HG ARG 8 8.589 3.551 -2.342
55 HD2 ARG 8 2HD ARG 8 8.493 4.662 -0.163
56 HD3 ARG 8 1HD ARG 8 6.888 4.170 -0.709
57 HE ARG 8 HE ARG 8 8.318 2.351 1.015
58 HH11 ARG 8 1HH1 ARG 8 5.736 4.787 0.772
59 HH12 ARG 8 2HH1 ARG 8 5.029 4.376 2.268
60 HH21 ARG 8 1HH2 ARG 8 7.305 1.769 3.025
61 HH22 ARG 8 2HH2 ARG 8 5.923 2.606 3.563
62 H ARG 9 H ARG 9 10.144 0.761 -4.167
63 HA ARG 9 HA ARG 9 12.226 -0.093 -4.024
64 HB2 ARG 9 2HB ARG 9 12.223 1.659 -2.204
65 HB3 ARG 9 1HB ARG 9 11.931 0.349 -1.069
66 HG2 ARG 9 2HG ARG 9 14.078 -0.681 -1.729
67 HG3 ARG 9 1HG ARG 9 14.382 0.678 -2.813
68 HD2 ARG 9 2HD ARG 9 15.572 0.969 -0.713
69 HD3 ARG 9 1HD ARG 9 14.325 2.205 -0.898
70 HE ARG 9 HE ARG 9 13.104 0.207 0.473
71 HH11 ARG 9 1HH1 ARG 9 16.032 2.066 1.090
72 HH12 ARG 9 2HH1 ARG 9 15.866 2.028 2.789
73 HH21 ARG 9 1HH2 ARG 9 12.873 0.151 2.763
74 HH22 ARG 9 2HH2 ARG 9 14.022 0.884 3.774
75 H GLY 10 H GLY 10 10.264 -2.013 -4.074
76 HA2 GLY 10 2HA GLY 10 10.660 -4.331 -4.250
77 HA3 GLY 10 1HA GLY 10 11.818 -4.170 -2.943
78 H VAL 11 H VAL 11 9.487 -2.539 -1.545
79 HA VAL 11 HA VAL 11 8.172 -4.993 -0.683
80 HB VAL 11 HB VAL 11 9.438 -3.887 1.155
81 HG11 VAL 11 1HG1 VAL 11 9.226 -1.561 0.523
82 HG12 VAL 11 2HG1 VAL 11 8.678 -1.818 2.177
83 HG13 VAL 11 3HG1 VAL 11 7.498 -1.607 0.879
84 HG21 VAL 11 3HG2 VAL 11 7.552 -5.281 1.742
85 HG22 VAL 11 1HG2 VAL 11 6.450 -3.918 1.549
86 HG23 VAL 11 2HG2 VAL 11 7.638 -3.916 2.851
87 H CYS 12 H CYS 12 6.130 -5.274 -1.111
88 HA CYS 12 HA CYS 12 4.725 -2.981 -2.143
89 HB2 CYS 12 2HB CYS 12 4.028 -5.898 -2.343
90 HB3 CYS 12 1HB CYS 12 3.093 -4.542 -2.988
91 H ARG 13 H ARG 13 3.135 -2.102 -1.291
92 HA ARG 13 HA ARG 13 2.115 -3.204 1.245
93 HB2 ARG 13 2HB ARG 13 3.514 -1.121 1.494
94 HB3 ARG 13 1HB ARG 13 2.360 -0.275 0.472
95 HG2 ARG 13 2HG ARG 13 1.885 0.280 2.750
96 HG3 ARG 13 1HG ARG 13 0.602 -0.786 2.173
97 HD2 ARG 13 2HD ARG 13 1.778 -2.702 3.228
98 HD3 ARG 13 1HD ARG 13 2.969 -1.579 3.873
99 HE ARG 13 HE ARG 13 0.308 -0.873 4.578
100 HH11 ARG 13 1HH1 ARG 13 2.998 -3.015 5.479
101 HH12 ARG 13 2HH1 ARG 13 2.470 -3.204 7.079
102 HH21 ARG 13 1HH2 ARG 13 -0.399 -1.169 6.823
103 HH22 ARG 13 2HH2 ARG 13 0.527 -2.150 7.860
104 H CYS 14 H CYS 14 -0.177 -3.104 1.458
105 HA CYS 14 HA CYS 14 -1.467 -2.001 -0.883
106 HB2 CYS 14 2HB CYS 14 -2.242 -4.599 0.487
107 HB3 CYS 14 1HB CYS 14 -3.098 -3.867 -0.860
108 H ILE 15 H ILE 15 -3.293 -0.829 -0.430
109 HA ILE 15 HA ILE 15 -4.030 -0.477 2.401
110 HB ILE 15 HB ILE 15 -4.395 1.384 0.020
111 HG12 ILE 15 2HG1 ILE 15 -2.509 1.639 2.380
112 HG13 ILE 15 1HG1 ILE 15 -2.034 1.156 0.756
113 HG21 ILE 15 1HG2 ILE 15 -5.117 3.068 1.653
114 HG22 ILE 15 2HG2 ILE 15 -4.962 1.880 2.945
115 HG23 ILE 15 3HG2 ILE 15 -6.176 1.653 1.688
116 HD11 ILE 15 3HD1 ILE 15 -1.493 3.486 1.186
117 HD12 ILE 15 1HD1 ILE 15 -3.185 3.823 1.551
118 HD13 ILE 15 2HD1 ILE 15 -2.713 3.355 -0.082
119 H CYS 16 H CYS 16 -6.127 -1.102 2.932
120 HA CYS 16 HA CYS 16 -7.855 -1.705 0.651
121 HB2 CYS 16 2HB CYS 16 -7.969 -2.909 3.402
122 HB3 CYS 16 1HB CYS 16 -8.968 -3.358 2.028
123 H THR 17 H THR 17 -9.559 -0.637 0.385
124 HA THR 17 HA THR 17 -10.753 0.828 2.608
125 HB THR 17 HB THR 17 -10.201 1.984 -0.143
126 HG1 THR 17 1HG THR 17 -8.946 2.599 2.358
127 HG21 THR 17 3HG2 THR 17 -10.957 4.094 0.848
128 HG22 THR 17 1HG2 THR 17 -11.268 3.275 2.381
129 HG23 THR 17 2HG2 THR 17 -12.216 2.865 0.953
130 H ARG 18 H ARG 18 -12.850 0.318 2.666
131 HA ARG 18 HA ARG 18 -14.986 -0.195 2.128
132 HB2 ARG 18 2HB ARG 18 -14.623 1.703 0.435
133 HB3 ARG 18 1HB ARG 18 -14.324 0.453 -0.754
134 HG2 ARG 18 2HG ARG 18 -16.646 -0.430 -0.178
135 HG3 ARG 18 1HG ARG 18 -16.889 1.101 0.666
136 HD2 ARG 18 2HD ARG 18 -17.749 1.310 -1.571
137 HD3 ARG 18 1HD ARG 18 -16.276 2.283 -1.437
138 HE ARG 18 HE ARG 18 -15.824 -0.388 -2.377
139 HH11 ARG 18 1HH1 ARG 18 -16.533 2.909 -3.425
140 HH12 ARG 18 2HH1 ARG 18 -16.027 2.632 -5.030
141 HH21 ARG 18 1HH2 ARG 18 -15.175 -0.768 -4.551
142 HH22 ARG 18 2HH2 ARG 18 -15.262 0.506 -5.694
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -12.605 -1.415 1.649
2 HA2 GLY 1 2HA GLY 1 -12.889 -3.708 1.822
3 HA3 GLY 1 1HA GLY 1 -14.301 -3.591 0.784
4 H PHE 2 H PHE 2 -12.130 -1.906 -0.865
5 HA PHE 2 HA PHE 2 -11.269 -4.226 -2.419
6 HB2 PHE 2 2HB PHE 2 -12.661 -2.654 -3.634
7 HB3 PHE 2 1HB PHE 2 -11.633 -1.310 -3.164
8 HD1 PHE 2 1HD PHE 2 -11.612 -4.508 -5.062
9 HD2 PHE 2 2HD PHE 2 -9.918 -0.636 -4.580
10 HE1 PHE 2 1HE PHE 2 -10.348 -4.807 -7.148
11 HE2 PHE 2 2HE PHE 2 -8.645 -0.929 -6.661
12 HZ PHE 2 HZ PHE 2 -8.864 -3.020 -7.949
13 H CYS 3 H CYS 3 -9.157 -4.683 -2.444
14 HA CYS 3 HA CYS 3 -7.476 -2.793 -1.051
15 HB2 CYS 3 2HB CYS 3 -6.880 -5.670 -1.712
16 HB3 CYS 3 1HB CYS 3 -5.926 -4.609 -0.677
17 H ARG 4 H ARG 4 -5.842 -1.766 -1.763
18 HA ARG 4 HA ARG 4 -5.084 -2.184 -4.547
19 HB2 ARG 4 2HB ARG 4 -4.707 0.260 -4.710
20 HB3 ARG 4 1HB ARG 4 -6.384 -0.114 -4.364
21 HG2 ARG 4 2HG ARG 4 -5.986 0.453 -1.989
22 HG3 ARG 4 1HG ARG 4 -4.324 0.879 -2.391
23 HD2 ARG 4 2HD ARG 4 -6.826 2.196 -3.454
24 HD3 ARG 4 1HD ARG 4 -5.705 2.878 -2.279
25 HE ARG 4 HE ARG 4 -4.380 2.168 -4.683
26 HH11 ARG 4 1HH1 ARG 4 -6.415 4.747 -3.306
27 HH12 ARG 4 2HH1 ARG 4 -5.880 5.917 -4.405
28 HH21 ARG 4 1HH2 ARG 4 -3.683 3.792 -6.190
29 HH22 ARG 4 2HH2 ARG 4 -4.311 5.370 -6.086
30 H CYS 5 H CYS 5 -2.906 -2.218 -4.929
31 HA CYS 5 HA CYS 5 -1.357 -2.258 -2.487
32 HB2 CYS 5 2HB CYS 5 -0.791 -3.681 -5.082
33 HB3 CYS 5 1HB CYS 5 0.247 -3.693 -3.657
34 H LEU 6 H LEU 6 0.351 -1.138 -2.142
35 HA LEU 6 HA LEU 6 1.250 0.717 -4.220
36 HB2 LEU 6 2HB LEU 6 0.015 1.839 -2.396
37 HB3 LEU 6 1HB LEU 6 1.082 1.106 -1.223
38 HG LEU 6 HG LEU 6 2.975 2.392 -2.179
39 HD11 LEU 6 1HD1 LEU 6 2.145 2.706 -4.434
40 HD12 LEU 6 2HD1 LEU 6 2.508 4.258 -3.682
41 HD13 LEU 6 3HD1 LEU 6 0.836 3.723 -3.825
42 HD21 LEU 6 3HD2 LEU 6 0.611 4.042 -1.277
43 HD22 LEU 6 1HD2 LEU 6 2.297 4.560 -1.256
44 HD23 LEU 6 2HD2 LEU 6 1.772 3.225 -0.230
45 H CYS 7 H CYS 7 3.184 -0.010 -4.851
46 HA CYS 7 HA CYS 7 4.815 -1.362 -2.883
47 HB2 CYS 7 2HB CYS 7 5.228 -1.217 -5.875
48 HB3 CYS 7 1HB CYS 7 6.122 -2.204 -4.720
49 H ARG 8 H ARG 8 6.709 -0.685 -2.239
50 HA ARG 8 HA ARG 8 7.774 1.795 -3.331
51 HB2 ARG 8 2HB ARG 8 6.413 2.220 -1.306
52 HB3 ARG 8 1HB ARG 8 7.433 1.115 -0.416
53 HG2 ARG 8 2HG ARG 8 9.367 2.511 -0.800
54 HG3 ARG 8 1HG ARG 8 8.393 3.661 -1.710
55 HD2 ARG 8 2HD ARG 8 8.695 4.492 0.527
56 HD3 ARG 8 1HD ARG 8 7.014 4.005 0.321
57 HE ARG 8 HE ARG 8 8.292 1.809 1.351
58 HH11 ARG 8 1HH1 ARG 8 7.739 5.119 2.445
59 HH12 ARG 8 2HH1 ARG 8 7.759 4.720 4.108
60 HH21 ARG 8 1HH2 ARG 8 8.335 1.273 3.572
61 HH22 ARG 8 2HH2 ARG 8 8.127 2.473 4.768
62 H ARG 9 H ARG 9 9.694 1.243 -4.048
63 HA ARG 9 HA ARG 9 11.808 0.475 -4.229
64 HB2 ARG 9 2HB ARG 9 11.878 1.671 -1.974
65 HB3 ARG 9 1HB ARG 9 11.737 0.084 -1.240
66 HG2 ARG 9 2HG ARG 9 13.835 -0.578 -2.375
67 HG3 ARG 9 1HG ARG 9 13.985 1.070 -2.983
68 HD2 ARG 9 2HD ARG 9 13.962 0.215 -0.089
69 HD3 ARG 9 1HD ARG 9 15.353 0.772 -1.014
70 HE ARG 9 HE ARG 9 13.197 2.652 -0.915
71 HH11 ARG 9 1HH1 ARG 9 16.165 1.589 0.695
72 HH12 ARG 9 2HH1 ARG 9 16.318 2.989 1.648
73 HH21 ARG 9 1HH2 ARG 9 13.417 4.578 0.362
74 HH22 ARG 9 2HH2 ARG 9 14.694 4.738 1.463
75 H GLY 10 H GLY 10 9.666 -1.387 -4.482
76 HA2 GLY 10 2HA GLY 10 9.814 -3.595 -5.214
77 HA3 GLY 10 1HA GLY 10 11.247 -3.788 -4.208
78 H VAL 11 H VAL 11 9.413 -2.432 -2.042
79 HA VAL 11 HA VAL 11 8.366 -4.984 -1.088
80 HB VAL 11 HB VAL 11 8.568 -2.322 0.372
81 HG11 VAL 11 1HG1 VAL 11 6.873 -3.778 1.326
82 HG12 VAL 11 2HG1 VAL 11 8.255 -3.654 2.415
83 HG13 VAL 11 3HG1 VAL 11 8.037 -5.097 1.432
84 HG21 VAL 11 3HG2 VAL 11 10.792 -3.143 -0.211
85 HG22 VAL 11 1HG2 VAL 11 10.421 -4.703 0.524
86 HG23 VAL 11 2HG2 VAL 11 10.517 -3.255 1.528
87 H CYS 12 H CYS 12 6.201 -5.366 -1.173
88 HA CYS 12 HA CYS 12 4.625 -3.072 -1.982
89 HB2 CYS 12 2HB CYS 12 4.002 -5.974 -2.437
90 HB3 CYS 12 1HB CYS 12 3.000 -4.563 -2.832
91 H ARG 13 H ARG 13 3.178 -2.286 -0.888
92 HA ARG 13 HA ARG 13 2.224 -3.740 1.476
93 HB2 ARG 13 2HB ARG 13 3.593 -1.780 2.100
94 HB3 ARG 13 1HB ARG 13 2.571 -0.744 1.113
95 HG2 ARG 13 2HG ARG 13 1.953 -0.494 3.423
96 HG3 ARG 13 1HG ARG 13 0.649 -1.324 2.563
97 HD2 ARG 13 2HD ARG 13 1.678 -3.485 3.357
98 HD3 ARG 13 1HD ARG 13 2.710 -2.520 4.403
99 HE ARG 13 HE ARG 13 -0.221 -2.504 4.530
100 HH11 ARG 13 1HH1 ARG 13 2.913 -2.314 6.160
101 HH12 ARG 13 2HH1 ARG 13 2.293 -2.603 7.712
102 HH21 ARG 13 1HH2 ARG 13 -1.094 -2.851 6.649
103 HH22 ARG 13 2HH2 ARG 13 -0.075 -2.874 8.013
104 H CYS 14 H CYS 14 0.058 -4.099 1.441
105 HA CYS 14 HA CYS 14 -1.366 -2.597 -0.584
106 HB2 CYS 14 2HB CYS 14 -2.066 -5.300 0.557
107 HB3 CYS 14 1HB CYS 14 -2.932 -4.479 -0.744
108 H ILE 15 H ILE 15 -3.165 -1.525 -0.159
109 HA ILE 15 HA ILE 15 -3.925 -1.298 2.669
110 HB ILE 15 HB ILE 15 -3.840 0.895 0.554
111 HG12 ILE 15 2HG1 ILE 15 -2.058 0.519 2.980
112 HG13 ILE 15 1HG1 ILE 15 -1.584 0.182 1.323
113 HG21 ILE 15 1HG2 ILE 15 -4.488 1.042 3.502
114 HG22 ILE 15 2HG2 ILE 15 -5.629 1.227 2.175
115 HG23 ILE 15 3HG2 ILE 15 -4.348 2.420 2.410
116 HD11 ILE 15 3HD1 ILE 15 -0.707 2.316 2.082
117 HD12 ILE 15 1HD1 ILE 15 -2.341 2.879 2.430
118 HD13 ILE 15 2HD1 ILE 15 -1.858 2.549 0.767
119 H CYS 16 H CYS 16 -6.138 -1.345 2.990
120 HA CYS 16 HA CYS 16 -7.658 -1.810 0.564
121 HB2 CYS 16 2HB CYS 16 -8.343 -2.724 3.347
122 HB3 CYS 16 1HB CYS 16 -9.202 -3.142 1.865
123 H THR 17 H THR 17 -9.265 -0.687 -0.040
124 HA THR 17 HA THR 17 -10.270 1.402 1.721
125 HB THR 17 HB THR 17 -9.393 1.665 -1.162
126 HG1 THR 17 1HG THR 17 -8.180 2.007 1.223
127 HG21 THR 17 3HG2 THR 17 -9.938 4.056 -0.896
128 HG22 THR 17 1HG2 THR 17 -10.525 3.727 0.735
129 HG23 THR 17 2HG2 THR 17 -11.371 3.056 -0.660
130 H ARG 18 H ARG 18 -12.387 1.106 1.892
131 HA ARG 18 HA ARG 18 -14.574 0.722 1.462
132 HB2 ARG 18 2HB ARG 18 -14.085 2.300 -0.472
133 HB3 ARG 18 1HB ARG 18 -13.838 0.895 -1.480
134 HG2 ARG 18 2HG ARG 18 -16.200 0.232 -1.024
135 HG3 ARG 18 1HG ARG 18 -16.409 1.769 -0.177
136 HD2 ARG 18 2HD ARG 18 -17.196 1.991 -2.452
137 HD3 ARG 18 1HD ARG 18 -15.735 2.953 -2.236
138 HE ARG 18 HE ARG 18 -15.284 0.289 -3.221
139 HH11 ARG 18 1HH1 ARG 18 -15.848 3.660 -4.181
140 HH12 ARG 18 2HH1 ARG 18 -15.242 3.447 -5.753
141 HH21 ARG 18 1HH2 ARG 18 -14.472 0.026 -5.383
142 HH22 ARG 18 2HH2 ARG 18 -14.429 1.357 -6.446
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -12.049 -1.584 1.824
2 HA2 GLY 1 2HA GLY 1 -12.726 -3.886 1.511
3 HA3 GLY 1 1HA GLY 1 -14.152 -3.281 0.684
4 H PHE 2 H PHE 2 -12.338 -1.267 -0.707
5 HA PHE 2 HA PHE 2 -11.639 -2.992 -2.927
6 HB2 PHE 2 2HB PHE 2 -12.760 -0.943 -3.534
7 HB3 PHE 2 1HB PHE 2 -11.650 0.025 -2.577
8 HD1 PHE 2 2HD PHE 2 -11.749 -2.238 -5.540
9 HD2 PHE 2 1HD PHE 2 -9.807 1.016 -3.596
10 HE1 PHE 2 2HE PHE 2 -10.328 -1.899 -7.517
11 HE2 PHE 2 1HE PHE 2 -8.385 1.355 -5.573
12 HZ PHE 2 HZ PHE 2 -8.648 -0.108 -7.537
13 H CYS 3 H CYS 3 -9.746 -3.915 -2.943
14 HA CYS 3 HA CYS 3 -7.654 -2.753 -1.309
15 HB2 CYS 3 2HB CYS 3 -7.821 -5.471 -2.579
16 HB3 CYS 3 1HB CYS 3 -6.608 -4.931 -1.420
17 H ARG 4 H ARG 4 -5.795 -2.026 -1.958
18 HA ARG 4 HA ARG 4 -5.277 -2.089 -4.837
19 HB2 ARG 4 2HB ARG 4 -4.610 0.216 -4.808
20 HB3 ARG 4 1HB ARG 4 -6.171 0.147 -4.012
21 HG2 ARG 4 2HG ARG 4 -5.003 0.205 -1.813
22 HG3 ARG 4 1HG ARG 4 -3.480 0.394 -2.673
23 HD2 ARG 4 2HD ARG 4 -4.130 2.562 -2.025
24 HD3 ARG 4 1HD ARG 4 -4.509 2.451 -3.742
25 HE ARG 4 HE ARG 4 -6.545 2.031 -1.661
26 HH11 ARG 4 1HH1 ARG 4 -5.556 3.656 -4.663
27 HH12 ARG 4 2HH1 ARG 4 -7.011 4.520 -4.804
28 HH21 ARG 4 1HH2 ARG 4 -8.419 3.201 -1.848
29 HH22 ARG 4 2HH2 ARG 4 -8.736 4.237 -3.184
30 H CYS 5 H CYS 5 -3.087 -2.397 -5.351
31 HA CYS 5 HA CYS 5 -1.388 -2.752 -3.026
32 HB2 CYS 5 2HB CYS 5 -1.204 -4.203 -5.666
33 HB3 CYS 5 1HB CYS 5 -0.007 -4.219 -4.358
34 H LEU 6 H LEU 6 0.269 -1.651 -2.794
35 HA LEU 6 HA LEU 6 1.260 -0.059 -5.074
36 HB2 LEU 6 2HB LEU 6 0.982 0.850 -2.200
37 HB3 LEU 6 1HB LEU 6 1.731 1.773 -3.481
38 HG LEU 6 HG LEU 6 -1.197 1.024 -3.360
39 HD11 LEU 6 1HD1 LEU 6 0.188 3.658 -2.859
40 HD12 LEU 6 2HD1 LEU 6 -0.600 2.644 -1.644
41 HD13 LEU 6 3HD1 LEU 6 -1.556 3.401 -2.918
42 HD21 LEU 6 3HD2 LEU 6 -1.432 2.610 -5.227
43 HD22 LEU 6 1HD2 LEU 6 -0.402 1.245 -5.659
44 HD23 LEU 6 2HD2 LEU 6 0.318 2.807 -5.274
45 H CYS 7 H CYS 7 3.339 -0.523 -5.447
46 HA CYS 7 HA CYS 7 4.837 -1.598 -3.212
47 HB2 CYS 7 2HB CYS 7 5.417 -1.786 -6.173
48 HB3 CYS 7 1HB CYS 7 6.467 -2.410 -4.903
49 H ARG 8 H ARG 8 6.654 -0.702 -2.508
50 HA ARG 8 HA ARG 8 7.481 1.796 -3.743
51 HB2 ARG 8 2HB ARG 8 5.799 2.165 -1.954
52 HB3 ARG 8 1HB ARG 8 6.878 1.378 -0.829
53 HG2 ARG 8 2HG ARG 8 8.449 3.129 -0.925
54 HG3 ARG 8 1HG ARG 8 7.688 3.818 -2.363
55 HD2 ARG 8 2HD ARG 8 6.435 3.651 0.378
56 HD3 ARG 8 1HD ARG 8 7.098 5.110 -0.376
57 HE ARG 8 HE ARG 8 5.232 3.948 -2.098
58 HH11 ARG 8 1HH1 ARG 8 5.231 5.733 0.954
59 HH12 ARG 8 2HH1 ARG 8 3.651 6.347 0.719
60 HH21 ARG 8 1HH2 ARG 8 3.121 4.805 -2.403
61 HH22 ARG 8 2HH2 ARG 8 2.428 5.828 -1.229
62 H ARG 9 H ARG 9 9.373 1.022 -4.396
63 HA ARG 9 HA ARG 9 11.523 0.365 -4.396
64 HB2 ARG 9 2HB ARG 9 11.387 1.535 -1.641
65 HB3 ARG 9 1HB ARG 9 12.886 1.094 -2.456
66 HG2 ARG 9 2HG ARG 9 12.413 2.684 -4.224
67 HG3 ARG 9 1HG ARG 9 10.885 3.106 -3.452
68 HD2 ARG 9 2HD ARG 9 12.048 3.967 -1.532
69 HD3 ARG 9 1HD ARG 9 13.603 3.454 -2.201
70 HE ARG 9 HE ARG 9 12.661 4.999 -4.128
71 HH11 ARG 9 1HH1 ARG 9 12.907 5.596 -0.650
72 HH12 ARG 9 2HH1 ARG 9 13.046 7.278 -0.792
73 HH21 ARG 9 1HH2 ARG 9 12.895 7.295 -4.339
74 HH22 ARG 9 2HH2 ARG 9 13.071 8.269 -2.951
75 H GLY 10 H GLY 10 9.998 -1.722 -4.055
76 HA2 GLY 10 2HA GLY 10 10.648 -3.954 -3.773
77 HA3 GLY 10 1HA GLY 10 11.769 -3.419 -2.529
78 H VAL 11 H VAL 11 9.426 -1.788 -1.350
79 HA VAL 11 HA VAL 11 8.427 -4.026 0.198
80 HB VAL 11 HB VAL 11 7.999 -1.048 0.629
81 HG11 VAL 11 1HG1 VAL 11 7.324 -1.677 2.902
82 HG12 VAL 11 2HG1 VAL 11 7.501 -3.379 2.480
83 HG13 VAL 11 3HG1 VAL 11 6.274 -2.399 1.681
84 HG21 VAL 11 3HG2 VAL 11 9.677 -1.244 2.432
85 HG22 VAL 11 1HG2 VAL 11 10.356 -1.572 0.839
86 HG23 VAL 11 2HG2 VAL 11 9.989 -2.906 1.937
87 H CYS 12 H CYS 12 6.571 -4.908 -0.562
88 HA CYS 12 HA CYS 12 4.813 -3.105 -1.969
89 HB2 CYS 12 2HB CYS 12 4.792 -6.123 -1.995
90 HB3 CYS 12 1HB CYS 12 3.571 -5.066 -2.721
91 H ARG 13 H ARG 13 3.056 -2.483 -1.334
92 HA ARG 13 HA ARG 13 2.107 -3.403 1.290
93 HB2 ARG 13 2HB ARG 13 3.348 -1.329 1.476
94 HB3 ARG 13 1HB ARG 13 2.397 -0.612 0.193
95 HG2 ARG 13 2HG ARG 13 0.410 -0.702 1.625
96 HG3 ARG 13 1HG ARG 13 1.386 -1.410 2.918
97 HD2 ARG 13 2HD ARG 13 2.845 0.548 2.892
98 HD3 ARG 13 1HD ARG 13 1.867 1.264 1.617
99 HE ARG 13 HE ARG 13 0.007 1.142 3.339
100 HH11 ARG 13 1HH1 ARG 13 3.413 1.747 4.126
101 HH12 ARG 13 2HH1 ARG 13 3.047 2.528 5.604
102 HH21 ARG 13 1HH2 ARG 13 -0.445 2.338 5.301
103 HH22 ARG 13 2HH2 ARG 13 0.850 2.888 6.264
104 H CYS 14 H CYS 14 0.285 -4.462 0.686
105 HA CYS 14 HA CYS 14 -1.485 -3.035 -1.099
106 HB2 CYS 14 2HB CYS 14 -1.792 -5.817 0.098
107 HB3 CYS 14 1HB CYS 14 -2.872 -5.091 -1.088
108 H ILE 15 H ILE 15 -3.354 -2.115 -0.365
109 HA ILE 15 HA ILE 15 -4.055 -2.440 2.435
110 HB ILE 15 HB ILE 15 -2.542 -0.506 2.357
111 HG12 ILE 15 2HG1 ILE 15 -4.061 1.265 3.307
112 HG13 ILE 15 1HG1 ILE 15 -5.425 0.284 2.790
113 HG21 ILE 15 1HG2 ILE 15 -2.777 0.180 0.067
114 HG22 ILE 15 2HG2 ILE 15 -3.098 1.548 1.133
115 HG23 ILE 15 3HG2 ILE 15 -4.437 0.697 0.362
116 HD11 ILE 15 3HD1 ILE 15 -4.945 0.021 5.162
117 HD12 ILE 15 1HD1 ILE 15 -3.328 -0.563 4.773
118 HD13 ILE 15 2HD1 ILE 15 -4.753 -1.490 4.285
119 H CYS 16 H CYS 16 -6.263 -2.092 2.812
120 HA CYS 16 HA CYS 16 -7.789 -1.828 0.350
121 HB2 CYS 16 2HB CYS 16 -8.695 -3.142 2.912
122 HB3 CYS 16 1HB CYS 16 -9.562 -3.120 1.385
123 H THR 17 H THR 17 -9.152 -0.386 -0.017
124 HA THR 17 HA THR 17 -9.729 1.664 1.986
125 HB THR 17 HB THR 17 -10.071 1.757 -1.018
126 HG1 THR 17 1HG THR 17 -7.783 2.160 0.579
127 HG21 THR 17 3HG2 THR 17 -9.910 4.185 -0.665
128 HG22 THR 17 1HG2 THR 17 -9.697 3.913 1.063
129 HG23 THR 17 2HG2 THR 17 -11.224 3.492 0.288
130 H ARG 18 H ARG 18 -11.666 0.941 2.878
131 HA ARG 18 HA ARG 18 -13.795 0.305 3.185
132 HB2 ARG 18 2HB ARG 18 -15.541 1.315 1.891
133 HB3 ARG 18 1HB ARG 18 -14.213 2.455 1.869
134 HG2 ARG 18 2HG ARG 18 -13.633 1.758 -0.397
135 HG3 ARG 18 1HG ARG 18 -14.915 0.549 -0.355
136 HD2 ARG 18 2HD ARG 18 -16.556 2.375 -0.059
137 HD3 ARG 18 1HD ARG 18 -15.241 3.540 -0.251
138 HE ARG 18 HE ARG 18 -15.235 1.747 -2.390
139 HH11 ARG 18 1HH1 ARG 18 -17.100 4.493 -1.164
140 HH12 ARG 18 2HH1 ARG 18 -17.748 4.886 -2.691
141 HH21 ARG 18 1HH2 ARG 18 -16.164 2.283 -4.463
142 HH22 ARG 18 2HH2 ARG 18 -17.244 3.615 -4.572
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -13.024 -1.569 1.257
2 HA2 GLY 1 2HA GLY 1 -13.437 -3.849 0.885
3 HA3 GLY 1 1HA GLY 1 -14.641 -3.407 -0.325
4 H PHE 2 H PHE 2 -12.197 -1.489 -1.103
5 HA PHE 2 HA PHE 2 -11.219 -3.326 -3.135
6 HB2 PHE 2 2HB PHE 2 -12.227 -1.262 -3.955
7 HB3 PHE 2 1HB PHE 2 -11.175 -0.309 -2.928
8 HD1 PHE 2 2HD PHE 2 -11.120 -2.691 -5.783
9 HD2 PHE 2 1HD PHE 2 -9.146 0.473 -3.748
10 HE1 PHE 2 2HE PHE 2 -9.481 -2.537 -7.609
11 HE2 PHE 2 1HE PHE 2 -7.506 0.626 -5.579
12 HZ PHE 2 HZ PHE 2 -7.675 -0.876 -7.506
13 H CYS 3 H CYS 3 -9.256 -4.117 -2.938
14 HA CYS 3 HA CYS 3 -7.421 -2.842 -1.061
15 HB2 CYS 3 2HB CYS 3 -7.410 -5.653 -2.168
16 HB3 CYS 3 1HB CYS 3 -6.252 -4.994 -1.013
17 H ARG 4 H ARG 4 -5.596 -2.011 -1.694
18 HA ARG 4 HA ARG 4 -4.760 -2.398 -4.474
19 HB2 ARG 4 2HB ARG 4 -5.912 -0.254 -4.339
20 HB3 ARG 4 1HB ARG 4 -4.970 0.198 -2.933
21 HG2 ARG 4 2HG ARG 4 -4.224 1.367 -4.940
22 HG3 ARG 4 1HG ARG 4 -2.954 0.329 -4.293
23 HD2 ARG 4 2HD ARG 4 -3.517 -1.372 -5.963
24 HD3 ARG 4 1HD ARG 4 -4.759 -0.312 -6.629
25 HE ARG 4 HE ARG 4 -2.676 1.248 -6.827
26 HH11 ARG 4 1HH1 ARG 4 -2.856 -2.221 -7.560
27 HH12 ARG 4 2HH1 ARG 4 -1.737 -2.179 -8.826
28 HH21 ARG 4 1HH2 ARG 4 -1.065 1.312 -8.610
29 HH22 ARG 4 2HH2 ARG 4 -0.677 -0.124 -9.416
30 H CYS 5 H CYS 5 -2.579 -2.697 -4.680
31 HA CYS 5 HA CYS 5 -1.102 -2.471 -2.210
32 HB2 CYS 5 2HB CYS 5 -0.347 -4.045 -4.663
33 HB3 CYS 5 1HB CYS 5 0.558 -3.883 -3.145
34 H LEU 6 H LEU 6 0.295 -1.153 -1.873
35 HA LEU 6 HA LEU 6 1.184 0.633 -4.042
36 HB2 LEU 6 2HB LEU 6 1.113 1.125 -1.058
37 HB3 LEU 6 1HB LEU 6 1.593 2.279 -2.285
38 HG LEU 6 HG LEU 6 -1.189 1.175 -1.887
39 HD11 LEU 6 1HD1 LEU 6 -1.748 3.447 -1.196
40 HD12 LEU 6 2HD1 LEU 6 -0.048 3.906 -1.335
41 HD13 LEU 6 3HD1 LEU 6 -0.548 2.716 -0.132
42 HD21 LEU 6 3HD2 LEU 6 -0.161 3.241 -3.842
43 HD22 LEU 6 1HD2 LEU 6 -1.862 2.857 -3.563
44 HD23 LEU 6 2HD2 LEU 6 -0.787 1.641 -4.237
45 H CYS 7 H CYS 7 3.156 0.101 -4.660
46 HA CYS 7 HA CYS 7 4.872 -1.187 -2.693
47 HB2 CYS 7 2HB CYS 7 5.096 -1.288 -5.703
48 HB3 CYS 7 1HB CYS 7 6.039 -2.226 -4.551
49 H ARG 8 H ARG 8 6.916 -0.524 -2.348
50 HA ARG 8 HA ARG 8 7.898 1.811 -3.793
51 HB2 ARG 8 2HB ARG 8 6.819 2.466 -1.665
52 HB3 ARG 8 1HB ARG 8 7.922 1.404 -0.813
53 HG2 ARG 8 2HG ARG 8 9.829 2.726 -1.583
54 HG3 ARG 8 1HG ARG 8 8.725 3.829 -2.412
55 HD2 ARG 8 2HD ARG 8 8.771 3.275 0.550
56 HD3 ARG 8 1HD ARG 8 9.424 4.708 -0.245
57 HE ARG 8 HE ARG 8 6.939 4.856 -1.073
58 HH11 ARG 8 1HH1 ARG 8 8.114 4.147 2.184
59 HH12 ARG 8 2HH1 ARG 8 6.703 4.678 2.959
60 HH21 ARG 8 1HH2 ARG 8 5.008 5.622 -0.014
61 HH22 ARG 8 2HH2 ARG 8 4.891 5.558 1.674
62 H ARG 9 H ARG 9 9.728 1.116 -4.677
63 HA ARG 9 HA ARG 9 11.693 0.102 -5.072
64 HB2 ARG 9 2HB ARG 9 11.968 0.437 -2.107
65 HB3 ARG 9 1HB ARG 9 13.273 -0.131 -3.139
66 HG2 ARG 9 2HG ARG 9 13.124 1.985 -4.411
67 HG3 ARG 9 1HG ARG 9 11.894 2.542 -3.271
68 HD2 ARG 9 2HD ARG 9 14.103 3.415 -2.681
69 HD3 ARG 9 1HD ARG 9 13.489 2.322 -1.441
70 HE ARG 9 HE ARG 9 15.085 0.943 -3.334
71 HH11 ARG 9 1HH1 ARG 9 15.386 3.159 -0.602
72 HH12 ARG 9 2HH1 ARG 9 16.879 2.537 -0.086
73 HH21 ARG 9 1HH2 ARG 9 17.137 0.080 -2.615
74 HH22 ARG 9 2HH2 ARG 9 17.895 0.735 -1.239
75 H GLY 10 H GLY 10 9.550 -1.605 -4.893
76 HA2 GLY 10 2HA GLY 10 9.573 -3.886 -5.368
77 HA3 GLY 10 1HA GLY 10 11.042 -4.027 -4.413
78 H VAL 11 H VAL 11 9.557 -2.383 -2.276
79 HA VAL 11 HA VAL 11 8.467 -4.738 -0.980
80 HB VAL 11 HB VAL 11 8.944 -1.957 0.114
81 HG11 VAL 11 1HG1 VAL 11 7.235 -3.184 1.372
82 HG12 VAL 11 2HG1 VAL 11 8.700 -2.988 2.327
83 HG13 VAL 11 3HG1 VAL 11 8.347 -4.539 1.566
84 HG21 VAL 11 3HG2 VAL 11 10.910 -2.934 1.228
85 HG22 VAL 11 1HG2 VAL 11 11.041 -2.993 -0.530
86 HG23 VAL 11 2HG2 VAL 11 10.619 -4.448 0.377
87 H CYS 12 H CYS 12 6.367 -5.083 -0.958
88 HA CYS 12 HA CYS 12 4.687 -2.875 -1.774
89 HB2 CYS 12 2HB CYS 12 4.140 -5.814 -1.918
90 HB3 CYS 12 1HB CYS 12 3.013 -4.515 -2.341
91 H ARG 13 H ARG 13 3.187 -2.062 -0.689
92 HA ARG 13 HA ARG 13 2.409 -3.297 1.860
93 HB2 ARG 13 2HB ARG 13 3.629 -1.223 2.274
94 HB3 ARG 13 1HB ARG 13 2.622 -0.374 1.107
95 HG2 ARG 13 2HG ARG 13 0.684 -0.656 2.538
96 HG3 ARG 13 1HG ARG 13 1.649 -1.570 3.690
97 HD2 ARG 13 2HD ARG 13 2.205 1.282 2.893
98 HD3 ARG 13 1HD ARG 13 1.276 0.816 4.310
99 HE ARG 13 HE ARG 13 4.045 -0.096 3.964
100 HH11 ARG 13 1HH1 ARG 13 1.599 1.623 5.873
101 HH12 ARG 13 2HH1 ARG 13 2.638 1.831 7.218
102 HH21 ARG 13 1HH2 ARG 13 5.438 0.234 5.817
103 HH22 ARG 13 2HH2 ARG 13 4.822 1.047 7.181
104 H CYS 14 H CYS 14 0.411 -4.070 1.659
105 HA CYS 14 HA CYS 14 -1.290 -2.834 -0.339
106 HB2 CYS 14 2HB CYS 14 -1.634 -5.504 1.037
107 HB3 CYS 14 1HB CYS 14 -2.626 -4.893 -0.286
108 H ILE 15 H ILE 15 -3.212 -1.934 0.059
109 HA ILE 15 HA ILE 15 -4.065 -1.778 2.839
110 HB ILE 15 HB ILE 15 -2.814 0.263 2.336
111 HG12 ILE 15 2HG1 ILE 15 -5.791 0.846 2.367
112 HG13 ILE 15 1HG1 ILE 15 -4.802 0.497 3.778
113 HG21 ILE 15 1HG2 ILE 15 -3.491 1.838 0.580
114 HG22 ILE 15 2HG2 ILE 15 -4.674 0.663 0.003
115 HG23 ILE 15 3HG2 ILE 15 -2.954 0.287 -0.069
116 HD11 ILE 15 3HD1 ILE 15 -3.525 2.546 3.381
117 HD12 ILE 15 1HD1 ILE 15 -5.246 2.870 3.587
118 HD13 ILE 15 2HD1 ILE 15 -4.531 2.891 1.975
119 H CYS 16 H CYS 16 -6.338 -1.651 3.105
120 HA CYS 16 HA CYS 16 -7.896 -1.932 0.628
121 HB2 CYS 16 2HB CYS 16 -8.484 -3.268 3.264
122 HB3 CYS 16 1HB CYS 16 -9.430 -3.425 1.797
123 H THR 17 H THR 17 -9.443 -0.598 0.327
124 HA THR 17 HA THR 17 -10.717 0.785 2.551
125 HB THR 17 HB THR 17 -9.656 2.183 0.071
126 HG1 THR 17 1HG THR 17 -8.557 1.531 2.467
127 HG21 THR 17 3HG2 THR 17 -11.668 3.230 1.071
128 HG22 THR 17 1HG2 THR 17 -10.242 4.247 1.288
129 HG23 THR 17 2HG2 THR 17 -10.850 3.288 2.632
130 H ARG 18 H ARG 18 -12.906 0.940 2.185
131 HA ARG 18 HA ARG 18 -14.968 0.617 1.366
132 HB2 ARG 18 2HB ARG 18 -15.604 1.610 -0.727
133 HB3 ARG 18 1HB ARG 18 -14.257 2.570 -0.143
134 HG2 ARG 18 2HG ARG 18 -12.765 1.383 -1.678
135 HG3 ARG 18 1HG ARG 18 -14.118 0.424 -2.252
136 HD2 ARG 18 2HD ARG 18 -15.200 2.549 -2.984
137 HD3 ARG 18 1HD ARG 18 -13.701 3.386 -2.564
138 HE ARG 18 HE ARG 18 -13.967 1.281 -4.594
139 HH11 ARG 18 1HH1 ARG 18 -12.420 4.277 -3.491
140 HH12 ARG 18 2HH1 ARG 18 -11.285 4.302 -4.748
141 HH21 ARG 18 1HH2 ARG 18 -12.411 1.353 -6.328
142 HH22 ARG 18 2HH2 ARG 18 -11.307 2.638 -6.430
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -12.303 -0.712 1.946
2 HA2 GLY 1 2HA GLY 1 -12.530 -3.020 2.182
3 HA3 GLY 1 1HA GLY 1 -14.030 -2.946 1.277
4 H PHE 2 H PHE 2 -11.985 -1.251 -0.569
5 HA PHE 2 HA PHE 2 -11.415 -3.564 -2.227
6 HB2 PHE 2 2HB PHE 2 -12.525 -1.634 -3.314
7 HB3 PHE 2 1HB PHE 2 -11.185 -0.600 -2.833
8 HD1 PHE 2 2HD PHE 2 -12.071 -3.524 -4.912
9 HD2 PHE 2 1HD PHE 2 -9.221 -0.460 -4.129
10 HE1 PHE 2 2HE PHE 2 -10.843 -4.135 -6.957
11 HE2 PHE 2 1HE PHE 2 -7.996 -1.072 -6.165
12 HZ PHE 2 HZ PHE 2 -8.804 -2.911 -7.577
13 H CYS 3 H CYS 3 -9.435 -4.333 -2.442
14 HA CYS 3 HA CYS 3 -7.335 -2.858 -1.079
15 HB2 CYS 3 2HB CYS 3 -7.428 -5.807 -1.713
16 HB3 CYS 3 1HB CYS 3 -6.192 -4.923 -0.801
17 H ARG 4 H ARG 4 -5.833 -2.043 -2.096
18 HA ARG 4 HA ARG 4 -5.317 -2.764 -4.896
19 HB2 ARG 4 2HB ARG 4 -6.293 -0.529 -4.735
20 HB3 ARG 4 1HB ARG 4 -5.129 -0.075 -3.507
21 HG2 ARG 4 2HG ARG 4 -4.564 0.944 -5.638
22 HG3 ARG 4 1HG ARG 4 -3.328 -0.216 -5.167
23 HD2 ARG 4 2HD ARG 4 -4.275 -1.864 -6.703
24 HD3 ARG 4 1HD ARG 4 -5.545 -0.723 -7.158
25 HE ARG 4 HE ARG 4 -3.133 0.556 -7.591
26 HH11 ARG 4 1HH1 ARG 4 -4.841 -2.238 -8.966
27 HH12 ARG 4 2HH1 ARG 4 -4.023 -2.158 -10.450
28 HH21 ARG 4 1HH2 ARG 4 -2.073 0.675 -9.617
29 HH22 ARG 4 2HH2 ARG 4 -2.394 -0.455 -10.843
30 H CYS 5 H CYS 5 -3.154 -3.240 -5.337
31 HA CYS 5 HA CYS 5 -1.480 -3.088 -2.997
32 HB2 CYS 5 2HB CYS 5 -1.032 -4.802 -5.437
33 HB3 CYS 5 1HB CYS 5 -0.077 -4.756 -3.943
34 H LEU 6 H LEU 6 0.204 -2.000 -2.777
35 HA LEU 6 HA LEU 6 1.108 -0.330 -5.037
36 HB2 LEU 6 2HB LEU 6 0.899 0.442 -2.109
37 HB3 LEU 6 1HB LEU 6 1.624 1.425 -3.347
38 HG LEU 6 HG LEU 6 -0.422 2.411 -2.886
39 HD11 LEU 6 1HD1 LEU 6 -1.750 2.243 -4.894
40 HD12 LEU 6 2HD1 LEU 6 -0.858 0.796 -5.350
41 HD13 LEU 6 3HD1 LEU 6 -0.018 2.345 -5.214
42 HD21 LEU 6 3HD2 LEU 6 -2.593 1.252 -2.852
43 HD22 LEU 6 1HD2 LEU 6 -1.488 0.654 -1.614
44 HD23 LEU 6 2HD2 LEU 6 -1.757 -0.281 -3.088
45 H CYS 7 H CYS 7 3.385 -0.034 -5.101
46 HA CYS 7 HA CYS 7 4.689 -1.615 -3.078
47 HB2 CYS 7 2HB CYS 7 5.719 -1.195 -5.883
48 HB3 CYS 7 1HB CYS 7 6.509 -2.077 -4.562
49 H ARG 8 H ARG 8 6.093 -0.804 -1.866
50 HA ARG 8 HA ARG 8 6.706 2.043 -2.180
51 HB2 ARG 8 2HB ARG 8 5.245 1.258 -0.240
52 HB3 ARG 8 1HB ARG 8 6.666 0.433 0.376
53 HG2 ARG 8 2HG ARG 8 7.840 2.644 0.391
54 HG3 ARG 8 1HG ARG 8 6.303 3.389 -0.025
55 HD2 ARG 8 2HD ARG 8 7.010 1.876 2.477
56 HD3 ARG 8 1HD ARG 8 6.546 3.570 2.331
57 HE ARG 8 HE ARG 8 4.840 1.239 2.338
58 HH11 ARG 8 1HH1 ARG 8 4.949 4.760 1.751
59 HH12 ARG 8 2HH1 ARG 8 3.291 4.975 2.052
60 HH21 ARG 8 1HH2 ARG 8 2.619 1.583 2.789
61 HH22 ARG 8 2HH2 ARG 8 1.892 3.118 2.647
62 H ARG 9 H ARG 9 8.632 1.903 -3.182
63 HA ARG 9 HA ARG 9 10.868 1.698 -3.466
64 HB2 ARG 9 2HB ARG 9 10.881 1.302 -0.478
65 HB3 ARG 9 1HB ARG 9 12.265 1.768 -1.464
66 HG2 ARG 9 2HG ARG 9 9.762 3.406 -1.017
67 HG3 ARG 9 1HG ARG 9 11.348 3.715 -0.317
68 HD2 ARG 9 2HD ARG 9 12.274 4.093 -2.528
69 HD3 ARG 9 1HD ARG 9 10.733 3.679 -3.264
70 HE ARG 9 HE ARG 9 9.887 5.668 -1.943
71 HH11 ARG 9 1HH1 ARG 9 13.194 5.453 -3.184
72 HH12 ARG 9 2HH1 ARG 9 13.323 7.107 -3.569
73 HH21 ARG 9 1HH2 ARG 9 10.065 7.970 -2.441
74 HH22 ARG 9 2HH2 ARG 9 11.496 8.580 -3.114
75 H GLY 10 H GLY 10 9.462 -0.553 -3.980
76 HA2 GLY 10 2HA GLY 10 10.270 -2.582 -4.813
77 HA3 GLY 10 1HA GLY 10 11.550 -2.519 -3.601
78 H VAL 11 H VAL 11 9.431 -1.878 -1.517
79 HA VAL 11 HA VAL 11 8.771 -4.655 -0.977
80 HB VAL 11 HB VAL 11 8.374 -2.191 0.751
81 HG11 VAL 11 1HG1 VAL 11 8.136 -3.773 2.606
82 HG12 VAL 11 2HG1 VAL 11 8.282 -5.119 1.477
83 HG13 VAL 11 3HG1 VAL 11 6.901 -4.027 1.374
84 HG21 VAL 11 3HG2 VAL 11 10.589 -4.233 0.815
85 HG22 VAL 11 1HG2 VAL 11 10.371 -2.925 1.976
86 HG23 VAL 11 2HG2 VAL 11 10.739 -2.558 0.287
87 H CYS 12 H CYS 12 6.765 -5.388 -1.438
88 HA CYS 12 HA CYS 12 4.885 -3.335 -2.193
89 HB2 CYS 12 2HB CYS 12 4.827 -6.280 -2.823
90 HB3 CYS 12 1HB CYS 12 3.631 -5.086 -3.339
91 H ARG 13 H ARG 13 3.022 -2.994 -1.366
92 HA ARG 13 HA ARG 13 2.127 -4.643 0.868
93 HB2 ARG 13 2HB ARG 13 3.347 -2.857 1.931
94 HB3 ARG 13 1HB ARG 13 2.573 -1.648 0.915
95 HG2 ARG 13 2HG ARG 13 1.609 -1.564 3.117
96 HG3 ARG 13 1HG ARG 13 0.413 -2.187 1.981
97 HD2 ARG 13 2HD ARG 13 1.119 -4.501 2.718
98 HD3 ARG 13 1HD ARG 13 2.032 -3.705 3.998
99 HE ARG 13 HE ARG 13 -0.862 -3.400 3.651
100 HH11 ARG 13 1HH1 ARG 13 1.952 -3.833 5.778
101 HH12 ARG 13 2HH1 ARG 13 1.039 -4.052 7.193
102 HH21 ARG 13 1HH2 ARG 13 -2.126 -3.698 5.617
103 HH22 ARG 13 2HH2 ARG 13 -1.345 -3.953 7.099
104 H CYS 14 H CYS 14 -0.014 -4.971 0.780
105 HA CYS 14 HA CYS 14 -1.480 -3.387 -1.120
106 HB2 CYS 14 2HB CYS 14 -2.341 -5.901 0.338
107 HB3 CYS 14 1HB CYS 14 -3.217 -5.115 -0.971
108 H ILE 15 H ILE 15 -3.102 -2.084 -0.649
109 HA ILE 15 HA ILE 15 -3.608 -1.526 2.198
110 HB ILE 15 HB ILE 15 -3.452 0.400 -0.149
111 HG12 ILE 15 2HG1 ILE 15 -1.220 -0.284 0.586
112 HG13 ILE 15 1HG1 ILE 15 -1.510 1.403 0.986
113 HG21 ILE 15 1HG2 ILE 15 -5.167 1.149 1.361
114 HG22 ILE 15 2HG2 ILE 15 -3.764 2.209 1.496
115 HG23 ILE 15 3HG2 ILE 15 -4.075 0.988 2.732
116 HD11 ILE 15 3HD1 ILE 15 -1.630 -0.925 2.895
117 HD12 ILE 15 1HD1 ILE 15 -1.949 0.763 3.314
118 HD13 ILE 15 2HD1 ILE 15 -0.342 0.271 2.777
119 H CYS 16 H CYS 16 -5.782 -1.230 2.705
120 HA CYS 16 HA CYS 16 -7.619 -1.661 0.470
121 HB2 CYS 16 2HB CYS 16 -8.021 -2.526 3.327
122 HB3 CYS 16 1HB CYS 16 -9.063 -2.880 1.950
123 H THR 17 H THR 17 -9.106 -0.241 0.135
124 HA THR 17 HA THR 17 -9.927 1.588 2.245
125 HB THR 17 HB THR 17 -9.155 2.466 -0.567
126 HG1 THR 17 1HG THR 17 -7.705 2.068 1.702
127 HG21 THR 17 3HG2 THR 17 -10.891 3.837 0.533
128 HG22 THR 17 1HG2 THR 17 -9.383 4.734 0.358
129 HG23 THR 17 2HG2 THR 17 -9.830 4.051 1.924
130 H ARG 18 H ARG 18 -12.128 1.755 2.244
131 HA ARG 18 HA ARG 18 -14.286 1.410 1.759
132 HB2 ARG 18 2HB ARG 18 -13.821 2.955 -0.166
133 HB3 ARG 18 1HB ARG 18 -13.393 1.570 -1.143
134 HG2 ARG 18 2HG ARG 18 -15.701 0.749 -0.989
135 HG3 ARG 18 1HG ARG 18 -16.124 2.146 0.002
136 HD2 ARG 18 2HD ARG 18 -16.764 2.386 -2.375
137 HD3 ARG 18 1HD ARG 18 -15.657 3.644 -1.831
138 HE ARG 18 HE ARG 18 -13.911 2.080 -2.864
139 HH11 ARG 18 1HH1 ARG 18 -17.159 2.484 -4.206
140 HH12 ARG 18 2HH1 ARG 18 -16.667 2.333 -5.824
141 HH21 ARG 18 1HH2 ARG 18 -13.227 1.849 -5.066
142 HH22 ARG 18 2HH2 ARG 18 -14.375 1.908 -6.326
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -12.803 -1.737 1.664
2 HA2 GLY 1 2HA GLY 1 -12.981 -4.037 1.382
3 HA3 GLY 1 1HA GLY 1 -14.360 -3.775 0.317
4 H PHE 2 H PHE 2 -12.081 -1.706 -0.726
5 HA PHE 2 HA PHE 2 -11.258 -3.542 -2.826
6 HB2 PHE 2 2HB PHE 2 -12.381 -1.362 -3.434
7 HB3 PHE 2 1HB PHE 2 -11.070 -0.536 -2.634
8 HD1 PHE 2 2HD PHE 2 -11.816 -2.788 -5.470
9 HD2 PHE 2 1HD PHE 2 -9.077 -0.037 -3.734
10 HE1 PHE 2 2HE PHE 2 -10.512 -2.773 -7.554
11 HE2 PHE 2 1HE PHE 2 -7.774 -0.014 -5.816
12 HZ PHE 2 HZ PHE 2 -8.489 -1.382 -7.722
13 H CYS 3 H CYS 3 -9.348 -4.485 -2.420
14 HA CYS 3 HA CYS 3 -7.387 -3.030 -0.884
15 HB2 CYS 3 2HB CYS 3 -7.395 -5.891 -1.840
16 HB3 CYS 3 1HB CYS 3 -6.125 -5.116 -0.886
17 H ARG 4 H ARG 4 -5.794 -2.068 -1.659
18 HA ARG 4 HA ARG 4 -5.180 -2.378 -4.521
19 HB2 ARG 4 2HB ARG 4 -6.542 -0.378 -3.994
20 HB3 ARG 4 1HB ARG 4 -5.294 0.147 -2.877
21 HG2 ARG 4 2HG ARG 4 -3.730 0.367 -4.733
22 HG3 ARG 4 1HG ARG 4 -4.988 -0.170 -5.850
23 HD2 ARG 4 2HD ARG 4 -6.383 1.738 -5.163
24 HD3 ARG 4 1HD ARG 4 -5.085 2.287 -4.102
25 HE ARG 4 HE ARG 4 -4.116 1.943 -6.706
26 HH11 ARG 4 1HH1 ARG 4 -6.208 4.153 -4.875
27 HH12 ARG 4 2HH1 ARG 4 -5.848 5.497 -5.860
28 HH21 ARG 4 1HH2 ARG 4 -3.677 3.756 -8.036
29 HH22 ARG 4 2HH2 ARG 4 -4.403 5.282 -7.683
30 H CYS 5 H CYS 5 -3.011 -2.613 -4.916
31 HA CYS 5 HA CYS 5 -1.288 -2.302 -2.603
32 HB2 CYS 5 2HB CYS 5 -0.927 -4.085 -4.999
33 HB3 CYS 5 1HB CYS 5 0.234 -3.849 -3.691
34 H LEU 6 H LEU 6 0.307 -1.083 -2.553
35 HA LEU 6 HA LEU 6 1.182 0.314 -5.007
36 HB2 LEU 6 2HB LEU 6 1.191 1.322 -2.137
37 HB3 LEU 6 1HB LEU 6 1.982 2.144 -3.455
38 HG LEU 6 HG LEU 6 -0.324 2.405 -4.510
39 HD11 LEU 6 1HD1 LEU 6 -2.260 2.319 -3.033
40 HD12 LEU 6 2HD1 LEU 6 -1.260 1.617 -1.762
41 HD13 LEU 6 3HD1 LEU 6 -1.539 0.722 -3.257
42 HD21 LEU 6 3HD2 LEU 6 0.212 3.747 -1.869
43 HD22 LEU 6 1HD2 LEU 6 -0.894 4.330 -3.117
44 HD23 LEU 6 2HD2 LEU 6 0.840 4.244 -3.441
45 H CYS 7 H CYS 7 3.519 0.502 -5.214
46 HA CYS 7 HA CYS 7 4.818 -1.271 -3.303
47 HB2 CYS 7 2HB CYS 7 5.404 -1.181 -6.256
48 HB3 CYS 7 1HB CYS 7 6.265 -2.154 -5.055
49 H ARG 8 H ARG 8 6.701 -0.790 -2.464
50 HA ARG 8 HA ARG 8 7.966 1.733 -3.217
51 HB2 ARG 8 2HB ARG 8 6.366 2.061 -1.392
52 HB3 ARG 8 1HB ARG 8 7.146 0.787 -0.484
53 HG2 ARG 8 2HG ARG 8 9.237 2.137 -0.452
54 HG3 ARG 8 1HG ARG 8 8.341 3.447 -1.227
55 HD2 ARG 8 2HD ARG 8 6.785 3.502 0.641
56 HD3 ARG 8 1HD ARG 8 7.654 2.178 1.409
57 HE ARG 8 HE ARG 8 9.370 4.349 0.841
58 HH11 ARG 8 1HH1 ARG 8 6.881 3.298 3.105
59 HH12 ARG 8 2HH1 ARG 8 7.445 4.229 4.411
60 HH21 ARG 8 1HH2 ARG 8 10.175 5.649 2.627
61 HH22 ARG 8 2HH2 ARG 8 9.350 5.605 4.121
62 H ARG 9 H ARG 9 10.009 1.150 -3.651
63 HA ARG 9 HA ARG 9 12.145 0.356 -3.464
64 HB2 ARG 9 2HB ARG 9 11.707 1.398 -1.151
65 HB3 ARG 9 1HB ARG 9 11.477 -0.238 -0.593
66 HG2 ARG 9 2HG ARG 9 13.778 -0.793 -1.270
67 HG3 ARG 9 1HG ARG 9 14.018 0.889 -1.759
68 HD2 ARG 9 2HD ARG 9 13.440 1.587 0.551
69 HD3 ARG 9 1HD ARG 9 13.351 -0.118 0.992
70 HE ARG 9 HE ARG 9 15.826 0.719 -0.196
71 HH11 ARG 9 1HH1 ARG 9 14.064 0.116 2.800
72 HH12 ARG 9 2HH1 ARG 9 15.447 0.161 3.806
73 HH21 ARG 9 1HH2 ARG 9 17.738 0.807 1.181
74 HH22 ARG 9 2HH2 ARG 9 17.589 0.541 2.852
75 H GLY 10 H GLY 10 10.076 -1.503 -4.218
76 HA2 GLY 10 2HA GLY 10 10.377 -3.693 -4.989
77 HA3 GLY 10 1HA GLY 10 11.609 -3.903 -3.761
78 H VAL 11 H VAL 11 9.390 -2.680 -1.860
79 HA VAL 11 HA VAL 11 8.086 -5.272 -1.507
80 HB VAL 11 HB VAL 11 9.540 -4.604 0.423
81 HG11 VAL 11 1HG1 VAL 11 7.636 -2.310 0.783
82 HG12 VAL 11 2HG1 VAL 11 9.341 -2.209 0.346
83 HG13 VAL 11 3HG1 VAL 11 8.875 -2.802 1.937
84 HG21 VAL 11 3HG2 VAL 11 6.595 -4.725 1.063
85 HG22 VAL 11 1HG2 VAL 11 7.897 -5.003 2.221
86 HG23 VAL 11 2HG2 VAL 11 7.688 -6.094 0.850
87 H CYS 12 H CYS 12 5.832 -5.309 -1.231
88 HA CYS 12 HA CYS 12 4.720 -2.806 -2.094
89 HB2 CYS 12 2HB CYS 12 3.596 -5.566 -2.548
90 HB3 CYS 12 1HB CYS 12 2.887 -4.037 -3.077
91 H ARG 13 H ARG 13 3.243 -1.829 -1.152
92 HA ARG 13 HA ARG 13 2.386 -2.741 1.487
93 HB2 ARG 13 2HB ARG 13 3.726 -0.657 1.449
94 HB3 ARG 13 1HB ARG 13 2.610 0.041 0.287
95 HG2 ARG 13 2HG ARG 13 2.180 0.954 2.471
96 HG3 ARG 13 1HG ARG 13 0.824 -0.073 1.997
97 HD2 ARG 13 2HD ARG 13 1.833 -1.909 3.332
98 HD3 ARG 13 1HD ARG 13 3.075 -0.781 3.873
99 HE ARG 13 HE ARG 13 0.754 0.466 4.453
100 HH11 ARG 13 1HH1 ARG 13 2.117 -2.684 5.267
101 HH12 ARG 13 2HH1 ARG 13 1.291 -2.830 6.751
102 HH21 ARG 13 1HH2 ARG 13 -0.385 0.263 6.516
103 HH22 ARG 13 2HH2 ARG 13 -0.179 -1.144 7.459
104 H CYS 14 H CYS 14 0.318 -3.397 1.470
105 HA CYS 14 HA CYS 14 -1.342 -2.352 -0.653
106 HB2 CYS 14 2HB CYS 14 -1.663 -4.936 0.893
107 HB3 CYS 14 1HB CYS 14 -2.699 -4.400 -0.426
108 H ILE 15 H ILE 15 -3.242 -1.402 -0.155
109 HA ILE 15 HA ILE 15 -3.997 -1.227 2.665
110 HB ILE 15 HB ILE 15 -2.872 0.853 2.070
111 HG12 ILE 15 2HG1 ILE 15 -4.726 2.530 2.408
112 HG13 ILE 15 1HG1 ILE 15 -5.872 1.212 2.218
113 HG21 ILE 15 1HG2 ILE 15 -4.771 1.087 -0.242
114 HG22 ILE 15 2HG2 ILE 15 -3.029 0.818 -0.312
115 HG23 ILE 15 3HG2 ILE 15 -3.655 2.347 0.294
116 HD11 ILE 15 3HD1 ILE 15 -3.786 1.443 4.367
117 HD12 ILE 15 1HD1 ILE 15 -4.922 0.109 4.175
118 HD13 ILE 15 2HD1 ILE 15 -5.518 1.722 4.553
119 H CYS 16 H CYS 16 -6.224 -1.385 3.019
120 HA CYS 16 HA CYS 16 -7.804 -1.805 0.598
121 HB2 CYS 16 2HB CYS 16 -8.278 -2.979 3.341
122 HB3 CYS 16 1HB CYS 16 -9.198 -3.320 1.882
123 H THR 17 H THR 17 -9.443 -0.597 0.263
124 HA THR 17 HA THR 17 -10.550 0.991 2.440
125 HB THR 17 HB THR 17 -9.752 2.114 -0.267
126 HG1 THR 17 1HG THR 17 -8.463 1.943 2.200
127 HG21 THR 17 3HG2 THR 17 -11.628 3.296 0.777
128 HG22 THR 17 1HG2 THR 17 -10.182 4.296 0.812
129 HG23 THR 17 2HG2 THR 17 -10.715 3.468 2.274
130 H ARG 18 H ARG 18 -12.703 0.629 2.415
131 HA ARG 18 HA ARG 18 -14.852 0.320 1.751
132 HB2 ARG 18 2HB ARG 18 -13.862 1.029 -1.011
133 HB3 ARG 18 1HB ARG 18 -15.546 0.941 -0.522
134 HG2 ARG 18 2HG ARG 18 -15.287 2.829 0.921
135 HG3 ARG 18 1HG ARG 18 -13.546 2.850 0.666
136 HD2 ARG 18 2HD ARG 18 -15.698 3.411 -1.368
137 HD3 ARG 18 1HD ARG 18 -14.558 4.566 -0.676
138 HE ARG 18 HE ARG 18 -13.627 2.280 -2.277
139 HH11 ARG 18 1HH1 ARG 18 -13.651 5.780 -1.699
140 HH12 ARG 18 2HH1 ARG 18 -12.675 6.149 -3.040
141 HH21 ARG 18 1HH2 ARG 18 -12.244 2.770 -4.051
142 HH22 ARG 18 2HH2 ARG 18 -11.846 4.383 -4.427
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -12.513 -1.028 1.749
2 HA2 GLY 1 2HA GLY 1 -13.084 -3.290 1.695
3 HA3 GLY 1 1HA GLY 1 -14.443 -2.891 0.656
4 H PHE 2 H PHE 2 -11.990 -1.349 -0.765
5 HA PHE 2 HA PHE 2 -11.480 -3.578 -2.567
6 HB2 PHE 2 2HB PHE 2 -12.467 -1.648 -3.642
7 HB3 PHE 2 1HB PHE 2 -11.252 -0.579 -2.959
8 HD1 PHE 2 2HD PHE 2 -11.641 -3.506 -5.228
9 HD2 PHE 2 1HD PHE 2 -9.342 -0.068 -4.207
10 HE1 PHE 2 2HE PHE 2 -10.259 -3.837 -7.236
11 HE2 PHE 2 1HE PHE 2 -7.964 -0.392 -6.213
12 HZ PHE 2 HZ PHE 2 -8.415 -2.278 -7.729
13 H CYS 3 H CYS 3 -9.576 -4.508 -2.458
14 HA CYS 3 HA CYS 3 -7.458 -3.126 -1.045
15 HB2 CYS 3 2HB CYS 3 -7.625 -6.033 -1.838
16 HB3 CYS 3 1HB CYS 3 -6.403 -5.262 -0.816
17 H ARG 4 H ARG 4 -5.850 -2.349 -1.882
18 HA ARG 4 HA ARG 4 -5.207 -2.856 -4.704
19 HB2 ARG 4 2HB ARG 4 -4.662 -0.362 -4.791
20 HB3 ARG 4 1HB ARG 4 -6.375 -0.758 -4.690
21 HG2 ARG 4 2HG ARG 4 -6.327 -0.306 -2.277
22 HG3 ARG 4 1HG ARG 4 -4.621 0.103 -2.392
23 HD2 ARG 4 2HD ARG 4 -5.125 2.009 -3.764
24 HD3 ARG 4 1HD ARG 4 -6.830 1.541 -3.865
25 HE ARG 4 HE ARG 4 -6.551 1.766 -1.250
26 HH11 ARG 4 1HH1 ARG 4 -5.388 4.004 -3.734
27 HH12 ARG 4 2HH1 ARG 4 -5.528 5.379 -2.767
28 HH21 ARG 4 1HH2 ARG 4 -6.753 3.600 0.073
29 HH22 ARG 4 2HH2 ARG 4 -6.360 5.157 -0.499
30 H CYS 5 H CYS 5 -2.915 -2.663 -5.115
31 HA CYS 5 HA CYS 5 -1.449 -2.660 -2.617
32 HB2 CYS 5 2HB CYS 5 -0.720 -4.207 -5.099
33 HB3 CYS 5 1HB CYS 5 0.218 -4.107 -3.600
34 H LEU 6 H LEU 6 0.132 -1.436 -2.246
35 HA LEU 6 HA LEU 6 0.968 0.374 -4.404
36 HB2 LEU 6 2HB LEU 6 -0.367 1.460 -2.601
37 HB3 LEU 6 1HB LEU 6 0.777 0.897 -1.414
38 HG LEU 6 HG LEU 6 0.893 3.354 -1.998
39 HD11 LEU 6 1HD1 LEU 6 2.768 2.306 -0.881
40 HD12 LEU 6 2HD1 LEU 6 3.328 3.508 -2.040
41 HD13 LEU 6 3HD1 LEU 6 3.430 1.793 -2.434
42 HD21 LEU 6 3HD2 LEU 6 2.068 2.316 -4.568
43 HD22 LEU 6 1HD2 LEU 6 2.055 3.999 -4.046
44 HD23 LEU 6 2HD2 LEU 6 0.534 3.172 -4.394
45 H CYS 7 H CYS 7 3.011 0.067 -4.988
46 HA CYS 7 HA CYS 7 4.716 -1.304 -3.063
47 HB2 CYS 7 2HB CYS 7 5.088 -1.121 -6.056
48 HB3 CYS 7 1HB CYS 7 6.054 -2.052 -4.908
49 H ARG 8 H ARG 8 6.636 -0.456 -2.456
50 HA ARG 8 HA ARG 8 7.699 1.867 -3.811
51 HB2 ARG 8 2HB ARG 8 6.111 2.563 -2.021
52 HB3 ARG 8 1HB ARG 8 7.152 1.746 -0.875
53 HG2 ARG 8 2HG ARG 8 9.043 3.202 -1.549
54 HG3 ARG 8 1HG ARG 8 7.949 4.086 -2.611
55 HD2 ARG 8 2HD ARG 8 6.585 4.674 -0.642
56 HD3 ARG 8 1HD ARG 8 7.755 3.855 0.389
57 HE ARG 8 HE ARG 8 8.888 5.838 -1.341
58 HH11 ARG 8 1HH1 ARG 8 7.393 5.327 1.816
59 HH12 ARG 8 2HH1 ARG 8 8.060 6.701 2.547
60 HH21 ARG 8 1HH2 ARG 8 9.845 7.761 -0.348
61 HH22 ARG 8 2HH2 ARG 8 9.497 8.119 1.275
62 H ARG 9 H ARG 9 9.872 1.671 -3.833
63 HA ARG 9 HA ARG 9 11.983 0.903 -3.509
64 HB2 ARG 9 2HB ARG 9 11.049 0.901 -0.651
65 HB3 ARG 9 1HB ARG 9 12.719 0.626 -1.125
66 HG2 ARG 9 2HG ARG 9 12.762 2.854 -2.157
67 HG3 ARG 9 1HG ARG 9 11.105 3.124 -1.628
68 HD2 ARG 9 2HD ARG 9 11.789 2.912 0.698
69 HD3 ARG 9 1HD ARG 9 13.436 2.538 0.191
70 HE ARG 9 HE ARG 9 12.649 4.994 -0.897
71 HH11 ARG 9 1HH1 ARG 9 13.573 3.592 2.257
72 HH12 ARG 9 2HH1 ARG 9 14.204 5.044 2.866
73 HH21 ARG 9 1HH2 ARG 9 13.533 6.995 -0.009
74 HH22 ARG 9 2HH2 ARG 9 14.161 7.002 1.572
75 H GLY 10 H GLY 10 10.101 -1.091 -4.195
76 HA2 GLY 10 2HA GLY 10 10.602 -3.304 -4.766
77 HA3 GLY 10 1HA GLY 10 11.702 -3.353 -3.401
78 H VAL 11 H VAL 11 9.379 -2.169 -1.726
79 HA VAL 11 HA VAL 11 8.283 -4.821 -1.192
80 HB VAL 11 HB VAL 11 9.421 -3.827 0.750
81 HG11 VAL 11 1HG1 VAL 11 9.143 -1.466 0.247
82 HG12 VAL 11 2HG1 VAL 11 8.596 -1.834 1.879
83 HG13 VAL 11 3HG1 VAL 11 7.419 -1.581 0.594
84 HG21 VAL 11 3HG2 VAL 11 7.616 -3.994 2.424
85 HG22 VAL 11 1HG2 VAL 11 7.529 -5.282 1.217
86 HG23 VAL 11 2HG2 VAL 11 6.430 -3.908 1.129
87 H CYS 12 H CYS 12 6.145 -5.230 -1.226
88 HA CYS 12 HA CYS 12 4.556 -2.982 -2.099
89 HB2 CYS 12 2HB CYS 12 4.053 -5.908 -2.595
90 HB3 CYS 12 1HB CYS 12 3.004 -4.538 -3.018
91 H ARG 13 H ARG 13 3.068 -2.287 -1.036
92 HA ARG 13 HA ARG 13 2.247 -3.681 1.434
93 HB2 ARG 13 2HB ARG 13 3.496 -1.567 1.796
94 HB3 ARG 13 1HB ARG 13 2.309 -0.718 0.822
95 HG2 ARG 13 2HG ARG 13 0.581 -1.184 2.461
96 HG3 ARG 13 1HG ARG 13 1.725 -2.122 3.422
97 HD2 ARG 13 2HD ARG 13 1.489 0.083 4.381
98 HD3 ARG 13 1HD ARG 13 3.108 -0.106 3.717
99 HE ARG 13 HE ARG 13 0.945 1.385 2.361
100 HH11 ARG 13 1HH1 ARG 13 4.401 1.033 3.159
101 HH12 ARG 13 2HH1 ARG 13 4.822 2.559 2.546
102 HH21 ARG 13 1HH2 ARG 13 1.553 3.470 1.550
103 HH22 ARG 13 2HH2 ARG 13 3.189 3.977 1.620
104 H CYS 14 H CYS 14 0.249 -4.535 1.125
105 HA CYS 14 HA CYS 14 -1.413 -3.181 -0.782
106 HB2 CYS 14 2HB CYS 14 -1.832 -5.849 0.581
107 HB3 CYS 14 1HB CYS 14 -2.856 -5.175 -0.687
108 H ILE 15 H ILE 15 -3.254 -2.206 -0.348
109 HA ILE 15 HA ILE 15 -3.915 -1.816 2.476
110 HB ILE 15 HB ILE 15 -3.644 0.268 0.292
111 HG12 ILE 15 2HG1 ILE 15 -1.486 -0.344 1.224
112 HG13 ILE 15 1HG1 ILE 15 -1.944 1.273 1.746
113 HG21 ILE 15 1HG2 ILE 15 -4.260 1.957 1.942
114 HG22 ILE 15 2HG2 ILE 15 -4.593 0.689 3.114
115 HG23 ILE 15 3HG2 ILE 15 -5.573 0.811 1.656
116 HD11 ILE 15 3HD1 ILE 15 -2.080 -1.245 3.396
117 HD12 ILE 15 1HD1 ILE 15 -2.629 0.351 3.922
118 HD13 ILE 15 2HD1 ILE 15 -0.929 0.073 3.562
119 H CYS 16 H CYS 16 -6.045 -1.922 2.850
120 HA CYS 16 HA CYS 16 -7.792 -2.077 0.527
121 HB2 CYS 16 2HB CYS 16 -8.307 -2.985 3.354
122 HB3 CYS 16 1HB CYS 16 -9.349 -3.268 1.959
123 H THR 17 H THR 17 -9.161 -0.640 0.143
124 HA THR 17 HA THR 17 -9.836 1.324 2.188
125 HB THR 17 HB THR 17 -9.005 1.991 -0.653
126 HG1 THR 17 1HG THR 17 -7.617 1.764 1.724
127 HG21 THR 17 3HG2 THR 17 -10.630 3.568 0.388
128 HG22 THR 17 1HG2 THR 17 -9.053 4.309 0.121
129 HG23 THR 17 2HG2 THR 17 -9.506 3.784 1.733
130 H ARG 18 H ARG 18 -12.001 1.402 2.254
131 HA ARG 18 HA ARG 18 -14.187 1.355 1.709
132 HB2 ARG 18 2HB ARG 18 -13.438 3.025 -0.033
133 HB3 ARG 18 1HB ARG 18 -13.246 1.696 -1.158
134 HG2 ARG 18 2HG ARG 18 -15.670 1.241 -0.970
135 HG3 ARG 18 1HG ARG 18 -15.824 2.677 0.049
136 HD2 ARG 18 2HD ARG 18 -16.387 3.231 -2.243
137 HD3 ARG 18 1HD ARG 18 -14.898 4.050 -1.762
138 HE ARG 18 HE ARG 18 -14.646 1.504 -3.158
139 HH11 ARG 18 1HH1 ARG 18 -14.394 5.027 -3.343
140 HH12 ARG 18 2HH1 ARG 18 -13.578 5.028 -4.838
141 HH21 ARG 18 1HH2 ARG 18 -13.555 1.509 -5.191
142 HH22 ARG 18 2HH2 ARG 18 -13.117 2.969 -5.946
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -12.850 -1.543 2.053
2 HA2 GLY 1 2HA GLY 1 -13.185 -3.788 1.547
3 HA3 GLY 1 1HA GLY 1 -14.708 -3.342 0.792
4 H PHE 2 H PHE 2 -12.027 -1.567 -0.287
5 HA PHE 2 HA PHE 2 -11.736 -3.311 -2.618
6 HB2 PHE 2 2HB PHE 2 -12.911 -1.260 -3.209
7 HB3 PHE 2 1HB PHE 2 -11.670 -0.265 -2.476
8 HD1 PHE 2 1HD PHE 2 -12.494 -2.489 -5.279
9 HD2 PHE 2 2HD PHE 2 -9.641 0.235 -3.688
10 HE1 PHE 2 1HE PHE 2 -11.362 -2.407 -7.458
11 HE2 PHE 2 2HE PHE 2 -8.502 0.323 -5.867
12 HZ PHE 2 HZ PHE 2 -9.361 -1.001 -7.754
13 H CYS 3 H CYS 3 -9.709 -4.055 -2.889
14 HA CYS 3 HA CYS 3 -7.589 -2.788 -1.309
15 HB2 CYS 3 2HB CYS 3 -7.815 -5.644 -2.271
16 HB3 CYS 3 1HB CYS 3 -6.442 -4.978 -1.400
17 H ARG 4 H ARG 4 -5.819 -2.076 -2.271
18 HA ARG 4 HA ARG 4 -5.186 -2.955 -4.954
19 HB2 ARG 4 2HB ARG 4 -4.728 -0.625 -5.674
20 HB3 ARG 4 1HB ARG 4 -6.427 -0.873 -5.309
21 HG2 ARG 4 2HG ARG 4 -6.132 0.242 -3.154
22 HG3 ARG 4 1HG ARG 4 -4.418 0.467 -3.513
23 HD2 ARG 4 2HD ARG 4 -6.719 1.594 -5.107
24 HD3 ARG 4 1HD ARG 4 -5.699 2.504 -3.994
25 HE ARG 4 HE ARG 4 -3.951 1.387 -5.736
26 HH11 ARG 4 1HH1 ARG 4 -6.754 3.524 -6.138
27 HH12 ARG 4 2HH1 ARG 4 -6.194 4.204 -7.589
28 HH21 ARG 4 1HH2 ARG 4 -3.191 2.306 -7.695
29 HH22 ARG 4 2HH2 ARG 4 -4.099 3.482 -8.534
30 H CYS 5 H CYS 5 -2.882 -2.819 -5.361
31 HA CYS 5 HA CYS 5 -1.519 -2.470 -2.830
32 HB2 CYS 5 2HB CYS 5 -0.716 -4.341 -5.062
33 HB3 CYS 5 1HB CYS 5 0.072 -4.183 -3.499
34 H LEU 6 H LEU 6 0.361 -1.522 -2.654
35 HA LEU 6 HA LEU 6 1.361 -0.011 -4.993
36 HB2 LEU 6 2HB LEU 6 1.225 0.888 -2.103
37 HB3 LEU 6 1HB LEU 6 2.013 1.768 -3.391
38 HG LEU 6 HG LEU 6 -0.958 1.243 -3.183
39 HD11 LEU 6 1HD1 LEU 6 -0.191 2.810 -1.501
40 HD12 LEU 6 2HD1 LEU 6 -1.086 3.665 -2.757
41 HD13 LEU 6 3HD1 LEU 6 0.673 3.735 -2.725
42 HD21 LEU 6 3HD2 LEU 6 -0.221 1.398 -5.504
43 HD22 LEU 6 1HD2 LEU 6 0.631 2.897 -5.144
44 HD23 LEU 6 2HD2 LEU 6 -1.129 2.837 -5.042
45 H CYS 7 H CYS 7 3.650 0.118 -5.088
46 HA CYS 7 HA CYS 7 4.912 -1.444 -3.009
47 HB2 CYS 7 2HB CYS 7 5.748 -1.452 -5.926
48 HB3 CYS 7 1HB CYS 7 6.594 -2.241 -4.600
49 H ARG 8 H ARG 8 6.650 -0.655 -2.082
50 HA ARG 8 HA ARG 8 7.563 1.953 -3.007
51 HB2 ARG 8 2HB ARG 8 6.198 2.141 -1.001
52 HB3 ARG 8 1HB ARG 8 7.179 0.931 -0.194
53 HG2 ARG 8 2HG ARG 8 9.065 2.421 -0.143
54 HG3 ARG 8 1HG ARG 8 8.199 3.619 -1.106
55 HD2 ARG 8 2HD ARG 8 8.192 4.192 1.284
56 HD3 ARG 8 1HD ARG 8 6.566 3.905 0.674
57 HE ARG 8 HE ARG 8 7.963 1.706 1.975
58 HH11 ARG 8 1HH1 ARG 8 5.444 4.211 2.211
59 HH12 ARG 8 2HH1 ARG 8 4.637 3.487 3.503
60 HH21 ARG 8 1HH2 ARG 8 6.839 0.705 3.772
61 HH22 ARG 8 2HH2 ARG 8 5.441 1.413 4.409
62 H ARG 9 H ARG 9 9.229 1.172 -4.132
63 HA ARG 9 HA ARG 9 11.326 0.557 -4.598
64 HB2 ARG 9 2HB ARG 9 11.645 2.459 -3.006
65 HB3 ARG 9 1HB ARG 9 11.904 1.254 -1.744
66 HG2 ARG 9 2HG ARG 9 13.878 0.442 -2.837
67 HG3 ARG 9 1HG ARG 9 13.581 1.468 -4.240
68 HD2 ARG 9 2HD ARG 9 13.868 3.453 -2.823
69 HD3 ARG 9 1HD ARG 9 14.219 2.405 -1.448
70 HE ARG 9 HE ARG 9 16.157 1.608 -2.687
71 HH11 ARG 9 1HH1 ARG 9 14.808 4.769 -3.648
72 HH12 ARG 9 2HH1 ARG 9 16.267 5.301 -4.337
73 HH21 ARG 9 1HH2 ARG 9 18.140 2.396 -3.641
74 HH22 ARG 9 2HH2 ARG 9 18.194 3.944 -4.334
75 H GLY 10 H GLY 10 9.939 -1.525 -4.277
76 HA2 GLY 10 2HA GLY 10 10.614 -3.791 -4.418
77 HA3 GLY 10 1HA GLY 10 11.859 -3.424 -3.239
78 H VAL 11 H VAL 11 9.626 -2.024 -1.598
79 HA VAL 11 HA VAL 11 8.721 -4.520 -0.363
80 HB VAL 11 HB VAL 11 8.642 -1.698 0.756
81 HG11 VAL 11 1HG1 VAL 11 8.167 -4.360 2.099
82 HG12 VAL 11 2HG1 VAL 11 6.944 -3.142 1.747
83 HG13 VAL 11 3HG1 VAL 11 8.221 -2.800 2.918
84 HG21 VAL 11 3HG2 VAL 11 10.939 -2.442 0.458
85 HG22 VAL 11 1HG2 VAL 11 10.590 -3.936 1.324
86 HG23 VAL 11 2HG2 VAL 11 10.534 -2.390 2.174
87 H CYS 12 H CYS 12 6.710 -5.148 -0.932
88 HA CYS 12 HA CYS 12 4.977 -3.067 -1.939
89 HB2 CYS 12 2HB CYS 12 4.738 -6.054 -2.234
90 HB3 CYS 12 1HB CYS 12 3.585 -4.874 -2.852
91 H ARG 13 H ARG 13 3.142 -2.517 -1.165
92 HA ARG 13 HA ARG 13 2.220 -3.773 1.338
93 HB2 ARG 13 2HB ARG 13 3.409 -1.623 1.754
94 HB3 ARG 13 1HB ARG 13 2.294 -0.821 0.663
95 HG2 ARG 13 2HG ARG 13 1.621 -0.368 2.922
96 HG3 ARG 13 1HG ARG 13 0.432 -1.458 2.194
97 HD2 ARG 13 2HD ARG 13 0.980 -2.175 4.454
98 HD3 ARG 13 1HD ARG 13 1.546 -3.359 3.280
99 HE ARG 13 HE ARG 13 3.320 -1.309 4.372
100 HH11 ARG 13 1HH1 ARG 13 2.614 -4.758 3.829
101 HH12 ARG 13 2HH1 ARG 13 4.148 -5.266 4.385
102 HH21 ARG 13 1HH2 ARG 13 5.421 -2.073 5.101
103 HH22 ARG 13 2HH2 ARG 13 5.737 -3.739 5.126
104 H CYS 14 H CYS 14 0.037 -4.244 1.245
105 HA CYS 14 HA CYS 14 -1.344 -3.037 -0.994
106 HB2 CYS 14 2HB CYS 14 -2.086 -5.499 0.601
107 HB3 CYS 14 1HB CYS 14 -3.081 -4.825 -0.684
108 H ILE 15 H ILE 15 -3.162 -1.790 -0.700
109 HA ILE 15 HA ILE 15 -3.820 -1.216 2.096
110 HB ILE 15 HB ILE 15 -3.858 0.712 -0.271
111 HG12 ILE 15 2HG1 ILE 15 -2.238 2.065 1.197
112 HG13 ILE 15 1HG1 ILE 15 -2.038 0.606 2.149
113 HG21 ILE 15 1HG2 ILE 15 -4.642 1.234 2.584
114 HG22 ILE 15 2HG2 ILE 15 -5.716 1.171 1.190
115 HG23 ILE 15 3HG2 ILE 15 -4.508 2.451 1.319
116 HD11 ILE 15 3HD1 ILE 15 -1.369 0.930 -0.768
117 HD12 ILE 15 1HD1 ILE 15 -1.145 -0.539 0.182
118 HD13 ILE 15 2HD1 ILE 15 -0.218 0.908 0.569
119 H CYS 16 H CYS 16 -5.913 -1.460 2.624
120 HA CYS 16 HA CYS 16 -7.805 -1.766 0.411
121 HB2 CYS 16 2HB CYS 16 -7.959 -3.037 3.142
122 HB3 CYS 16 1HB CYS 16 -9.110 -3.253 1.832
123 H THR 17 H THR 17 -9.396 -0.417 0.371
124 HA THR 17 HA THR 17 -10.252 0.924 2.800
125 HB THR 17 HB THR 17 -9.611 2.368 0.200
126 HG1 THR 17 1HG THR 17 -8.131 1.694 2.343
127 HG21 THR 17 3HG2 THR 17 -10.470 3.435 2.904
128 HG22 THR 17 1HG2 THR 17 -11.487 3.365 1.464
129 HG23 THR 17 2HG2 THR 17 -10.071 4.415 1.490
130 H ARG 18 H ARG 18 -12.429 0.823 2.912
131 HA ARG 18 HA ARG 18 -14.648 0.741 2.377
132 HB2 ARG 18 2HB ARG 18 -14.004 2.670 0.913
133 HB3 ARG 18 1HB ARG 18 -13.734 1.544 -0.397
134 HG2 ARG 18 2HG ARG 18 -16.163 0.929 -0.227
135 HG3 ARG 18 1HG ARG 18 -16.346 2.280 0.898
136 HD2 ARG 18 2HD ARG 18 -16.905 2.983 -1.358
137 HD3 ARG 18 1HD ARG 18 -15.441 3.796 -0.804
138 HE ARG 18 HE ARG 18 -15.319 1.394 -2.496
139 HH11 ARG 18 1HH1 ARG 18 -14.223 4.686 -1.830
140 HH12 ARG 18 2HH1 ARG 18 -13.357 4.846 -3.282
141 HH21 ARG 18 1HH2 ARG 18 -14.092 1.575 -4.450
142 HH22 ARG 18 2HH2 ARG 18 -13.259 3.012 -4.826
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -12.566 -1.091 1.834
2 HA2 GLY 1 2HA GLY 1 -13.083 -3.319 1.531
3 HA3 GLY 1 1HA GLY 1 -14.491 -2.834 0.597
4 H PHE 2 H PHE 2 -11.915 -1.238 -0.663
5 HA PHE 2 HA PHE 2 -11.502 -3.276 -2.697
6 HB2 PHE 2 2HB PHE 2 -12.387 -1.236 -3.647
7 HB3 PHE 2 1HB PHE 2 -11.240 -0.256 -2.761
8 HD1 PHE 2 2HD PHE 2 -11.254 -3.037 -5.256
9 HD2 PHE 2 1HD PHE 2 -9.397 0.543 -3.905
10 HE1 PHE 2 2HE PHE 2 -9.724 -3.111 -7.178
11 HE2 PHE 2 1HE PHE 2 -7.857 0.471 -5.821
12 HZ PHE 2 HZ PHE 2 -8.023 -1.356 -7.462
13 H CYS 3 H CYS 3 -9.732 -4.382 -2.377
14 HA CYS 3 HA CYS 3 -7.547 -3.132 -0.980
15 HB2 CYS 3 2HB CYS 3 -7.886 -5.993 -1.872
16 HB3 CYS 3 1HB CYS 3 -6.506 -5.339 -0.972
17 H ARG 4 H ARG 4 -5.893 -2.343 -1.770
18 HA ARG 4 HA ARG 4 -5.341 -2.590 -4.646
19 HB2 ARG 4 2HB ARG 4 -6.432 -0.497 -4.116
20 HB3 ARG 4 1HB ARG 4 -5.330 -0.218 -2.785
21 HG2 ARG 4 2HG ARG 4 -3.491 0.015 -4.389
22 HG3 ARG 4 1HG ARG 4 -4.636 -0.217 -5.710
23 HD2 ARG 4 2HD ARG 4 -5.894 1.739 -4.985
24 HD3 ARG 4 1HD ARG 4 -4.779 1.967 -3.640
25 HE ARG 4 HE ARG 4 -3.235 1.926 -5.874
26 HH11 ARG 4 1HH1 ARG 4 -5.826 3.935 -4.585
27 HH12 ARG 4 2HH1 ARG 4 -5.404 5.325 -5.461
28 HH21 ARG 4 1HH2 ARG 4 -2.611 3.880 -7.085
29 HH22 ARG 4 2HH2 ARG 4 -3.530 5.291 -6.919
30 H CYS 5 H CYS 5 -3.147 -2.892 -5.094
31 HA CYS 5 HA CYS 5 -1.463 -2.900 -2.734
32 HB2 CYS 5 2HB CYS 5 -1.095 -4.521 -5.251
33 HB3 CYS 5 1HB CYS 5 -0.011 -4.498 -3.857
34 H LEU 6 H LEU 6 0.289 -1.817 -2.609
35 HA LEU 6 HA LEU 6 1.082 -0.207 -4.932
36 HB2 LEU 6 2HB LEU 6 -0.349 1.139 -3.421
37 HB3 LEU 6 1HB LEU 6 0.732 0.777 -2.094
38 HG LEU 6 HG LEU 6 2.537 2.019 -3.276
39 HD11 LEU 6 1HD1 LEU 6 0.339 2.797 -5.183
40 HD12 LEU 6 2HD1 LEU 6 1.722 1.777 -5.560
41 HD13 LEU 6 3HD1 LEU 6 1.968 3.474 -5.142
42 HD21 LEU 6 3HD2 LEU 6 1.624 4.249 -2.834
43 HD22 LEU 6 1HD2 LEU 6 1.203 3.107 -1.557
44 HD23 LEU 6 2HD2 LEU 6 -0.001 3.564 -2.763
45 H CYS 7 H CYS 7 3.212 -0.359 -5.261
46 HA CYS 7 HA CYS 7 4.699 -1.588 -3.146
47 HB2 CYS 7 2HB CYS 7 5.515 -1.177 -6.012
48 HB3 CYS 7 1HB CYS 7 6.481 -1.997 -4.780
49 H ARG 8 H ARG 8 6.266 -0.773 -2.083
50 HA ARG 8 HA ARG 8 6.902 2.045 -2.518
51 HB2 ARG 8 2HB ARG 8 5.412 1.599 -0.593
52 HB3 ARG 8 1HB ARG 8 6.601 0.490 0.059
53 HG2 ARG 8 2HG ARG 8 6.769 2.515 1.268
54 HG3 ARG 8 1HG ARG 8 8.177 2.407 0.212
55 HD2 ARG 8 2HD ARG 8 7.146 3.946 -1.361
56 HD3 ARG 8 1HD ARG 8 5.700 4.029 -0.346
57 HE ARG 8 HE ARG 8 8.285 4.764 0.783
58 HH11 ARG 8 1HH1 ARG 8 5.032 5.798 -0.220
59 HH12 ARG 8 2HH1 ARG 8 5.112 7.299 0.548
60 HH21 ARG 8 1HH2 ARG 8 8.393 6.845 1.860
61 HH22 ARG 8 2HH2 ARG 8 7.071 7.905 1.761
62 H ARG 9 H ARG 9 8.796 1.706 -3.583
63 HA ARG 9 HA ARG 9 10.989 1.421 -3.911
64 HB2 ARG 9 2HB ARG 9 11.107 1.286 -0.908
65 HB3 ARG 9 1HB ARG 9 12.498 1.499 -1.956
66 HG2 ARG 9 2HG ARG 9 10.197 3.418 -1.575
67 HG3 ARG 9 1HG ARG 9 11.864 3.640 -1.039
68 HD2 ARG 9 2HD ARG 9 12.597 3.610 -3.387
69 HD3 ARG 9 1HD ARG 9 10.918 3.445 -3.896
70 HE ARG 9 HE ARG 9 11.899 5.731 -2.368
71 HH11 ARG 9 1HH1 ARG 9 9.976 4.440 -5.068
72 HH12 ARG 9 2HH1 ARG 9 9.610 5.969 -5.708
73 HH21 ARG 9 1HH2 ARG 9 11.406 7.841 -3.299
74 HH22 ARG 9 2HH2 ARG 9 10.462 7.925 -4.715
75 H GLY 10 H GLY 10 9.539 -0.860 -4.188
76 HA2 GLY 10 2HA GLY 10 10.284 -2.988 -4.865
77 HA3 GLY 10 1HA GLY 10 11.622 -2.817 -3.734
78 H VAL 11 H VAL 11 9.486 -1.922 -1.688
79 HA VAL 11 HA VAL 11 8.795 -4.646 -0.905
80 HB VAL 11 HB VAL 11 8.649 -2.050 0.685
81 HG11 VAL 11 1HG1 VAL 11 7.004 -3.676 1.461
82 HG12 VAL 11 2HG1 VAL 11 8.294 -3.489 2.646
83 HG13 VAL 11 3HG1 VAL 11 8.262 -4.904 1.592
84 HG21 VAL 11 3HG2 VAL 11 10.948 -2.699 0.214
85 HG22 VAL 11 1HG2 VAL 11 10.636 -4.314 0.854
86 HG23 VAL 11 2HG2 VAL 11 10.574 -2.911 1.926
87 H CYS 12 H CYS 12 6.801 -5.282 -1.420
88 HA CYS 12 HA CYS 12 4.985 -3.169 -2.115
89 HB2 CYS 12 2HB CYS 12 4.800 -6.117 -2.702
90 HB3 CYS 12 1HB CYS 12 3.647 -4.886 -3.228
91 H ARG 13 H ARG 13 3.097 -2.784 -1.262
92 HA ARG 13 HA ARG 13 2.353 -4.326 1.123
93 HB2 ARG 13 2HB ARG 13 3.548 -2.159 1.653
94 HB3 ARG 13 1HB ARG 13 2.263 -1.314 0.808
95 HG2 ARG 13 2HG ARG 13 1.808 -1.159 3.143
96 HG3 ARG 13 1HG ARG 13 0.651 -2.297 2.458
97 HD2 ARG 13 2HD ARG 13 2.059 -4.167 3.197
98 HD3 ARG 13 1HD ARG 13 3.194 -3.010 3.881
99 HE ARG 13 HE ARG 13 0.519 -2.753 4.895
100 HH11 ARG 13 1HH1 ARG 13 3.652 -4.305 5.327
101 HH12 ARG 13 2HH1 ARG 13 3.383 -4.761 6.936
102 HH21 ARG 13 1HH2 ARG 13 0.134 -3.328 7.091
103 HH22 ARG 13 2HH2 ARG 13 1.304 -4.167 8.005
104 H CYS 14 H CYS 14 0.076 -4.489 1.338
105 HA CYS 14 HA CYS 14 -1.346 -3.191 -0.824
106 HB2 CYS 14 2HB CYS 14 -2.089 -5.800 0.536
107 HB3 CYS 14 1HB CYS 14 -3.028 -5.018 -0.730
108 H ILE 15 H ILE 15 -3.095 -2.015 -0.335
109 HA ILE 15 HA ILE 15 -3.780 -1.775 2.491
110 HB ILE 15 HB ILE 15 -2.380 0.131 1.897
111 HG12 ILE 15 2HG1 ILE 15 -5.289 0.983 2.008
112 HG13 ILE 15 1HG1 ILE 15 -4.282 0.580 3.393
113 HG21 ILE 15 1HG2 ILE 15 -2.584 0.119 -0.505
114 HG22 ILE 15 2HG2 ILE 15 -2.977 1.726 0.116
115 HG23 ILE 15 3HG2 ILE 15 -4.269 0.640 -0.393
116 HD11 ILE 15 3HD1 ILE 15 -4.527 2.980 3.143
117 HD12 ILE 15 1HD1 ILE 15 -3.847 2.894 1.518
118 HD13 ILE 15 2HD1 ILE 15 -2.849 2.493 2.922
119 H CYS 16 H CYS 16 -5.949 -1.691 2.867
120 HA CYS 16 HA CYS 16 -7.608 -1.847 0.476
121 HB2 CYS 16 2HB CYS 16 -8.229 -2.863 3.250
122 HB3 CYS 16 1HB CYS 16 -9.220 -3.102 1.812
123 H THR 17 H THR 17 -9.072 -0.460 0.093
124 HA THR 17 HA THR 17 -9.731 1.515 2.139
125 HB THR 17 HB THR 17 -9.077 2.104 -0.763
126 HG1 THR 17 1HG THR 17 -7.533 1.801 1.432
127 HG21 THR 17 3HG2 THR 17 -9.548 3.943 1.596
128 HG22 THR 17 1HG2 THR 17 -10.678 3.671 0.271
129 HG23 THR 17 2HG2 THR 17 -9.125 4.450 -0.040
130 H ARG 18 H ARG 18 -11.906 1.420 2.354
131 HA ARG 18 HA ARG 18 -14.133 1.305 1.923
132 HB2 ARG 18 2HB ARG 18 -13.589 3.160 0.366
133 HB3 ARG 18 1HB ARG 18 -13.244 2.003 -0.894
134 HG2 ARG 18 2HG ARG 18 -15.618 1.332 -0.890
135 HG3 ARG 18 1HG ARG 18 -15.938 2.565 0.338
136 HD2 ARG 18 2HD ARG 18 -16.461 3.332 -1.940
137 HD3 ARG 18 1HD ARG 18 -15.207 4.300 -1.165
138 HE ARG 18 HE ARG 18 -14.451 2.120 -2.972
139 HH11 ARG 18 1HH1 ARG 18 -14.576 5.596 -2.293
140 HH12 ARG 18 2HH1 ARG 18 -13.475 6.016 -3.526
141 HH21 ARG 18 1HH2 ARG 18 -12.935 2.731 -4.692
142 HH22 ARG 18 2HH2 ARG 18 -12.552 4.377 -4.894
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -12.036 -2.219 2.155
2 HA2 GLY 1 2HA GLY 1 -11.907 -4.553 1.887
3 HA3 GLY 1 1HA GLY 1 -13.500 -4.518 1.137
4 H PHE 2 H PHE 2 -12.016 -2.067 -0.321
5 HA PHE 2 HA PHE 2 -11.160 -3.698 -2.586
6 HB2 PHE 2 2HB PHE 2 -12.848 -1.747 -2.872
7 HB3 PHE 2 1HB PHE 2 -11.528 -0.705 -2.408
8 HD1 PHE 2 2HD PHE 2 -12.585 -3.103 -4.978
9 HD2 PHE 2 1HD PHE 2 -9.865 -0.022 -3.912
10 HE1 PHE 2 2HE PHE 2 -11.779 -3.026 -7.300
11 HE2 PHE 2 1HE PHE 2 -9.048 0.059 -6.223
12 HZ PHE 2 HZ PHE 2 -10.005 -1.446 -7.924
13 H CYS 3 H CYS 3 -9.000 -3.979 -2.821
14 HA CYS 3 HA CYS 3 -7.325 -2.168 -1.264
15 HB2 CYS 3 2HB CYS 3 -6.648 -4.975 -2.106
16 HB3 CYS 3 1HB CYS 3 -5.684 -3.893 -1.106
17 H ARG 4 H ARG 4 -6.019 -0.914 -2.089
18 HA ARG 4 HA ARG 4 -5.412 -0.985 -4.961
19 HB2 ARG 4 2HB ARG 4 -4.855 1.109 -2.841
20 HB3 ARG 4 1HB ARG 4 -4.602 1.316 -4.560
21 HG2 ARG 4 2HG ARG 4 -7.051 1.102 -4.910
22 HG3 ARG 4 1HG ARG 4 -7.248 0.966 -3.169
23 HD2 ARG 4 2HD ARG 4 -7.661 3.253 -3.936
24 HD3 ARG 4 1HD ARG 4 -6.282 3.164 -2.845
25 HE ARG 4 HE ARG 4 -5.682 3.018 -5.666
26 HH11 ARG 4 1HH1 ARG 4 -5.936 5.117 -2.798
27 HH12 ARG 4 2HH1 ARG 4 -5.018 6.374 -3.441
28 HH21 ARG 4 1HH2 ARG 4 -4.346 4.800 -6.552
29 HH22 ARG 4 2HH2 ARG 4 -4.080 6.196 -5.618
30 H CYS 5 H CYS 5 -3.490 -2.022 -5.441
31 HA CYS 5 HA CYS 5 -1.621 -2.260 -3.230
32 HB2 CYS 5 2HB CYS 5 -1.902 -4.012 -5.656
33 HB3 CYS 5 1HB CYS 5 -0.690 -4.183 -4.377
34 H LEU 6 H LEU 6 0.344 -1.637 -3.241
35 HA LEU 6 HA LEU 6 1.582 -0.810 -5.738
36 HB2 LEU 6 2HB LEU 6 2.268 1.370 -4.969
37 HB3 LEU 6 1HB LEU 6 0.528 1.264 -4.898
38 HG LEU 6 HG LEU 6 2.291 0.955 -2.458
39 HD11 LEU 6 1HD1 LEU 6 1.718 3.292 -1.956
40 HD12 LEU 6 2HD1 LEU 6 0.955 3.433 -3.541
41 HD13 LEU 6 3HD1 LEU 6 2.689 3.141 -3.420
42 HD21 LEU 6 3HD2 LEU 6 -0.651 1.597 -2.770
43 HD22 LEU 6 1HD2 LEU 6 0.233 1.523 -1.240
44 HD23 LEU 6 2HD2 LEU 6 0.023 0.068 -2.212
45 H CYS 7 H CYS 7 3.802 -0.902 -5.699
46 HA CYS 7 HA CYS 7 4.865 -1.901 -3.192
47 HB2 CYS 7 2HB CYS 7 6.037 -2.320 -5.960
48 HB3 CYS 7 1HB CYS 7 6.665 -2.951 -4.435
49 H ARG 8 H ARG 8 6.528 -0.888 -2.277
50 HA ARG 8 HA ARG 8 7.661 1.461 -3.611
51 HB2 ARG 8 2HB ARG 8 5.867 2.109 -2.095
52 HB3 ARG 8 1HB ARG 8 6.637 1.224 -0.796
53 HG2 ARG 8 2HG ARG 8 8.547 2.714 -0.839
54 HG3 ARG 8 1HG ARG 8 7.840 3.598 -2.189
55 HD2 ARG 8 2HD ARG 8 6.568 3.307 0.526
56 HD3 ARG 8 1HD ARG 8 7.504 4.706 0.000
57 HE ARG 8 HE ARG 8 5.539 4.288 -1.893
58 HH11 ARG 8 1HH1 ARG 8 5.713 5.227 1.521
59 HH12 ARG 8 2HH1 ARG 8 4.246 6.102 1.485
60 HH21 ARG 8 1HH2 ARG 8 3.518 5.519 -1.916
61 HH22 ARG 8 2HH2 ARG 8 2.994 6.250 -0.474
62 H ARG 9 H ARG 9 9.746 1.103 -3.760
63 HA ARG 9 HA ARG 9 11.854 0.460 -3.432
64 HB2 ARG 9 2HB ARG 9 11.518 2.057 -1.492
65 HB3 ARG 9 1HB ARG 9 11.254 0.642 -0.479
66 HG2 ARG 9 2HG ARG 9 13.548 1.503 -0.251
67 HG3 ARG 9 1HG ARG 9 13.526 -0.129 -0.921
68 HD2 ARG 9 2HD ARG 9 15.122 1.314 -2.092
69 HD3 ARG 9 1HD ARG 9 13.844 0.768 -3.170
70 HE ARG 9 HE ARG 9 13.722 3.389 -1.870
71 HH11 ARG 9 1HH1 ARG 9 13.710 1.466 -4.867
72 HH12 ARG 9 2HH1 ARG 9 13.446 2.802 -5.879
73 HH21 ARG 9 1HH2 ARG 9 13.359 5.226 -3.304
74 HH22 ARG 9 2HH2 ARG 9 13.240 4.958 -4.975
75 H GLY 10 H GLY 10 9.999 -1.524 -3.785
76 HA2 GLY 10 2HA GLY 10 10.301 -3.811 -4.061
77 HA3 GLY 10 1HA GLY 10 11.489 -3.759 -2.765
78 H VAL 11 H VAL 11 9.362 -2.169 -1.200
79 HA VAL 11 HA VAL 11 8.248 -4.514 0.056
80 HB VAL 11 HB VAL 11 7.946 -1.584 0.792
81 HG11 VAL 11 1HG1 VAL 11 7.240 -2.399 2.990
82 HG12 VAL 11 2HG1 VAL 11 7.350 -4.059 2.411
83 HG13 VAL 11 3HG1 VAL 11 6.159 -2.961 1.716
84 HG21 VAL 11 3HG2 VAL 11 9.621 -2.015 2.513
85 HG22 VAL 11 1HG2 VAL 11 10.274 -2.280 0.897
86 HG23 VAL 11 2HG2 VAL 11 9.830 -3.657 1.908
87 H CYS 12 H CYS 12 6.379 -5.289 -0.647
88 HA CYS 12 HA CYS 12 4.642 -3.464 -2.073
89 HB2 CYS 12 2HB CYS 12 4.531 -6.469 -1.940
90 HB3 CYS 12 1HB CYS 12 3.441 -5.389 -2.828
91 H ARG 13 H ARG 13 2.843 -2.813 -1.471
92 HA ARG 13 HA ARG 13 1.601 -3.909 0.940
93 HB2 ARG 13 2HB ARG 13 3.110 -2.279 1.815
94 HB3 ARG 13 1HB ARG 13 2.645 -1.109 0.599
95 HG2 ARG 13 2HG ARG 13 0.548 -0.741 1.652
96 HG3 ARG 13 1HG ARG 13 0.782 -2.107 2.744
97 HD2 ARG 13 2HD ARG 13 2.546 0.333 2.636
98 HD3 ARG 13 1HD ARG 13 1.236 0.103 3.798
99 HE ARG 13 HE ARG 13 2.494 -1.992 4.413
100 HH11 ARG 13 1HH1 ARG 13 4.128 0.978 3.399
101 HH12 ARG 13 2HH1 ARG 13 5.613 0.617 4.133
102 HH21 ARG 13 1HH2 ARG 13 4.516 -2.491 5.494
103 HH22 ARG 13 2HH2 ARG 13 5.833 -1.431 5.410
104 H CYS 14 H CYS 14 -0.615 -3.601 1.008
105 HA CYS 14 HA CYS 14 -1.632 -2.145 -1.281
106 HB2 CYS 14 2HB CYS 14 -2.957 -4.440 0.192
107 HB3 CYS 14 1HB CYS 14 -3.621 -3.579 -1.188
108 H ILE 15 H ILE 15 -3.081 -0.558 -0.879
109 HA ILE 15 HA ILE 15 -3.758 0.047 1.902
110 HB ILE 15 HB ILE 15 -4.178 1.668 -0.638
111 HG12 ILE 15 2HG1 ILE 15 -1.801 1.478 -0.107
112 HG13 ILE 15 1HG1 ILE 15 -2.363 3.120 0.176
113 HG21 ILE 15 1HG2 ILE 15 -4.688 3.567 0.840
114 HG22 ILE 15 2HG2 ILE 15 -4.598 2.487 2.235
115 HG23 ILE 15 3HG2 ILE 15 -5.848 2.248 1.014
116 HD11 ILE 15 3HD1 ILE 15 -1.857 1.028 2.291
117 HD12 ILE 15 1HD1 ILE 15 -2.436 2.667 2.583
118 HD13 ILE 15 2HD1 ILE 15 -0.826 2.408 1.914
119 H CYS 16 H CYS 16 -5.548 -0.996 2.536
120 HA CYS 16 HA CYS 16 -7.594 -1.538 0.566
121 HB2 CYS 16 2HB CYS 16 -7.325 -2.540 3.388
122 HB3 CYS 16 1HB CYS 16 -8.575 -3.027 2.251
123 H THR 17 H THR 17 -9.387 -0.651 0.412
124 HA THR 17 HA THR 17 -10.381 1.167 2.470
125 HB THR 17 HB THR 17 -10.102 1.729 -0.495
126 HG1 THR 17 1HG THR 17 -8.631 2.396 1.777
127 HG21 THR 17 3HG2 THR 17 -10.852 3.998 0.091
128 HG22 THR 17 1HG2 THR 17 -11.118 3.485 1.756
129 HG23 THR 17 2HG2 THR 17 -12.091 2.800 0.445
130 H ARG 18 H ARG 18 -12.221 0.123 2.992
131 HA ARG 18 HA ARG 18 -14.372 -0.609 2.909
132 HB2 ARG 18 2HB ARG 18 -14.389 0.084 -0.034
133 HB3 ARG 18 1HB ARG 18 -15.794 -0.196 0.978
134 HG2 ARG 18 2HG ARG 18 -15.272 1.835 2.238
135 HG3 ARG 18 1HG ARG 18 -13.866 2.103 1.209
136 HD2 ARG 18 2HD ARG 18 -16.757 2.058 0.358
137 HD3 ARG 18 1HD ARG 18 -15.695 3.453 0.439
138 HE ARG 18 HE ARG 18 -14.542 1.558 -1.290
139 HH11 ARG 18 1HH1 ARG 18 -17.323 3.762 -1.184
140 HH12 ARG 18 2HH1 ARG 18 -17.425 3.912 -2.876
141 HH21 ARG 18 1HH2 ARG 18 -14.727 1.781 -3.643
142 HH22 ARG 18 2HH2 ARG 18 -15.964 2.771 -4.262
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -12.534 -1.169 2.018
2 HA2 GLY 1 2HA GLY 1 -12.730 -3.502 2.225
3 HA3 GLY 1 1HA GLY 1 -14.277 -3.408 1.389
4 H PHE 2 H PHE 2 -12.163 -1.627 -0.362
5 HA PHE 2 HA PHE 2 -11.643 -3.842 -2.188
6 HB2 PHE 2 2HB PHE 2 -13.103 -2.070 -3.076
7 HB3 PHE 2 1HB PHE 2 -11.877 -0.866 -2.729
8 HD1 PHE 2 1HD PHE 2 -12.412 -4.001 -4.642
9 HD2 PHE 2 2HD PHE 2 -10.397 -0.270 -4.412
10 HE1 PHE 2 1HE PHE 2 -11.505 -4.364 -6.885
11 HE2 PHE 2 2HE PHE 2 -9.473 -0.624 -6.663
12 HZ PHE 2 HZ PHE 2 -10.032 -2.678 -7.905
13 H CYS 3 H CYS 3 -9.609 -4.429 -2.468
14 HA CYS 3 HA CYS 3 -7.587 -2.815 -1.148
15 HB2 CYS 3 2HB CYS 3 -7.485 -5.701 -2.002
16 HB3 CYS 3 1HB CYS 3 -6.274 -4.848 -1.049
17 H ARG 4 H ARG 4 -5.858 -2.033 -2.034
18 HA ARG 4 HA ARG 4 -5.429 -2.486 -4.887
19 HB2 ARG 4 2HB ARG 4 -6.730 -0.399 -4.450
20 HB3 ARG 4 1HB ARG 4 -5.425 0.169 -3.433
21 HG2 ARG 4 2HG ARG 4 -3.957 0.326 -5.337
22 HG3 ARG 4 1HG ARG 4 -5.195 -0.394 -6.376
23 HD2 ARG 4 2HD ARG 4 -6.702 1.469 -5.855
24 HD3 ARG 4 1HD ARG 4 -5.446 2.198 -4.864
25 HE ARG 4 HE ARG 4 -4.210 1.976 -7.196
26 HH11 ARG 4 1HH1 ARG 4 -7.522 3.106 -6.524
27 HH12 ARG 4 2HH1 ARG 4 -7.504 4.293 -7.737
28 HH21 ARG 4 1HH2 ARG 4 -4.202 3.664 -8.826
29 HH22 ARG 4 2HH2 ARG 4 -5.595 4.599 -9.090
30 H CYS 5 H CYS 5 -3.201 -2.664 -5.346
31 HA CYS 5 HA CYS 5 -1.561 -2.562 -2.948
32 HB2 CYS 5 2HB CYS 5 -1.167 -4.260 -5.395
33 HB3 CYS 5 1HB CYS 5 -0.114 -4.229 -3.974
34 H LEU 6 H LEU 6 0.256 -1.544 -2.782
35 HA LEU 6 HA LEU 6 1.248 -0.022 -5.099
36 HB2 LEU 6 2HB LEU 6 0.975 0.964 -2.242
37 HB3 LEU 6 1HB LEU 6 1.876 1.797 -3.478
38 HG LEU 6 HG LEU 6 -0.337 2.040 -4.735
39 HD11 LEU 6 1HD1 LEU 6 -2.381 1.940 -3.424
40 HD12 LEU 6 2HD1 LEU 6 -1.487 1.265 -2.064
41 HD13 LEU 6 3HD1 LEU 6 -1.632 0.351 -3.567
42 HD21 LEU 6 3HD2 LEU 6 -1.024 3.953 -3.372
43 HD22 LEU 6 1HD2 LEU 6 0.725 3.880 -3.594
44 HD23 LEU 6 2HD2 LEU 6 0.009 3.370 -2.064
45 H CYS 7 H CYS 7 3.533 0.237 -5.124
46 HA CYS 7 HA CYS 7 4.849 -1.379 -3.097
47 HB2 CYS 7 2HB CYS 7 5.619 -1.211 -6.009
48 HB3 CYS 7 1HB CYS 7 6.515 -2.065 -4.764
49 H ARG 8 H ARG 8 6.674 -0.642 -2.179
50 HA ARG 8 HA ARG 8 7.724 1.941 -3.059
51 HB2 ARG 8 2HB ARG 8 6.158 2.224 -1.202
52 HB3 ARG 8 1HB ARG 8 7.072 1.075 -0.251
53 HG2 ARG 8 2HG ARG 8 9.000 2.537 -0.228
54 HG3 ARG 8 1HG ARG 8 8.156 3.696 -1.257
55 HD2 ARG 8 2HD ARG 8 6.455 3.983 0.494
56 HD3 ARG 8 1HD ARG 8 7.348 2.859 1.520
57 HE ARG 8 HE ARG 8 9.214 4.674 0.998
58 HH11 ARG 8 1HH1 ARG 8 5.847 5.090 2.056
59 HH12 ARG 8 2HH1 ARG 8 6.138 6.556 2.857
60 HH21 ARG 8 1HH2 ARG 8 9.598 6.679 2.089
61 HH22 ARG 8 2HH2 ARG 8 8.343 7.476 2.920
62 H ARG 9 H ARG 9 9.709 1.432 -3.701
63 HA ARG 9 HA ARG 9 11.870 0.755 -3.746
64 HB2 ARG 9 2HB ARG 9 11.566 0.959 -0.752
65 HB3 ARG 9 1HB ARG 9 13.100 0.836 -1.605
66 HG2 ARG 9 2HG ARG 9 11.107 3.074 -1.949
67 HG3 ARG 9 1HG ARG 9 12.548 3.162 -0.941
68 HD2 ARG 9 2HD ARG 9 12.572 2.619 -3.912
69 HD3 ARG 9 1HD ARG 9 12.828 4.201 -3.194
70 HE ARG 9 HE ARG 9 14.704 2.932 -1.954
71 HH11 ARG 9 1HH1 ARG 9 13.794 2.392 -5.338
72 HH12 ARG 9 2HH1 ARG 9 15.385 2.128 -5.863
73 HH21 ARG 9 1HH2 ARG 9 16.886 2.539 -2.690
74 HH22 ARG 9 2HH2 ARG 9 17.174 2.186 -4.328
75 H GLY 10 H GLY 10 10.150 -1.273 -4.061
76 HA2 GLY 10 2HA GLY 10 10.663 -3.510 -4.513
77 HA3 GLY 10 1HA GLY 10 11.828 -3.459 -3.198
78 H VAL 11 H VAL 11 9.717 -2.156 -1.464
79 HA VAL 11 HA VAL 11 8.599 -4.664 -0.517
80 HB VAL 11 HB VAL 11 8.421 -1.895 0.715
81 HG11 VAL 11 1HG1 VAL 11 7.850 -3.078 2.787
82 HG12 VAL 11 2HG1 VAL 11 7.922 -4.616 1.924
83 HG13 VAL 11 3HG1 VAL 11 6.690 -3.431 1.505
84 HG21 VAL 11 3HG2 VAL 11 10.210 -2.603 2.231
85 HG22 VAL 11 1HG2 VAL 11 10.754 -2.593 0.552
86 HG23 VAL 11 2HG2 VAL 11 10.355 -4.120 1.342
87 H CYS 12 H CYS 12 6.671 -5.222 -1.262
88 HA CYS 12 HA CYS 12 4.930 -3.110 -2.190
89 HB2 CYS 12 2HB CYS 12 4.798 -6.081 -2.660
90 HB3 CYS 12 1HB CYS 12 3.593 -4.897 -3.184
91 H ARG 13 H ARG 13 3.075 -2.635 -1.377
92 HA ARG 13 HA ARG 13 2.168 -4.109 0.999
93 HB2 ARG 13 2HB ARG 13 3.476 -2.135 1.682
94 HB3 ARG 13 1HB ARG 13 2.441 -1.110 0.705
95 HG2 ARG 13 2HG ARG 13 0.541 -1.680 2.120
96 HG3 ARG 13 1HG ARG 13 1.574 -2.724 3.093
97 HD2 ARG 13 2HD ARG 13 2.964 -0.779 3.668
98 HD3 ARG 13 1HD ARG 13 1.881 0.256 2.731
99 HE ARG 13 HE ARG 13 0.536 -1.302 4.692
100 HH11 ARG 13 1HH1 ARG 13 2.363 1.690 4.258
101 HH12 ARG 13 2HH1 ARG 13 1.635 2.495 5.575
102 HH21 ARG 13 1HH2 ARG 13 -0.439 -0.204 6.532
103 HH22 ARG 13 2HH2 ARG 13 -0.002 1.400 6.877
104 H CYS 14 H CYS 14 -0.076 -4.216 1.155
105 HA CYS 14 HA CYS 14 -1.448 -2.890 -1.030
106 HB2 CYS 14 2HB CYS 14 -2.240 -5.446 0.384
107 HB3 CYS 14 1HB CYS 14 -3.165 -4.673 -0.895
108 H ILE 15 H ILE 15 -3.243 -1.685 -0.596
109 HA ILE 15 HA ILE 15 -3.865 -1.279 2.238
110 HB ILE 15 HB ILE 15 -3.823 0.772 -0.017
111 HG12 ILE 15 2HG1 ILE 15 -2.001 0.528 2.393
112 HG13 ILE 15 1HG1 ILE 15 -1.561 0.077 0.753
113 HG21 ILE 15 1HG2 ILE 15 -4.275 2.437 1.737
114 HG22 ILE 15 2HG2 ILE 15 -4.412 1.141 2.921
115 HG23 ILE 15 3HG2 ILE 15 -5.580 1.256 1.600
116 HD11 ILE 15 3HD1 ILE 15 -0.637 2.240 1.366
117 HD12 ILE 15 1HD1 ILE 15 -2.256 2.851 1.709
118 HD13 ILE 15 2HD1 ILE 15 -1.808 2.415 0.059
119 H CYS 16 H CYS 16 -6.014 -1.424 2.708
120 HA CYS 16 HA CYS 16 -7.808 -1.754 0.433
121 HB2 CYS 16 2HB CYS 16 -8.183 -2.792 3.240
122 HB3 CYS 16 1HB CYS 16 -9.216 -3.123 1.849
123 H THR 17 H THR 17 -9.346 -0.471 0.112
124 HA THR 17 HA THR 17 -10.185 1.363 2.229
125 HB THR 17 HB THR 17 -9.640 2.130 -0.662
126 HG1 THR 17 1HG THR 17 -7.963 3.472 0.608
127 HG21 THR 17 3HG2 THR 17 -11.388 3.464 0.467
128 HG22 THR 17 1HG2 THR 17 -9.946 4.422 0.124
129 HG23 THR 17 2HG2 THR 17 -10.243 3.837 1.760
130 H ARG 18 H ARG 18 -12.365 1.276 2.389
131 HA ARG 18 HA ARG 18 -14.582 0.969 1.965
132 HB2 ARG 18 2HB ARG 18 -14.088 2.414 -0.073
133 HB3 ARG 18 1HB ARG 18 -13.842 0.942 -0.984
134 HG2 ARG 18 2HG ARG 18 -16.227 0.335 -0.423
135 HG3 ARG 18 1HG ARG 18 -16.417 1.984 0.174
136 HD2 ARG 18 2HD ARG 18 -17.156 1.943 -2.093
137 HD3 ARG 18 1HD ARG 18 -15.606 2.788 -2.056
138 HE ARG 18 HE ARG 18 -15.782 -0.062 -2.746
139 HH11 ARG 18 1HH1 ARG 18 -14.574 3.192 -3.528
140 HH12 ARG 18 2HH1 ARG 18 -13.899 2.721 -5.005
141 HH21 ARG 18 1HH2 ARG 18 -14.797 -0.697 -4.799
142 HH22 ARG 18 2HH2 ARG 18 -13.995 0.486 -5.731
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -12.130 -2.456 2.156
2 HA2 GLY 1 2HA GLY 1 -12.070 -4.772 1.623
3 HA3 GLY 1 1HA GLY 1 -13.611 -4.583 0.799
4 H PHE 2 H PHE 2 -12.282 -2.022 -0.338
5 HA PHE 2 HA PHE 2 -11.348 -3.279 -2.770
6 HB2 PHE 2 2HB PHE 2 -12.914 -1.383 -2.892
7 HB3 PHE 2 1HB PHE 2 -11.827 -0.376 -1.976
8 HD1 PHE 2 1HD PHE 2 -12.525 -1.876 -5.236
9 HD2 PHE 2 2HD PHE 2 -9.873 0.619 -3.027
10 HE1 PHE 2 1HE PHE 2 -11.567 -1.036 -7.334
11 HE2 PHE 2 2HE PHE 2 -8.910 1.458 -5.126
12 HZ PHE 2 HZ PHE 2 -9.755 0.636 -7.277
13 H CYS 3 H CYS 3 -9.278 -3.833 -2.834
14 HA CYS 3 HA CYS 3 -7.370 -2.243 -1.299
15 HB2 CYS 3 2HB CYS 3 -7.201 -5.109 -2.232
16 HB3 CYS 3 1HB CYS 3 -5.937 -4.232 -1.366
17 H ARG 4 H ARG 4 -5.835 -1.240 -2.285
18 HA ARG 4 HA ARG 4 -5.316 -1.886 -5.104
19 HB2 ARG 4 2HB ARG 4 -6.514 0.377 -4.583
20 HB3 ARG 4 1HB ARG 4 -4.987 0.880 -3.885
21 HG2 ARG 4 2HG ARG 4 -5.259 -0.045 -6.740
22 HG3 ARG 4 1HG ARG 4 -5.433 1.634 -6.252
23 HD2 ARG 4 2HD ARG 4 -3.176 1.738 -5.537
24 HD3 ARG 4 1HD ARG 4 -2.984 -0.011 -5.662
25 HE ARG 4 HE ARG 4 -3.629 0.639 -8.139
26 HH11 ARG 4 1HH1 ARG 4 -1.335 2.296 -6.028
27 HH12 ARG 4 2HH1 ARG 4 -0.155 2.532 -7.225
28 HH21 ARG 4 1HH2 ARG 4 -1.989 0.924 -9.812
29 HH22 ARG 4 2HH2 ARG 4 -0.538 1.744 -9.422
30 H CYS 5 H CYS 5 -3.247 -2.458 -5.451
31 HA CYS 5 HA CYS 5 -1.481 -2.297 -3.154
32 HB2 CYS 5 2HB CYS 5 -1.429 -4.137 -5.529
33 HB3 CYS 5 1HB CYS 5 -0.212 -4.092 -4.250
34 H LEU 6 H LEU 6 0.388 -1.395 -3.169
35 HA LEU 6 HA LEU 6 1.552 -0.547 -5.687
36 HB2 LEU 6 2HB LEU 6 2.056 1.715 -4.883
37 HB3 LEU 6 1HB LEU 6 0.337 1.442 -5.012
38 HG LEU 6 HG LEU 6 1.845 1.383 -2.387
39 HD11 LEU 6 1HD1 LEU 6 0.330 3.633 -3.704
40 HD12 LEU 6 2HD1 LEU 6 2.067 3.575 -3.392
41 HD13 LEU 6 3HD1 LEU 6 0.931 3.637 -2.048
42 HD21 LEU 6 3HD2 LEU 6 -0.332 0.238 -2.339
43 HD22 LEU 6 1HD2 LEU 6 -1.106 1.676 -3.004
44 HD23 LEU 6 2HD2 LEU 6 -0.378 1.726 -1.400
45 H CYS 7 H CYS 7 3.764 -0.503 -5.693
46 HA CYS 7 HA CYS 7 4.889 -1.636 -3.269
47 HB2 CYS 7 2HB CYS 7 5.856 -1.936 -6.116
48 HB3 CYS 7 1HB CYS 7 6.608 -2.666 -4.701
49 H ARG 8 H ARG 8 6.807 -0.874 -2.457
50 HA ARG 8 HA ARG 8 7.989 1.454 -3.735
51 HB2 ARG 8 2HB ARG 8 6.266 2.077 -2.012
52 HB3 ARG 8 1HB ARG 8 7.263 1.264 -0.825
53 HG2 ARG 8 2HG ARG 8 9.110 2.810 -1.362
54 HG3 ARG 8 1HG ARG 8 8.026 3.676 -2.460
55 HD2 ARG 8 2HD ARG 8 7.755 3.344 0.514
56 HD3 ARG 8 1HD ARG 8 8.081 4.837 -0.366
57 HE ARG 8 HE ARG 8 5.594 3.408 -0.893
58 HH11 ARG 8 1HH1 ARG 8 7.146 6.258 0.523
59 HH12 ARG 8 2HH1 ARG 8 5.694 7.065 0.840
60 HH21 ARG 8 1HH2 ARG 8 3.618 4.482 -0.438
61 HH22 ARG 8 2HH2 ARG 8 3.622 6.028 0.278
62 H ARG 9 H ARG 9 10.065 0.955 -3.886
63 HA ARG 9 HA ARG 9 12.061 0.005 -3.644
64 HB2 ARG 9 2HB ARG 9 13.198 0.408 -1.543
65 HB3 ARG 9 1HB ARG 9 12.350 1.827 -2.157
66 HG2 ARG 9 2HG ARG 9 10.510 1.270 -0.499
67 HG3 ARG 9 1HG ARG 9 11.592 0.059 0.175
68 HD2 ARG 9 2HD ARG 9 11.699 2.092 1.470
69 HD3 ARG 9 1HD ARG 9 13.242 1.828 0.648
70 HE ARG 9 HE ARG 9 11.871 3.402 -1.049
71 HH11 ARG 9 1HH1 ARG 9 12.566 3.715 2.406
72 HH12 ARG 9 2HH1 ARG 9 12.663 5.414 2.372
73 HH21 ARG 9 1HH2 ARG 9 11.978 5.764 -1.078
74 HH22 ARG 9 2HH2 ARG 9 12.358 6.585 0.374
75 H GLY 10 H GLY 10 10.343 -1.909 -3.768
76 HA2 GLY 10 2HA GLY 10 10.755 -4.234 -3.830
77 HA3 GLY 10 1HA GLY 10 11.863 -4.010 -2.486
78 H VAL 11 H VAL 11 9.365 -2.394 -1.372
79 HA VAL 11 HA VAL 11 8.181 -4.765 -0.130
80 HB VAL 11 HB VAL 11 8.117 -1.891 0.832
81 HG11 VAL 11 1HG1 VAL 11 7.352 -2.852 2.964
82 HG12 VAL 11 2HG1 VAL 11 7.335 -4.451 2.227
83 HG13 VAL 11 3HG1 VAL 11 6.235 -3.205 1.644
84 HG21 VAL 11 3HG2 VAL 11 9.754 -2.580 2.532
85 HG22 VAL 11 1HG2 VAL 11 10.404 -2.728 0.900
86 HG23 VAL 11 2HG2 VAL 11 9.874 -4.165 1.767
87 H CYS 12 H CYS 12 6.145 -5.232 -0.690
88 HA CYS 12 HA CYS 12 4.713 -3.133 -2.069
89 HB2 CYS 12 2HB CYS 12 4.202 -6.103 -2.151
90 HB3 CYS 12 1HB CYS 12 3.269 -4.827 -2.953
91 H ARG 13 H ARG 13 2.988 -2.307 -1.368
92 HA ARG 13 HA ARG 13 1.833 -3.445 1.082
93 HB2 ARG 13 2HB ARG 13 3.341 -1.452 1.530
94 HB3 ARG 13 1HB ARG 13 2.240 -0.483 0.565
95 HG2 ARG 13 2HG ARG 13 1.741 -0.121 2.882
96 HG3 ARG 13 1HG ARG 13 0.423 -1.066 2.177
97 HD2 ARG 13 2HD ARG 13 1.516 -3.127 3.060
98 HD3 ARG 13 1HD ARG 13 2.709 -2.102 3.846
99 HE ARG 13 HE ARG 13 0.127 -1.310 4.603
100 HH11 ARG 13 1HH1 ARG 13 2.548 -3.812 5.206
101 HH12 ARG 13 2HH1 ARG 13 1.845 -4.356 6.662
102 HH21 ARG 13 1HH2 ARG 13 -0.843 -2.055 6.624
103 HH22 ARG 13 2HH2 ARG 13 -0.111 -3.322 7.488
104 H CYS 14 H CYS 14 -0.424 -3.296 1.152
105 HA CYS 14 HA CYS 14 -1.537 -2.041 -1.212
106 HB2 CYS 14 2HB CYS 14 -2.648 -4.455 0.261
107 HB3 CYS 14 1HB CYS 14 -3.314 -3.745 -1.199
108 H ILE 15 H ILE 15 -3.185 -0.614 -0.851
109 HA ILE 15 HA ILE 15 -3.943 -0.185 1.936
110 HB ILE 15 HB ILE 15 -3.024 1.823 0.868
111 HG12 ILE 15 2HG1 ILE 15 -6.034 2.077 1.187
112 HG13 ILE 15 1HG1 ILE 15 -4.860 2.131 2.491
113 HG21 ILE 15 1HG2 ILE 15 -4.092 2.910 -1.062
114 HG22 ILE 15 2HG2 ILE 15 -5.166 1.521 -1.233
115 HG23 ILE 15 3HG2 ILE 15 -3.427 1.324 -1.461
116 HD11 ILE 15 3HD1 ILE 15 -3.920 4.181 1.549
117 HD12 ILE 15 1HD1 ILE 15 -5.642 4.353 1.898
118 HD13 ILE 15 2HD1 ILE 15 -5.100 4.117 0.238
119 H CYS 16 H CYS 16 -5.989 -0.553 2.577
120 HA CYS 16 HA CYS 16 -7.847 -1.326 0.461
121 HB2 CYS 16 2HB CYS 16 -7.610 -2.533 3.207
122 HB3 CYS 16 1HB CYS 16 -8.785 -2.984 1.987
123 H THR 17 H THR 17 -9.622 -0.324 0.418
124 HA THR 17 HA THR 17 -10.654 1.038 2.786
125 HB THR 17 HB THR 17 -10.728 2.052 -0.084
126 HG1 THR 17 1HG THR 17 -9.060 2.530 2.111
127 HG21 THR 17 3HG2 THR 17 -11.640 4.119 0.907
128 HG22 THR 17 1HG2 THR 17 -11.611 3.372 2.505
129 HG23 THR 17 2HG2 THR 17 -12.685 2.741 1.263
130 H ARG 18 H ARG 18 -12.484 0.076 3.278
131 HA ARG 18 HA ARG 18 -14.353 -1.118 3.291
132 HB2 ARG 18 2HB ARG 18 -16.180 -0.498 1.855
133 HB3 ARG 18 1HB ARG 18 -15.237 0.938 2.204
134 HG2 ARG 18 2HG ARG 18 -14.275 0.883 -0.014
135 HG3 ARG 18 1HG ARG 18 -15.100 -0.636 -0.363
136 HD2 ARG 18 2HD ARG 18 -17.259 0.530 0.010
137 HD3 ARG 18 1HD ARG 18 -16.365 2.034 0.193
138 HE ARG 18 HE ARG 18 -15.627 0.845 -2.221
139 HH11 ARG 18 1HH1 ARG 18 -18.411 2.435 -0.747
140 HH12 ARG 18 2HH1 ARG 18 -19.092 2.937 -2.221
141 HH21 ARG 18 1HH2 ARG 18 -16.562 1.518 -4.240
142 HH22 ARG 18 2HH2 ARG 18 -17.990 2.446 -4.264
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -12.364 -1.101 2.185
2 HA2 GLY 1 2HA GLY 1 -12.752 -3.394 2.195
3 HA3 GLY 1 1HA GLY 1 -14.214 -3.132 1.249
4 H PHE 2 H PHE 2 -12.039 -1.435 -0.361
5 HA PHE 2 HA PHE 2 -11.553 -3.581 -2.279
6 HB2 PHE 2 2HB PHE 2 -12.839 -1.610 -3.029
7 HB3 PHE 2 1HB PHE 2 -11.519 -0.565 -2.534
8 HD1 PHE 2 2HD PHE 2 -12.124 -3.503 -4.742
9 HD2 PHE 2 1HD PHE 2 -10.099 0.189 -4.166
10 HE1 PHE 2 2HE PHE 2 -11.186 -3.664 -7.006
11 HE2 PHE 2 1HE PHE 2 -9.165 0.041 -6.426
12 HZ PHE 2 HZ PHE 2 -9.706 -1.875 -7.852
13 H CYS 3 H CYS 3 -9.498 -4.325 -2.501
14 HA CYS 3 HA CYS 3 -7.464 -2.797 -1.107
15 HB2 CYS 3 2HB CYS 3 -7.442 -5.723 -1.834
16 HB3 CYS 3 1HB CYS 3 -6.218 -4.857 -0.902
17 H ARG 4 H ARG 4 -5.874 -1.945 -2.041
18 HA ARG 4 HA ARG 4 -5.481 -2.344 -4.944
19 HB2 ARG 4 2HB ARG 4 -4.939 0.105 -3.238
20 HB3 ARG 4 1HB ARG 4 -4.820 0.004 -4.990
21 HG2 ARG 4 2HG ARG 4 -7.177 -0.220 -5.224
22 HG3 ARG 4 1HG ARG 4 -7.385 -0.419 -3.488
23 HD2 ARG 4 2HD ARG 4 -8.041 1.811 -4.114
24 HD3 ARG 4 1HD ARG 4 -6.557 1.891 -3.169
25 HE ARG 4 HE ARG 4 -6.032 1.798 -5.955
26 HH11 ARG 4 1HH1 ARG 4 -6.958 3.991 -3.338
27 HH12 ARG 4 2HH1 ARG 4 -6.474 5.399 -4.153
28 HH21 ARG 4 1HH2 ARG 4 -5.374 3.696 -7.065
29 HH22 ARG 4 2HH2 ARG 4 -5.601 5.250 -6.372
30 H CYS 5 H CYS 5 -3.305 -2.772 -5.536
31 HA CYS 5 HA CYS 5 -1.524 -2.940 -3.242
32 HB2 CYS 5 2HB CYS 5 -1.452 -4.590 -5.761
33 HB3 CYS 5 1HB CYS 5 -0.263 -4.636 -4.452
34 H LEU 6 H LEU 6 0.347 -2.018 -3.170
35 HA LEU 6 HA LEU 6 1.429 -0.810 -5.564
36 HB2 LEU 6 2HB LEU 6 1.730 1.390 -4.379
37 HB3 LEU 6 1HB LEU 6 0.087 0.999 -4.817
38 HG LEU 6 HG LEU 6 -0.205 0.258 -2.362
39 HD11 LEU 6 1HD1 LEU 6 1.226 1.325 -0.721
40 HD12 LEU 6 2HD1 LEU 6 2.284 1.913 -2.005
41 HD13 LEU 6 3HD1 LEU 6 2.134 0.181 -1.712
42 HD21 LEU 6 3HD2 LEU 6 0.240 3.163 -3.025
43 HD22 LEU 6 1HD2 LEU 6 -0.663 2.548 -1.639
44 HD23 LEU 6 2HD2 LEU 6 -1.242 2.242 -3.278
45 H CYS 7 H CYS 7 3.647 -0.434 -5.474
46 HA CYS 7 HA CYS 7 4.869 -1.624 -3.117
47 HB2 CYS 7 2HB CYS 7 6.051 -1.531 -5.899
48 HB3 CYS 7 1HB CYS 7 6.720 -2.333 -4.473
49 H ARG 8 H ARG 8 6.374 -0.609 -2.072
50 HA ARG 8 HA ARG 8 7.141 2.105 -2.929
51 HB2 ARG 8 2HB ARG 8 5.318 1.868 -1.100
52 HB3 ARG 8 1HB ARG 8 6.603 1.239 -0.086
53 HG2 ARG 8 2HG ARG 8 6.502 3.461 0.536
54 HG3 ARG 8 1HG ARG 8 7.807 3.458 -0.655
55 HD2 ARG 8 2HD ARG 8 4.925 4.194 -1.212
56 HD3 ARG 8 1HD ARG 8 6.226 5.346 -0.953
57 HE ARG 8 HE ARG 8 7.245 4.500 -2.994
58 HH11 ARG 8 1HH1 ARG 8 3.758 3.855 -2.555
59 HH12 ARG 8 2HH1 ARG 8 3.455 3.743 -4.224
60 HH21 ARG 8 1HH2 ARG 8 6.750 4.368 -5.281
61 HH22 ARG 8 2HH2 ARG 8 5.193 4.007 -5.813
62 H ARG 9 H ARG 9 9.304 1.818 -3.340
63 HA ARG 9 HA ARG 9 11.472 1.285 -3.160
64 HB2 ARG 9 2HB ARG 9 10.750 1.478 -0.261
65 HB3 ARG 9 1HB ARG 9 12.374 1.019 -0.750
66 HG2 ARG 9 2HG ARG 9 12.606 3.125 -1.969
67 HG3 ARG 9 1HG ARG 9 10.968 3.578 -1.494
68 HD2 ARG 9 2HD ARG 9 13.148 2.952 0.481
69 HD3 ARG 9 1HD ARG 9 12.843 4.575 -0.122
70 HE ARG 9 HE ARG 9 10.497 4.161 0.773
71 HH11 ARG 9 1HH1 ARG 9 13.341 2.658 2.312
72 HH12 ARG 9 2HH1 ARG 9 12.693 2.837 3.874
73 HH21 ARG 9 1HH2 ARG 9 9.702 4.404 2.935
74 HH22 ARG 9 2HH2 ARG 9 10.659 3.842 4.246
75 H GLY 10 H GLY 10 9.841 -0.786 -3.759
76 HA2 GLY 10 2HA GLY 10 10.416 -2.987 -4.276
77 HA3 GLY 10 1HA GLY 10 11.550 -2.955 -2.930
78 H VAL 11 H VAL 11 9.310 -1.810 -1.188
79 HA VAL 11 HA VAL 11 8.407 -4.409 -0.354
80 HB VAL 11 HB VAL 11 7.798 -1.680 0.828
81 HG11 VAL 11 1HG1 VAL 11 7.336 -4.439 1.976
82 HG12 VAL 11 2HG1 VAL 11 6.089 -3.303 1.447
83 HG13 VAL 11 3HG1 VAL 11 7.100 -2.919 2.839
84 HG21 VAL 11 3HG2 VAL 11 9.428 -2.278 2.553
85 HG22 VAL 11 1HG2 VAL 11 10.161 -2.203 0.954
86 HG23 VAL 11 2HG2 VAL 11 9.797 -3.768 1.679
87 H CYS 12 H CYS 12 6.635 -5.239 -1.143
88 HA CYS 12 HA CYS 12 4.765 -3.413 -2.344
89 HB2 CYS 12 2HB CYS 12 4.957 -6.394 -2.593
90 HB3 CYS 12 1HB CYS 12 3.742 -5.315 -3.312
91 H ARG 13 H ARG 13 3.018 -2.979 -1.593
92 HA ARG 13 HA ARG 13 2.064 -4.384 0.792
93 HB2 ARG 13 2HB ARG 13 3.436 -2.553 1.535
94 HB3 ARG 13 1HB ARG 13 2.631 -1.450 0.435
95 HG2 ARG 13 2HG ARG 13 0.570 -1.689 1.740
96 HG3 ARG 13 1HG ARG 13 1.423 -2.772 2.850
97 HD2 ARG 13 2HD ARG 13 2.964 -1.038 3.450
98 HD3 ARG 13 1HD ARG 13 2.283 0.047 2.239
99 HE ARG 13 HE ARG 13 0.242 -0.724 3.932
100 HH11 ARG 13 1HH1 ARG 13 3.274 1.123 4.178
101 HH12 ARG 13 2HH1 ARG 13 2.713 2.146 5.417
102 HH21 ARG 13 1HH2 ARG 13 -0.540 0.718 5.614
103 HH22 ARG 13 2HH2 ARG 13 0.487 1.913 6.241
104 H CYS 14 H CYS 14 -0.109 -4.580 0.784
105 HA CYS 14 HA CYS 14 -1.432 -3.094 -1.302
106 HB2 CYS 14 2HB CYS 14 -2.333 -5.655 0.066
107 HB3 CYS 14 1HB CYS 14 -3.213 -4.832 -1.215
108 H ILE 15 H ILE 15 -3.096 -1.784 -0.780
109 HA ILE 15 HA ILE 15 -3.608 -1.438 2.076
110 HB ILE 15 HB ILE 15 -2.315 0.448 1.234
111 HG12 ILE 15 2HG1 ILE 15 -5.218 1.244 1.610
112 HG13 ILE 15 1HG1 ILE 15 -4.048 0.961 2.894
113 HG21 ILE 15 1HG2 ILE 15 -4.438 0.801 -0.879
114 HG22 ILE 15 2HG2 ILE 15 -2.776 0.291 -1.137
115 HG23 ILE 15 3HG2 ILE 15 -3.115 1.926 -0.565
116 HD11 ILE 15 3HD1 ILE 15 -3.908 3.146 0.831
117 HD12 ILE 15 1HD1 ILE 15 -2.738 2.870 2.120
118 HD13 ILE 15 2HD1 ILE 15 -4.394 3.337 2.515
119 H CYS 16 H CYS 16 -5.656 -1.501 2.692
120 HA CYS 16 HA CYS 16 -7.625 -1.771 0.573
121 HB2 CYS 16 2HB CYS 16 -7.803 -2.716 3.425
122 HB3 CYS 16 1HB CYS 16 -8.980 -3.021 2.157
123 H THR 17 H THR 17 -9.064 -0.383 0.321
124 HA THR 17 HA THR 17 -9.815 1.491 2.430
125 HB THR 17 HB THR 17 -9.309 2.231 -0.478
126 HG1 THR 17 1HG THR 17 -7.623 2.115 1.720
127 HG21 THR 17 3HG2 THR 17 -10.945 3.649 0.684
128 HG22 THR 17 1HG2 THR 17 -9.459 4.547 0.377
129 HG23 THR 17 2HG2 THR 17 -9.790 3.927 1.991
130 H ARG 18 H ARG 18 -12.017 1.618 2.499
131 HA ARG 18 HA ARG 18 -14.157 1.130 2.198
132 HB2 ARG 18 2HB ARG 18 -15.237 1.653 0.037
133 HB3 ARG 18 1HB ARG 18 -14.054 2.874 0.457
134 HG2 ARG 18 2HG ARG 18 -12.498 1.911 -1.164
135 HG3 ARG 18 1HG ARG 18 -13.673 0.656 -1.542
136 HD2 ARG 18 2HD ARG 18 -15.224 2.339 -2.335
137 HD3 ARG 18 1HD ARG 18 -14.066 3.612 -1.934
138 HE ARG 18 HE ARG 18 -12.563 2.294 -3.537
139 HH11 ARG 18 1HH1 ARG 18 -16.044 2.738 -3.959
140 HH12 ARG 18 2HH1 ARG 18 -15.996 2.659 -5.654
141 HH21 ARG 18 1HH2 ARG 18 -12.478 2.136 -5.832
142 HH22 ARG 18 2HH2 ARG 18 -13.898 2.268 -6.763
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -12.469 -1.764 2.287
2 HA2 GLY 1 2HA GLY 1 -12.574 -4.089 2.089
3 HA3 GLY 1 1HA GLY 1 -14.128 -3.914 1.289
4 H PHE 2 H PHE 2 -11.881 -1.913 -0.125
5 HA PHE 2 HA PHE 2 -11.377 -3.825 -2.285
6 HB2 PHE 2 2HB PHE 2 -12.948 -2.031 -2.872
7 HB3 PHE 2 1HB PHE 2 -11.808 -0.820 -2.335
8 HD1 PHE 2 2HD PHE 2 -11.892 -3.723 -4.674
9 HD2 PHE 2 1HD PHE 2 -10.692 0.291 -3.987
10 HE1 PHE 2 2HE PHE 2 -11.003 -3.603 -6.955
11 HE2 PHE 2 1HE PHE 2 -9.808 0.424 -6.266
12 HZ PHE 2 HZ PHE 2 -9.957 -1.533 -7.760
13 H CYS 3 H CYS 3 -9.218 -3.987 -2.962
14 HA CYS 3 HA CYS 3 -7.369 -2.407 -1.339
15 HB2 CYS 3 2HB CYS 3 -7.041 -5.243 -2.296
16 HB3 CYS 3 1HB CYS 3 -5.834 -4.316 -1.407
17 H ARG 4 H ARG 4 -5.870 -1.306 -2.267
18 HA ARG 4 HA ARG 4 -5.289 -1.720 -5.130
19 HB2 ARG 4 2HB ARG 4 -5.002 0.765 -3.406
20 HB3 ARG 4 1HB ARG 4 -4.461 0.642 -5.072
21 HG2 ARG 4 2HG ARG 4 -7.316 0.344 -4.170
22 HG3 ARG 4 1HG ARG 4 -6.612 1.821 -4.827
23 HD2 ARG 4 2HD ARG 4 -6.753 -0.827 -6.280
24 HD3 ARG 4 1HD ARG 4 -7.857 0.520 -6.518
25 HE ARG 4 HE ARG 4 -5.573 1.714 -6.978
26 HH11 ARG 4 1HH1 ARG 4 -6.627 -1.474 -8.146
27 HH12 ARG 4 2HH1 ARG 4 -5.844 -1.343 -9.640
28 HH21 ARG 4 1HH2 ARG 4 -4.488 1.886 -9.032
29 HH22 ARG 4 2HH2 ARG 4 -4.592 0.617 -10.160
30 H CYS 5 H CYS 5 -3.298 -2.573 -5.490
31 HA CYS 5 HA CYS 5 -1.548 -2.590 -3.182
32 HB2 CYS 5 2HB CYS 5 -1.511 -4.394 -5.587
33 HB3 CYS 5 1HB CYS 5 -0.412 -4.433 -4.197
34 H LEU 6 H LEU 6 0.300 -1.725 -3.105
35 HA LEU 6 HA LEU 6 1.410 -0.562 -5.560
36 HB2 LEU 6 2HB LEU 6 0.040 1.127 -4.355
37 HB3 LEU 6 1HB LEU 6 1.023 0.881 -2.930
38 HG LEU 6 HG LEU 6 2.984 1.761 -4.189
39 HD11 LEU 6 1HD1 LEU 6 2.250 1.234 -6.447
40 HD12 LEU 6 2HD1 LEU 6 2.603 2.954 -6.284
41 HD13 LEU 6 3HD1 LEU 6 0.930 2.395 -6.301
42 HD21 LEU 6 3HD2 LEU 6 0.579 3.573 -4.056
43 HD22 LEU 6 1HD2 LEU 6 2.259 4.100 -4.144
44 HD23 LEU 6 2HD2 LEU 6 1.682 3.212 -2.731
45 H CYS 7 H CYS 7 3.672 -0.449 -5.513
46 HA CYS 7 HA CYS 7 4.828 -1.664 -3.150
47 HB2 CYS 7 2HB CYS 7 5.862 -1.782 -5.995
48 HB3 CYS 7 1HB CYS 7 6.637 -2.529 -4.601
49 H ARG 8 H ARG 8 6.691 -0.749 -2.310
50 HA ARG 8 HA ARG 8 7.694 1.678 -3.536
51 HB2 ARG 8 2HB ARG 8 5.835 2.172 -1.962
52 HB3 ARG 8 1HB ARG 8 6.778 1.437 -0.689
53 HG2 ARG 8 2HG ARG 8 8.438 3.132 -0.788
54 HG3 ARG 8 1HG ARG 8 7.734 3.809 -2.263
55 HD2 ARG 8 2HD ARG 8 6.349 3.655 0.406
56 HD3 ARG 8 1HD ARG 8 7.138 5.098 -0.247
57 HE ARG 8 HE ARG 8 5.472 4.577 -2.205
58 HH11 ARG 8 1HH1 ARG 8 4.753 4.479 1.263
59 HH12 ARG 8 2HH1 ARG 8 3.131 4.970 1.086
60 HH21 ARG 8 1HH2 ARG 8 3.226 5.296 -2.437
61 HH22 ARG 8 2HH2 ARG 8 2.263 5.449 -1.067
62 H ARG 9 H ARG 9 9.744 1.278 -3.739
63 HA ARG 9 HA ARG 9 11.842 0.569 -3.506
64 HB2 ARG 9 2HB ARG 9 11.318 0.982 -0.570
65 HB3 ARG 9 1HB ARG 9 12.905 0.782 -1.298
66 HG2 ARG 9 2HG ARG 9 12.448 2.831 -2.656
67 HG3 ARG 9 1HG ARG 9 10.984 3.064 -1.696
68 HD2 ARG 9 2HD ARG 9 13.825 3.011 -0.705
69 HD3 ARG 9 1HD ARG 9 12.768 4.414 -0.778
70 HE ARG 9 HE ARG 9 12.478 2.107 1.009
71 HH11 ARG 9 1HH1 ARG 9 11.669 5.483 0.242
72 HH12 ARG 9 2HH1 ARG 9 11.115 5.840 1.805
73 HH21 ARG 9 1HH2 ARG 9 11.733 2.623 3.160
74 HH22 ARG 9 2HH2 ARG 9 11.145 4.178 3.512
75 H GLY 10 H GLY 10 10.080 -1.438 -3.803
76 HA2 GLY 10 2HA GLY 10 10.505 -3.724 -3.992
77 HA3 GLY 10 1HA GLY 10 11.623 -3.579 -2.640
78 H VAL 11 H VAL 11 9.397 -2.028 -1.214
79 HA VAL 11 HA VAL 11 8.255 -4.385 0.016
80 HB VAL 11 HB VAL 11 7.886 -1.453 0.710
81 HG11 VAL 11 1HG1 VAL 11 7.102 -2.264 2.886
82 HG12 VAL 11 2HG1 VAL 11 7.270 -3.926 2.323
83 HG13 VAL 11 3HG1 VAL 11 6.084 -2.860 1.574
84 HG21 VAL 11 3HG2 VAL 11 10.211 -2.092 0.931
85 HG22 VAL 11 1HG2 VAL 11 9.752 -3.494 1.896
86 HG23 VAL 11 2HG2 VAL 11 9.485 -1.869 2.525
87 H CYS 12 H CYS 12 6.438 -5.175 -0.817
88 HA CYS 12 HA CYS 12 4.671 -3.304 -2.149
89 HB2 CYS 12 2HB CYS 12 4.655 -6.317 -2.286
90 HB3 CYS 12 1HB CYS 12 3.512 -5.199 -3.053
91 H ARG 13 H ARG 13 2.877 -2.753 -1.445
92 HA ARG 13 HA ARG 13 1.764 -4.137 0.893
93 HB2 ARG 13 2HB ARG 13 3.250 -2.377 1.742
94 HB3 ARG 13 1HB ARG 13 2.401 -1.186 0.782
95 HG2 ARG 13 2HG ARG 13 0.417 -1.448 2.122
96 HG3 ARG 13 1HG ARG 13 1.164 -2.778 3.019
97 HD2 ARG 13 2HD ARG 13 2.156 0.072 2.943
98 HD3 ARG 13 1HD ARG 13 1.275 -0.672 4.279
99 HE ARG 13 HE ARG 13 3.255 -2.348 4.120
100 HH11 ARG 13 1HH1 ARG 13 3.437 1.184 3.985
101 HH12 ARG 13 2HH1 ARG 13 5.038 1.267 4.546
102 HH21 ARG 13 1HH2 ARG 13 5.474 -2.227 4.892
103 HH22 ARG 13 2HH2 ARG 13 6.217 -0.719 5.055
104 H CYS 14 H CYS 14 -0.464 -4.027 0.991
105 HA CYS 14 HA CYS 14 -1.582 -2.569 -1.252
106 HB2 CYS 14 2HB CYS 14 -2.821 -4.902 0.230
107 HB3 CYS 14 1HB CYS 14 -3.513 -4.086 -1.167
108 H ILE 15 H ILE 15 -3.049 -1.077 -0.985
109 HA ILE 15 HA ILE 15 -3.663 -0.196 1.720
110 HB ILE 15 HB ILE 15 -4.189 1.143 -0.955
111 HG12 ILE 15 2HG1 ILE 15 -1.769 0.922 -0.650
112 HG13 ILE 15 1HG1 ILE 15 -2.251 2.603 -0.482
113 HG21 ILE 15 1HG2 ILE 15 -5.659 1.949 0.798
114 HG22 ILE 15 2HG2 ILE 15 -4.505 3.199 0.341
115 HG23 ILE 15 3HG2 ILE 15 -4.270 2.282 1.834
116 HD11 ILE 15 3HD1 ILE 15 -0.567 2.003 1.157
117 HD12 ILE 15 1HD1 ILE 15 -1.600 0.710 1.771
118 HD13 ILE 15 2HD1 ILE 15 -2.093 2.392 1.952
119 H CYS 16 H CYS 16 -5.460 -1.156 2.438
120 HA CYS 16 HA CYS 16 -7.584 -1.683 0.512
121 HB2 CYS 16 2HB CYS 16 -7.189 -2.829 3.245
122 HB3 CYS 16 1HB CYS 16 -8.487 -3.250 2.136
123 H THR 17 H THR 17 -9.205 -0.536 0.489
124 HA THR 17 HA THR 17 -10.141 0.826 2.842
125 HB THR 17 HB THR 17 -8.716 2.481 1.787
126 HG1 THR 17 1HG THR 17 -10.696 3.840 0.876
127 HG21 THR 17 3HG2 THR 17 -9.041 3.261 -0.525
128 HG22 THR 17 1HG2 THR 17 -10.293 2.038 -0.756
129 HG23 THR 17 2HG2 THR 17 -8.623 1.551 -0.483
130 H ARG 18 H ARG 18 -12.326 0.703 2.956
131 HA ARG 18 HA ARG 18 -14.524 0.329 2.446
132 HB2 ARG 18 2HB ARG 18 -14.014 2.143 0.773
133 HB3 ARG 18 1HB ARG 18 -13.690 0.897 -0.410
134 HG2 ARG 18 2HG ARG 18 -16.083 0.160 -0.125
135 HG3 ARG 18 1HG ARG 18 -16.325 1.611 0.850
136 HD2 ARG 18 2HD ARG 18 -16.983 2.064 -1.440
137 HD3 ARG 18 1HD ARG 18 -15.542 2.999 -1.046
138 HE ARG 18 HE ARG 18 -15.566 0.521 -2.630
139 HH11 ARG 18 1HH1 ARG 18 -13.964 3.602 -1.817
140 HH12 ARG 18 2HH1 ARG 18 -12.964 3.602 -3.193
141 HH21 ARG 18 1HH2 ARG 18 -14.153 0.550 -4.555
142 HH22 ARG 18 2HH2 ARG 18 -13.101 1.880 -4.771
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -12.853 -1.463 1.573
2 HA2 GLY 1 2HA GLY 1 -13.141 -3.776 1.492
3 HA3 GLY 1 1HA GLY 1 -14.577 -3.527 0.505
4 H PHE 2 H PHE 2 -11.973 -1.785 -0.689
5 HA PHE 2 HA PHE 2 -11.348 -3.906 -2.608
6 HB2 PHE 2 2HB PHE 2 -12.624 -2.006 -3.590
7 HB3 PHE 2 1HB PHE 2 -11.376 -0.904 -3.037
8 HD1 PHE 2 2HD PHE 2 -11.969 -3.820 -5.240
9 HD2 PHE 2 1HD PHE 2 -9.524 -0.445 -4.387
10 HE1 PHE 2 2HE PHE 2 -10.763 -4.161 -7.356
11 HE2 PHE 2 1HE PHE 2 -8.322 -0.774 -6.493
12 HZ PHE 2 HZ PHE 2 -8.938 -2.636 -7.986
13 H CYS 3 H CYS 3 -9.235 -4.429 -2.733
14 HA CYS 3 HA CYS 3 -7.520 -2.901 -0.993
15 HB2 CYS 3 2HB CYS 3 -7.267 -5.751 -1.937
16 HB3 CYS 3 1HB CYS 3 -6.065 -4.915 -0.954
17 H ARG 4 H ARG 4 -5.875 -1.859 -1.597
18 HA ARG 4 HA ARG 4 -5.141 -1.869 -4.435
19 HB2 ARG 4 2HB ARG 4 -4.935 0.301 -2.338
20 HB3 ARG 4 1HB ARG 4 -4.414 0.453 -4.001
21 HG2 ARG 4 2HG ARG 4 -6.721 0.221 -4.755
22 HG3 ARG 4 1HG ARG 4 -7.250 0.012 -3.083
23 HD2 ARG 4 2HD ARG 4 -7.618 2.308 -3.819
24 HD3 ARG 4 1HD ARG 4 -6.399 2.239 -2.544
25 HE ARG 4 HE ARG 4 -5.445 2.202 -5.265
26 HH11 ARG 4 1HH1 ARG 4 -6.038 4.152 -2.380
27 HH12 ARG 4 2HH1 ARG 4 -5.010 5.432 -2.843
28 HH21 ARG 4 1HH2 ARG 4 -4.029 3.971 -5.923
29 HH22 ARG 4 2HH2 ARG 4 -3.809 5.308 -4.915
30 H CYS 5 H CYS 5 -2.942 -2.159 -4.840
31 HA CYS 5 HA CYS 5 -1.336 -2.386 -2.448
32 HB2 CYS 5 2HB CYS 5 -1.086 -4.107 -4.908
33 HB3 CYS 5 1HB CYS 5 0.026 -4.031 -3.519
34 H LEU 6 H LEU 6 0.257 -1.274 -2.280
35 HA LEU 6 HA LEU 6 1.154 0.371 -4.543
36 HB2 LEU 6 2HB LEU 6 -0.069 1.563 -2.728
37 HB3 LEU 6 1HB LEU 6 1.084 0.976 -1.567
38 HG LEU 6 HG LEU 6 1.298 3.397 -2.189
39 HD11 LEU 6 1HD1 LEU 6 3.723 3.446 -2.347
40 HD12 LEU 6 2HD1 LEU 6 3.736 1.734 -2.768
41 HD13 LEU 6 3HD1 LEU 6 3.178 2.249 -1.172
42 HD21 LEU 6 3HD2 LEU 6 2.320 4.002 -4.298
43 HD22 LEU 6 1HD2 LEU 6 0.787 3.175 -4.562
44 HD23 LEU 6 2HD2 LEU 6 2.310 2.313 -4.806
45 H CYS 7 H CYS 7 3.207 -0.075 -5.125
46 HA CYS 7 HA CYS 7 4.786 -1.490 -3.156
47 HB2 CYS 7 2HB CYS 7 5.251 -1.394 -6.149
48 HB3 CYS 7 1HB CYS 7 6.178 -2.322 -4.960
49 H ARG 8 H ARG 8 6.643 -0.795 -2.445
50 HA ARG 8 HA ARG 8 7.660 1.773 -3.398
51 HB2 ARG 8 2HB ARG 8 6.005 2.010 -1.492
52 HB3 ARG 8 1HB ARG 8 7.117 1.073 -0.513
53 HG2 ARG 8 2HG ARG 8 7.479 3.344 0.023
54 HG3 ARG 8 1HG ARG 8 8.846 2.843 -0.975
55 HD2 ARG 8 2HD ARG 8 7.752 3.853 -2.946
56 HD3 ARG 8 1HD ARG 8 6.417 4.355 -1.924
57 HE ARG 8 HE ARG 8 9.138 5.267 -1.371
58 HH11 ARG 8 1HH1 ARG 8 5.798 6.040 -2.259
59 HH12 ARG 8 2HH1 ARG 8 5.955 7.696 -1.915
60 HH21 ARG 8 1HH2 ARG 8 9.350 7.555 -0.999
61 HH22 ARG 8 2HH2 ARG 8 7.993 8.589 -1.194
62 H ARG 9 H ARG 9 9.758 1.450 -3.725
63 HA ARG 9 HA ARG 9 11.905 0.728 -3.641
64 HB2 ARG 9 2HB ARG 9 11.267 0.182 -0.740
65 HB3 ARG 9 1HB ARG 9 12.877 0.224 -1.436
66 HG2 ARG 9 2HG ARG 9 12.617 2.574 -1.951
67 HG3 ARG 9 1HG ARG 9 10.969 2.546 -1.323
68 HD2 ARG 9 2HD ARG 9 13.472 1.970 0.249
69 HD3 ARG 9 1HD ARG 9 12.548 3.464 0.321
70 HE ARG 9 HE ARG 9 10.782 1.418 0.879
71 HH11 ARG 9 1HH1 ARG 9 13.697 2.734 2.386
72 HH12 ARG 9 2HH1 ARG 9 13.260 2.240 3.958
73 HH21 ARG 9 1HH2 ARG 9 10.195 0.773 2.992
74 HH22 ARG 9 2HH2 ARG 9 11.197 1.113 4.334
75 H GLY 10 H GLY 10 9.926 -1.203 -4.417
76 HA2 GLY 10 2HA GLY 10 10.120 -3.396 -5.148
77 HA3 GLY 10 1HA GLY 10 11.582 -3.524 -4.193
78 H VAL 11 H VAL 11 9.179 -2.314 -2.245
79 HA VAL 11 HA VAL 11 8.475 -5.001 -1.291
80 HB VAL 11 HB VAL 11 8.554 -2.415 0.305
81 HG11 VAL 11 1HG1 VAL 11 8.213 -5.271 1.203
82 HG12 VAL 11 2HG1 VAL 11 6.967 -4.019 1.180
83 HG13 VAL 11 3HG1 VAL 11 8.350 -3.870 2.267
84 HG21 VAL 11 3HG2 VAL 11 10.563 -3.313 1.418
85 HG22 VAL 11 1HG2 VAL 11 10.823 -3.033 -0.306
86 HG23 VAL 11 2HG2 VAL 11 10.559 -4.671 0.290
87 H CYS 12 H CYS 12 6.306 -5.413 -1.379
88 HA CYS 12 HA CYS 12 4.702 -3.148 -2.157
89 HB2 CYS 12 2HB CYS 12 4.094 -6.074 -2.512
90 HB3 CYS 12 1HB CYS 12 3.055 -4.719 -2.979
91 H ARG 13 H ARG 13 3.127 -2.384 -1.158
92 HA ARG 13 HA ARG 13 2.467 -3.432 1.530
93 HB2 ARG 13 2HB ARG 13 3.889 -1.310 1.264
94 HB3 ARG 13 1HB ARG 13 2.471 -0.575 0.547
95 HG2 ARG 13 2HG ARG 13 2.591 0.130 2.803
96 HG3 ARG 13 1HG ARG 13 1.267 -1.035 2.697
97 HD2 ARG 13 2HD ARG 13 2.587 -2.749 3.680
98 HD3 ARG 13 1HD ARG 13 4.060 -1.784 3.532
99 HE ARG 13 HE ARG 13 1.945 -0.655 5.157
100 HH11 ARG 13 1HH1 ARG 13 4.952 -2.567 5.166
101 HH12 ARG 13 2HH1 ARG 13 5.327 -2.193 6.771
102 HH21 ARG 13 1HH2 ARG 13 2.478 -0.143 7.328
103 HH22 ARG 13 2HH2 ARG 13 3.899 -0.775 8.027
104 H CYS 14 H CYS 14 0.232 -3.882 1.656
105 HA CYS 14 HA CYS 14 -1.337 -2.649 -0.471
106 HB2 CYS 14 2HB CYS 14 -1.900 -5.265 0.950
107 HB3 CYS 14 1HB CYS 14 -2.927 -4.542 -0.282
108 H ILE 15 H ILE 15 -3.135 -1.541 -0.025
109 HA ILE 15 HA ILE 15 -3.927 -1.227 2.796
110 HB ILE 15 HB ILE 15 -3.834 0.915 0.629
111 HG12 ILE 15 2HG1 ILE 15 -2.105 0.655 3.108
112 HG13 ILE 15 1HG1 ILE 15 -1.579 0.283 1.470
113 HG21 ILE 15 1HG2 ILE 15 -4.426 2.490 2.423
114 HG22 ILE 15 2HG2 ILE 15 -4.560 1.144 3.551
115 HG23 ILE 15 3HG2 ILE 15 -5.673 1.262 2.188
116 HD11 ILE 15 3HD1 ILE 15 -2.448 2.987 2.469
117 HD12 ILE 15 1HD1 ILE 15 -1.882 2.619 0.839
118 HD13 ILE 15 2HD1 ILE 15 -0.783 2.469 2.215
119 H CYS 16 H CYS 16 -6.181 -1.385 3.075
120 HA CYS 16 HA CYS 16 -7.627 -1.746 0.579
121 HB2 CYS 16 2HB CYS 16 -8.283 -2.931 3.276
122 HB3 CYS 16 1HB CYS 16 -9.153 -3.213 1.776
123 H THR 17 H THR 17 -9.275 -0.566 0.132
124 HA THR 17 HA THR 17 -10.457 1.048 2.223
125 HB THR 17 HB THR 17 -9.502 2.213 -0.413
126 HG1 THR 17 1HG THR 17 -8.276 1.765 1.986
127 HG21 THR 17 3HG2 THR 17 -10.007 4.365 0.638
128 HG22 THR 17 1HG2 THR 17 -10.523 3.538 2.109
129 HG23 THR 17 2HG2 THR 17 -11.453 3.358 0.625
130 H ARG 18 H ARG 18 -12.599 0.988 2.053
131 HA ARG 18 HA ARG 18 -14.753 0.781 1.337
132 HB2 ARG 18 2HB ARG 18 -13.801 0.821 -1.531
133 HB3 ARG 18 1HB ARG 18 -15.401 1.213 -0.940
134 HG2 ARG 18 2HG ARG 18 -14.480 3.264 0.078
135 HG3 ARG 18 1HG ARG 18 -12.897 2.828 -0.573
136 HD2 ARG 18 2HD ARG 18 -15.387 3.533 -2.091
137 HD3 ARG 18 1HD ARG 18 -13.841 4.372 -2.108
138 HE ARG 18 HE ARG 18 -14.182 1.640 -3.177
139 HH11 ARG 18 1HH1 ARG 18 -12.718 4.850 -3.529
140 HH12 ARG 18 2HH1 ARG 18 -12.208 4.578 -5.129
141 HH21 ARG 18 1HH2 ARG 18 -13.460 1.269 -5.328
142 HH22 ARG 18 2HH2 ARG 18 -12.630 2.503 -6.172
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -12.509 -0.833 2.134
2 HA2 GLY 1 2HA GLY 1 -13.038 -3.090 2.067
3 HA3 GLY 1 1HA GLY 1 -14.463 -2.689 1.120
4 H PHE 2 H PHE 2 -11.958 -1.161 -0.353
5 HA PHE 2 HA PHE 2 -11.694 -3.385 -2.228
6 HB2 PHE 2 2HB PHE 2 -12.809 -1.232 -3.007
7 HB3 PHE 2 1HB PHE 2 -11.252 -0.439 -2.783
8 HD1 PHE 2 2HD PHE 2 -13.092 -2.964 -4.710
9 HD2 PHE 2 1HD PHE 2 -9.508 -0.703 -4.391
10 HE1 PHE 2 2HE PHE 2 -12.461 -3.661 -6.982
11 HE2 PHE 2 1HE PHE 2 -8.866 -1.395 -6.664
12 HZ PHE 2 HZ PHE 2 -10.349 -2.879 -7.962
13 H CYS 3 H CYS 3 -9.684 -4.145 -2.617
14 HA CYS 3 HA CYS 3 -7.516 -2.842 -1.142
15 HB2 CYS 3 2HB CYS 3 -7.747 -5.735 -1.986
16 HB3 CYS 3 1HB CYS 3 -6.443 -5.017 -1.046
17 H ARG 4 H ARG 4 -5.830 -2.143 -2.138
18 HA ARG 4 HA ARG 4 -5.424 -2.795 -4.984
19 HB2 ARG 4 2HB ARG 4 -5.050 -0.137 -3.575
20 HB3 ARG 4 1HB ARG 4 -4.523 -0.470 -5.214
21 HG2 ARG 4 2HG ARG 4 -6.810 -0.775 -5.926
22 HG3 ARG 4 1HG ARG 4 -7.375 -0.578 -4.265
23 HD2 ARG 4 2HD ARG 4 -7.672 1.467 -5.587
24 HD3 ARG 4 1HD ARG 4 -6.572 1.715 -4.236
25 HE ARG 4 HE ARG 4 -5.165 1.016 -6.589
26 HH11 ARG 4 1HH1 ARG 4 -6.914 3.743 -5.178
27 HH12 ARG 4 2HH1 ARG 4 -5.948 4.933 -5.897
28 HH21 ARG 4 1HH2 ARG 4 -3.792 2.669 -7.565
29 HH22 ARG 4 2HH2 ARG 4 -4.132 4.307 -7.294
30 H CYS 5 H CYS 5 -3.179 -2.937 -5.566
31 HA CYS 5 HA CYS 5 -1.508 -3.103 -3.203
32 HB2 CYS 5 2HB CYS 5 -1.276 -4.756 -5.704
33 HB3 CYS 5 1HB CYS 5 -0.171 -4.755 -4.316
34 H LEU 6 H LEU 6 0.241 -2.061 -3.047
35 HA LEU 6 HA LEU 6 1.196 -0.555 -5.382
36 HB2 LEU 6 2HB LEU 6 0.792 0.457 -2.560
37 HB3 LEU 6 1HB LEU 6 1.826 1.264 -3.704
38 HG LEU 6 HG LEU 6 -0.190 2.476 -3.586
39 HD11 LEU 6 1HD1 LEU 6 -1.072 2.398 -5.839
40 HD12 LEU 6 2HD1 LEU 6 -0.228 0.872 -6.104
41 HD13 LEU 6 3HD1 LEU 6 0.688 2.346 -5.785
42 HD21 LEU 6 3HD2 LEU 6 -2.415 1.529 -4.037
43 HD22 LEU 6 1HD2 LEU 6 -1.660 0.826 -2.606
44 HD23 LEU 6 2HD2 LEU 6 -1.696 -0.082 -4.118
45 H CYS 7 H CYS 7 3.424 -0.319 -5.474
46 HA CYS 7 HA CYS 7 4.766 -1.718 -3.340
47 HB2 CYS 7 2HB CYS 7 5.755 -1.429 -6.191
48 HB3 CYS 7 1HB CYS 7 6.625 -2.179 -4.845
49 H ARG 8 H ARG 8 6.270 -0.748 -2.238
50 HA ARG 8 HA ARG 8 6.892 2.014 -2.943
51 HB2 ARG 8 2HB ARG 8 5.130 1.895 -1.246
52 HB3 ARG 8 1HB ARG 8 6.169 0.912 -0.237
53 HG2 ARG 8 2HG ARG 8 7.756 2.776 -0.038
54 HG3 ARG 8 1HG ARG 8 6.700 3.768 -1.045
55 HD2 ARG 8 2HD ARG 8 5.960 2.551 1.616
56 HD3 ARG 8 1HD ARG 8 6.378 4.242 1.343
57 HE ARG 8 HE ARG 8 4.311 3.611 -0.389
58 HH11 ARG 8 1HH1 ARG 8 4.755 3.844 3.110
59 HH12 ARG 8 2HH1 ARG 8 3.140 4.295 3.408
60 HH21 ARG 8 1HH2 ARG 8 2.137 4.177 0.016
61 HH22 ARG 8 2HH2 ARG 8 1.591 4.489 1.608
62 H ARG 9 H ARG 9 8.960 1.804 -3.496
63 HA ARG 9 HA ARG 9 11.196 1.684 -3.270
64 HB2 ARG 9 2HB ARG 9 10.458 1.781 -0.361
65 HB3 ARG 9 1HB ARG 9 12.094 1.994 -0.981
66 HG2 ARG 9 2HG ARG 9 11.474 3.977 -2.151
67 HG3 ARG 9 1HG ARG 9 9.768 3.718 -1.791
68 HD2 ARG 9 2HD ARG 9 10.159 4.109 0.548
69 HD3 ARG 9 1HD ARG 9 11.900 4.225 0.282
70 HE ARG 9 HE ARG 9 10.855 6.079 -1.374
71 HH11 ARG 9 1HH1 ARG 9 10.419 5.573 2.110
72 HH12 ARG 9 2HH1 ARG 9 10.323 7.235 2.464
73 HH21 ARG 9 1HH2 ARG 9 10.698 8.338 -0.864
74 HH22 ARG 9 2HH2 ARG 9 10.479 8.832 0.756
75 H GLY 10 H GLY 10 10.016 -0.738 -3.722
76 HA2 GLY 10 2HA GLY 10 11.107 -2.802 -4.038
77 HA3 GLY 10 1HA GLY 10 12.064 -2.451 -2.609
78 H VAL 11 H VAL 11 9.366 -1.719 -1.263
79 HA VAL 11 HA VAL 11 8.737 -4.499 -0.566
80 HB VAL 11 HB VAL 11 8.057 -1.959 0.950
81 HG11 VAL 11 1HG1 VAL 11 7.501 -3.463 2.814
82 HG12 VAL 11 2HG1 VAL 11 7.826 -4.851 1.779
83 HG13 VAL 11 3HG1 VAL 11 6.487 -3.764 1.402
84 HG21 VAL 11 3HG2 VAL 11 10.465 -2.330 0.943
85 HG22 VAL 11 1HG2 VAL 11 10.222 -3.985 1.504
86 HG23 VAL 11 2HG2 VAL 11 9.791 -2.629 2.546
87 H CYS 12 H CYS 12 6.822 -5.292 -1.277
88 HA CYS 12 HA CYS 12 4.961 -3.328 -2.284
89 HB2 CYS 12 2HB CYS 12 5.004 -6.313 -2.753
90 HB3 CYS 12 1HB CYS 12 3.802 -5.182 -3.383
91 H ARG 13 H ARG 13 3.061 -2.987 -1.552
92 HA ARG 13 HA ARG 13 2.170 -4.434 0.851
93 HB2 ARG 13 2HB ARG 13 3.420 -2.546 1.645
94 HB3 ARG 13 1HB ARG 13 2.640 -1.479 0.496
95 HG2 ARG 13 2HG ARG 13 0.510 -1.791 1.705
96 HG3 ARG 13 1HG ARG 13 1.361 -2.785 2.889
97 HD2 ARG 13 2HD ARG 13 2.789 -0.935 3.484
98 HD3 ARG 13 1HD ARG 13 2.085 0.062 2.217
99 HE ARG 13 HE ARG 13 0.028 -0.779 3.883
100 HH11 ARG 13 1HH1 ARG 13 2.925 1.222 4.162
101 HH12 ARG 13 2HH1 ARG 13 2.261 2.309 5.282
102 HH21 ARG 13 1HH2 ARG 13 -0.883 0.673 5.438
103 HH22 ARG 13 2HH2 ARG 13 0.019 1.976 6.056
104 H CYS 14 H CYS 14 0.016 -4.853 0.709
105 HA CYS 14 HA CYS 14 -1.450 -3.330 -1.278
106 HB2 CYS 14 2HB CYS 14 -2.233 -5.911 0.107
107 HB3 CYS 14 1HB CYS 14 -3.165 -5.113 -1.154
108 H ILE 15 H ILE 15 -3.150 -2.097 -0.768
109 HA ILE 15 HA ILE 15 -3.663 -1.701 2.095
110 HB ILE 15 HB ILE 15 -2.414 0.202 1.216
111 HG12 ILE 15 2HG1 ILE 15 -4.023 2.084 1.585
112 HG13 ILE 15 1HG1 ILE 15 -5.338 0.920 1.559
113 HG21 ILE 15 1HG2 ILE 15 -2.856 -0.054 -1.130
114 HG22 ILE 15 2HG2 ILE 15 -3.216 1.599 -0.623
115 HG23 ILE 15 3HG2 ILE 15 -4.530 0.452 -0.904
116 HD11 ILE 15 3HD1 ILE 15 -4.416 -0.163 3.536
117 HD12 ILE 15 1HD1 ILE 15 -4.749 1.542 3.824
118 HD13 ILE 15 2HD1 ILE 15 -3.092 1.001 3.555
119 H CYS 16 H CYS 16 -5.789 -1.652 2.715
120 HA CYS 16 HA CYS 16 -7.746 -1.864 0.558
121 HB2 CYS 16 2HB CYS 16 -7.955 -2.920 3.360
122 HB3 CYS 16 1HB CYS 16 -9.131 -3.135 2.072
123 H THR 17 H THR 17 -9.077 -0.345 0.391
124 HA THR 17 HA THR 17 -9.854 1.243 2.687
125 HB THR 17 HB THR 17 -8.814 2.375 0.069
126 HG1 THR 17 1HG THR 17 -7.686 1.751 2.390
127 HG21 THR 17 3HG2 THR 17 -9.228 4.593 1.048
128 HG22 THR 17 1HG2 THR 17 -9.895 3.839 2.496
129 HG23 THR 17 2HG2 THR 17 -10.735 3.682 0.958
130 H ARG 18 H ARG 18 -11.985 1.494 2.698
131 HA ARG 18 HA ARG 18 -14.169 1.581 2.106
132 HB2 ARG 18 2HB ARG 18 -13.284 3.195 0.343
133 HB3 ARG 18 1HB ARG 18 -13.214 1.841 -0.769
134 HG2 ARG 18 2HG ARG 18 -15.669 1.586 -0.499
135 HG3 ARG 18 1HG ARG 18 -15.662 3.060 0.478
136 HD2 ARG 18 2HD ARG 18 -16.257 3.615 -1.787
137 HD3 ARG 18 1HD ARG 18 -14.657 4.271 -1.431
138 HE ARG 18 HE ARG 18 -14.625 1.667 -2.630
139 HH11 ARG 18 1HH1 ARG 18 -14.673 5.152 -3.367
140 HH12 ARG 18 2HH1 ARG 18 -14.091 4.958 -4.953
141 HH21 ARG 18 1HH2 ARG 18 -13.823 1.436 -4.849
142 HH22 ARG 18 2HH2 ARG 18 -13.574 2.832 -5.780
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -12.518 -1.732 2.189
2 HA2 GLY 1 2HA GLY 1 -12.524 -4.060 2.129
3 HA3 GLY 1 1HA GLY 1 -13.950 -4.009 1.107
4 H PHE 2 H PHE 2 -12.184 -1.943 -0.520
5 HA PHE 2 HA PHE 2 -11.161 -4.050 -2.239
6 HB2 PHE 2 2HB PHE 2 -12.754 -2.374 -3.162
7 HB3 PHE 2 1HB PHE 2 -11.611 -1.094 -2.816
8 HD1 PHE 2 2HD PHE 2 -12.285 -4.048 -4.889
9 HD2 PHE 2 1HD PHE 2 -9.716 -0.720 -4.255
10 HE1 PHE 2 2HE PHE 2 -11.263 -4.421 -7.096
11 HE2 PHE 2 1HE PHE 2 -8.693 -1.087 -6.456
12 HZ PHE 2 HZ PHE 2 -9.465 -2.939 -7.881
13 H CYS 3 H CYS 3 -9.039 -4.385 -2.409
14 HA CYS 3 HA CYS 3 -7.289 -2.457 -1.089
15 HB2 CYS 3 2HB CYS 3 -6.788 -5.391 -1.601
16 HB3 CYS 3 1HB CYS 3 -5.755 -4.267 -0.725
17 H ARG 4 H ARG 4 -5.848 -1.457 -2.146
18 HA ARG 4 HA ARG 4 -5.166 -2.321 -4.871
19 HB2 ARG 4 2HB ARG 4 -5.276 0.421 -3.640
20 HB3 ARG 4 1HB ARG 4 -4.362 0.108 -5.106
21 HG2 ARG 4 2HG ARG 4 -6.413 -0.662 -6.196
22 HG3 ARG 4 1HG ARG 4 -7.317 -0.280 -4.726
23 HD2 ARG 4 2HD ARG 4 -7.454 1.494 -6.444
24 HD3 ARG 4 1HD ARG 4 -6.750 2.038 -4.921
25 HE ARG 4 HE ARG 4 -4.565 1.852 -6.006
26 HH11 ARG 4 1HH1 ARG 4 -7.312 1.876 -8.238
27 HH12 ARG 4 2HH1 ARG 4 -6.529 2.819 -9.416
28 HH21 ARG 4 1HH2 ARG 4 -3.475 3.091 -7.641
29 HH22 ARG 4 2HH2 ARG 4 -4.301 3.540 -9.073
30 H CYS 5 H CYS 5 -3.064 -2.689 -5.312
31 HA CYS 5 HA CYS 5 -1.351 -2.436 -2.995
32 HB2 CYS 5 2HB CYS 5 -1.026 -4.272 -5.349
33 HB3 CYS 5 1HB CYS 5 0.031 -4.124 -3.933
34 H LEU 6 H LEU 6 0.297 -1.315 -2.909
35 HA LEU 6 HA LEU 6 1.260 0.076 -5.319
36 HB2 LEU 6 2HB LEU 6 1.161 1.072 -2.452
37 HB3 LEU 6 1HB LEU 6 1.998 1.890 -3.742
38 HG LEU 6 HG LEU 6 -0.255 2.222 -4.856
39 HD11 LEU 6 1HD1 LEU 6 -2.251 2.082 -3.452
40 HD12 LEU 6 2HD1 LEU 6 -1.299 1.316 -2.179
41 HD13 LEU 6 3HD1 LEU 6 -1.530 0.496 -3.718
42 HD21 LEU 6 3HD2 LEU 6 -0.872 4.073 -3.380
43 HD22 LEU 6 1HD2 LEU 6 0.869 3.999 -3.664
44 HD23 LEU 6 2HD2 LEU 6 0.197 3.430 -2.138
45 H CYS 7 H CYS 7 3.437 -0.147 -5.635
46 HA CYS 7 HA CYS 7 4.715 -1.640 -3.545
47 HB2 CYS 7 2HB CYS 7 5.646 -1.311 -6.399
48 HB3 CYS 7 1HB CYS 7 6.472 -2.243 -5.140
49 H ARG 8 H ARG 8 6.406 -1.036 -2.415
50 HA ARG 8 HA ARG 8 7.394 1.679 -2.861
51 HB2 ARG 8 2HB ARG 8 5.551 1.607 -1.181
52 HB3 ARG 8 1HB ARG 8 6.534 0.518 -0.213
53 HG2 ARG 8 2HG ARG 8 6.715 2.746 0.685
54 HG3 ARG 8 1HG ARG 8 8.261 2.283 -0.036
55 HD2 ARG 8 2HD ARG 8 7.636 4.587 -0.594
56 HD3 ARG 8 1HD ARG 8 7.744 3.571 -2.030
57 HE ARG 8 HE ARG 8 5.127 3.826 -0.830
58 HH11 ARG 8 1HH1 ARG 8 7.328 4.984 -3.350
59 HH12 ARG 8 2HH1 ARG 8 6.100 5.647 -4.317
60 HH21 ARG 8 1HH2 ARG 8 3.457 4.726 -2.123
61 HH22 ARG 8 2HH2 ARG 8 3.818 5.478 -3.619
62 H ARG 9 H ARG 9 9.437 1.278 -3.321
63 HA ARG 9 HA ARG 9 11.635 0.754 -3.121
64 HB2 ARG 9 2HB ARG 9 10.956 0.707 -0.191
65 HB3 ARG 9 1HB ARG 9 12.578 0.850 -0.864
66 HG2 ARG 9 2HG ARG 9 10.354 2.857 -1.248
67 HG3 ARG 9 1HG ARG 9 11.681 3.018 -0.099
68 HD2 ARG 9 2HD ARG 9 13.282 3.044 -1.915
69 HD3 ARG 9 1HD ARG 9 12.003 2.764 -3.086
70 HE ARG 9 HE ARG 9 11.112 4.990 -2.125
71 HH11 ARG 9 1HH1 ARG 9 14.494 4.181 -2.773
72 HH12 ARG 9 2HH1 ARG 9 15.007 5.775 -2.975
73 HH21 ARG 9 1HH2 ARG 9 11.765 7.186 -2.437
74 HH22 ARG 9 2HH2 ARG 9 13.392 7.562 -2.747
75 H GLY 10 H GLY 10 10.179 -1.373 -3.788
76 HA2 GLY 10 2HA GLY 10 10.955 -3.541 -4.238
77 HA3 GLY 10 1HA GLY 10 11.878 -3.466 -2.739
78 H VAL 11 H VAL 11 9.298 -2.483 -1.384
79 HA VAL 11 HA VAL 11 8.211 -5.197 -1.030
80 HB VAL 11 HB VAL 11 8.090 -2.839 0.880
81 HG11 VAL 11 1HG1 VAL 11 6.146 -4.312 1.102
82 HG12 VAL 11 2HG1 VAL 11 7.194 -4.429 2.510
83 HG13 VAL 11 3HG1 VAL 11 7.214 -5.701 1.293
84 HG21 VAL 11 3HG2 VAL 11 9.714 -5.371 1.017
85 HG22 VAL 11 1HG2 VAL 11 9.623 -4.130 2.264
86 HG23 VAL 11 2HG2 VAL 11 10.335 -3.753 0.695
87 H CYS 12 H CYS 12 6.101 -5.527 -1.581
88 HA CYS 12 HA CYS 12 4.719 -3.122 -2.338
89 HB2 CYS 12 2HB CYS 12 3.919 -5.955 -3.012
90 HB3 CYS 12 1HB CYS 12 3.164 -4.442 -3.554
91 H ARG 13 H ARG 13 3.065 -2.343 -1.434
92 HA ARG 13 HA ARG 13 2.049 -3.719 0.913
93 HB2 ARG 13 2HB ARG 13 2.901 -0.894 0.436
94 HB3 ARG 13 1HB ARG 13 1.758 -1.304 1.702
95 HG2 ARG 13 2HG ARG 13 4.548 -2.437 1.443
96 HG3 ARG 13 1HG ARG 13 4.104 -1.098 2.509
97 HD2 ARG 13 2HD ARG 13 2.573 -2.527 3.715
98 HD3 ARG 13 1HD ARG 13 2.903 -3.868 2.630
99 HE ARG 13 HE ARG 13 5.290 -2.997 3.808
100 HH11 ARG 13 1HH1 ARG 13 2.253 -4.564 4.694
101 HH12 ARG 13 2HH1 ARG 13 2.930 -5.590 5.868
102 HH21 ARG 13 1HH2 ARG 13 6.257 -4.417 5.474
103 HH22 ARG 13 2HH2 ARG 13 5.228 -5.465 6.338
104 H CYS 14 H CYS 14 -0.120 -3.636 1.170
105 HA CYS 14 HA CYS 14 -1.479 -2.373 -1.067
106 HB2 CYS 14 2HB CYS 14 -2.399 -4.816 0.466
107 HB3 CYS 14 1HB CYS 14 -3.162 -4.132 -0.967
108 H ILE 15 H ILE 15 -3.104 -1.065 -0.726
109 HA ILE 15 HA ILE 15 -3.731 -0.362 2.046
110 HB ILE 15 HB ILE 15 -3.980 1.277 -0.508
111 HG12 ILE 15 2HG1 ILE 15 -2.067 1.570 1.823
112 HG13 ILE 15 1HG1 ILE 15 -1.645 0.939 0.236
113 HG21 ILE 15 1HG2 ILE 15 -5.726 1.872 1.118
114 HG22 ILE 15 2HG2 ILE 15 -4.545 3.168 0.947
115 HG23 ILE 15 3HG2 ILE 15 -4.489 2.109 2.355
116 HD11 ILE 15 3HD1 ILE 15 -0.918 3.239 0.507
117 HD12 ILE 15 1HD1 ILE 15 -2.577 3.739 0.838
118 HD13 ILE 15 2HD1 ILE 15 -2.143 3.114 -0.754
119 H CYS 16 H CYS 16 -5.814 -0.655 2.685
120 HA CYS 16 HA CYS 16 -7.679 -1.507 0.597
121 HB2 CYS 16 2HB CYS 16 -7.667 -2.296 3.502
122 HB3 CYS 16 1HB CYS 16 -8.783 -2.876 2.283
123 H THR 17 H THR 17 -9.425 -0.449 0.321
124 HA THR 17 HA THR 17 -10.446 1.288 2.415
125 HB THR 17 HB THR 17 -10.084 2.150 -0.478
126 HG1 THR 17 1HG THR 17 -8.406 2.204 1.649
127 HG21 THR 17 3HG2 THR 17 -10.933 3.695 1.988
128 HG22 THR 17 1HG2 THR 17 -12.007 3.162 0.696
129 HG23 THR 17 2HG2 THR 17 -10.755 4.360 0.368
130 H ARG 18 H ARG 18 -12.525 0.677 2.680
131 HA ARG 18 HA ARG 18 -14.699 0.167 2.225
132 HB2 ARG 18 2HB ARG 18 -14.450 1.980 0.544
133 HB3 ARG 18 1HB ARG 18 -13.886 0.814 -0.619
134 HG2 ARG 18 2HG ARG 18 -16.105 -0.236 -0.609
135 HG3 ARG 18 1HG ARG 18 -16.661 1.009 0.523
136 HD2 ARG 18 2HD ARG 18 -17.185 1.555 -1.839
137 HD3 ARG 18 1HD ARG 18 -16.150 2.752 -1.060
138 HE ARG 18 HE ARG 18 -15.206 0.664 -2.903
139 HH11 ARG 18 1HH1 ARG 18 -14.833 3.928 -1.506
140 HH12 ARG 18 2HH1 ARG 18 -13.580 4.388 -2.546
141 HH21 ARG 18 1HH2 ARG 18 -13.451 1.312 -4.309
142 HH22 ARG 18 2HH2 ARG 18 -12.758 2.861 -4.194
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -12.487 -0.932 1.887
2 HA2 GLY 1 2HA GLY 1 -13.081 -3.078 1.213
3 HA3 GLY 1 1HA GLY 1 -14.419 -2.378 0.309
4 H PHE 2 H PHE 2 -11.866 -0.624 -0.551
5 HA PHE 2 HA PHE 2 -11.520 -2.100 -3.019
6 HB2 PHE 2 2HB PHE 2 -12.037 0.424 -2.952
7 HB3 PHE 2 1HB PHE 2 -10.469 0.613 -2.216
8 HD1 PHE 2 2HD PHE 2 -12.205 -0.299 -5.283
9 HD2 PHE 2 1HD PHE 2 -8.454 0.492 -3.468
10 HE1 PHE 2 2HE PHE 2 -11.175 -0.160 -7.498
11 HE2 PHE 2 1HE PHE 2 -7.411 0.639 -5.681
12 HZ PHE 2 HZ PHE 2 -8.776 0.307 -7.703
13 H CYS 3 H CYS 3 -9.875 -3.514 -2.983
14 HA CYS 3 HA CYS 3 -7.630 -2.937 -1.231
15 HB2 CYS 3 2HB CYS 3 -8.338 -5.514 -2.628
16 HB3 CYS 3 1HB CYS 3 -6.978 -5.235 -1.540
17 H ARG 4 H ARG 4 -5.836 -2.318 -1.939
18 HA ARG 4 HA ARG 4 -5.319 -2.390 -4.830
19 HB2 ARG 4 2HB ARG 4 -6.161 -0.187 -4.090
20 HB3 ARG 4 1HB ARG 4 -4.885 -0.110 -2.896
21 HG2 ARG 4 2HG ARG 4 -4.354 1.296 -4.781
22 HG3 ARG 4 1HG ARG 4 -3.223 -0.051 -4.703
23 HD2 ARG 4 2HD ARG 4 -4.384 -1.184 -6.476
24 HD3 ARG 4 1HD ARG 4 -5.646 0.042 -6.497
25 HE ARG 4 HE ARG 4 -3.452 1.495 -6.929
26 HH11 ARG 4 1HH1 ARG 4 -4.592 -1.457 -8.521
27 HH12 ARG 4 2HH1 ARG 4 -3.948 -1.023 -10.033
28 HH21 ARG 4 1HH2 ARG 4 -2.564 2.057 -8.974
29 HH22 ARG 4 2HH2 ARG 4 -2.766 1.007 -10.308
30 H CYS 5 H CYS 5 -3.315 -3.174 -5.289
31 HA CYS 5 HA CYS 5 -1.490 -3.421 -3.046
32 HB2 CYS 5 2HB CYS 5 -1.462 -4.873 -5.689
33 HB3 CYS 5 1HB CYS 5 -0.215 -4.938 -4.428
34 H LEU 6 H LEU 6 0.240 -2.381 -2.880
35 HA LEU 6 HA LEU 6 1.187 -0.859 -5.208
36 HB2 LEU 6 2HB LEU 6 0.713 0.271 -2.453
37 HB3 LEU 6 1HB LEU 6 1.500 1.117 -3.763
38 HG LEU 6 HG LEU 6 -1.376 0.204 -3.772
39 HD11 LEU 6 1HD1 LEU 6 -0.198 2.944 -3.403
40 HD12 LEU 6 2HD1 LEU 6 -1.018 1.984 -2.170
41 HD13 LEU 6 3HD1 LEU 6 -1.913 2.578 -3.571
42 HD21 LEU 6 3HD2 LEU 6 -0.468 0.284 -6.024
43 HD22 LEU 6 1HD2 LEU 6 0.182 1.896 -5.724
44 HD23 LEU 6 2HD2 LEU 6 -1.562 1.641 -5.777
45 H CYS 7 H CYS 7 3.263 -1.220 -5.490
46 HA CYS 7 HA CYS 7 4.826 -1.856 -3.147
47 HB2 CYS 7 2HB CYS 7 5.592 -2.164 -6.068
48 HB3 CYS 7 1HB CYS 7 6.581 -2.598 -4.676
49 H ARG 8 H ARG 8 6.437 -0.520 -2.534
50 HA ARG 8 HA ARG 8 7.042 1.834 -4.155
51 HB2 ARG 8 2HB ARG 8 5.090 2.196 -2.599
52 HB3 ARG 8 1HB ARG 8 6.197 1.915 -1.276
53 HG2 ARG 8 2HG ARG 8 7.482 3.877 -1.892
54 HG3 ARG 8 1HG ARG 8 6.434 4.137 -3.296
55 HD2 ARG 8 2HD ARG 8 4.500 4.304 -1.748
56 HD3 ARG 8 1HD ARG 8 5.625 4.203 -0.401
57 HE ARG 8 HE ARG 8 6.331 6.281 -2.190
58 HH11 ARG 8 1HH1 ARG 8 4.180 5.513 0.512
59 HH12 ARG 8 2HH1 ARG 8 3.770 7.141 0.819
60 HH21 ARG 8 1HH2 ARG 8 5.831 8.483 -1.730
61 HH22 ARG 8 2HH2 ARG 8 4.773 8.858 -0.438
62 H ARG 9 H ARG 9 9.192 1.812 -4.256
63 HA ARG 9 HA ARG 9 11.399 1.643 -3.773
64 HB2 ARG 9 2HB ARG 9 10.467 2.080 -0.939
65 HB3 ARG 9 1HB ARG 9 12.146 2.090 -1.445
66 HG2 ARG 9 2HG ARG 9 11.689 4.042 -2.866
67 HG3 ARG 9 1HG ARG 9 10.007 4.026 -2.324
68 HD2 ARG 9 2HD ARG 9 12.426 4.348 -0.547
69 HD3 ARG 9 1HD ARG 9 11.356 5.651 -1.060
70 HE ARG 9 HE ARG 9 9.560 4.373 0.113
71 HH11 ARG 9 1HH1 ARG 9 12.934 4.154 1.202
72 HH12 ARG 9 2HH1 ARG 9 12.523 3.727 2.788
73 HH21 ARG 9 1HH2 ARG 9 9.005 3.816 2.300
74 HH22 ARG 9 2HH2 ARG 9 10.226 3.534 3.444
75 H GLY 10 H GLY 10 9.927 -0.784 -3.926
76 HA2 GLY 10 2HA GLY 10 10.738 -2.980 -3.863
77 HA3 GLY 10 1HA GLY 10 11.884 -2.462 -2.641
78 H VAL 11 H VAL 11 9.175 -1.202 -1.529
79 HA VAL 11 HA VAL 11 8.624 -3.468 0.209
80 HB VAL 11 HB VAL 11 7.792 -0.551 0.342
81 HG11 VAL 11 1HG1 VAL 11 7.312 -2.761 2.329
82 HG12 VAL 11 2HG1 VAL 11 6.090 -1.954 1.347
83 HG13 VAL 11 3HG1 VAL 11 6.951 -1.053 2.595
84 HG21 VAL 11 3HG2 VAL 11 9.304 -0.422 2.271
85 HG22 VAL 11 1HG2 VAL 11 10.165 -0.890 0.801
86 HG23 VAL 11 2HG2 VAL 11 9.768 -2.104 2.016
87 H CYS 12 H CYS 12 6.987 -4.773 -0.514
88 HA CYS 12 HA CYS 12 4.901 -3.448 -2.030
89 HB2 CYS 12 2HB CYS 12 5.498 -6.393 -1.829
90 HB3 CYS 12 1HB CYS 12 4.100 -5.629 -2.618
91 H ARG 13 H ARG 13 3.059 -3.104 -1.346
92 HA ARG 13 HA ARG 13 2.127 -4.542 1.028
93 HB2 ARG 13 2HB ARG 13 3.331 -2.585 1.873
94 HB3 ARG 13 1HB ARG 13 2.330 -1.534 0.890
95 HG2 ARG 13 2HG ARG 13 0.377 -2.100 2.196
96 HG3 ARG 13 1HG ARG 13 1.307 -3.272 3.130
97 HD2 ARG 13 2HD ARG 13 1.053 -1.185 4.373
98 HD3 ARG 13 1HD ARG 13 2.742 -1.480 3.964
99 HE ARG 13 HE ARG 13 1.137 0.265 2.247
100 HH11 ARG 13 1HH1 ARG 13 3.819 -0.041 4.572
101 HH12 ARG 13 2HH1 ARG 13 4.418 1.523 4.288
102 HH21 ARG 13 1HH2 ARG 13 1.972 2.357 1.844
103 HH22 ARG 13 2HH2 ARG 13 3.350 2.950 2.655
104 H CYS 14 H CYS 14 0.121 -5.192 0.692
105 HA CYS 14 HA CYS 14 -1.511 -3.656 -1.131
106 HB2 CYS 14 2HB CYS 14 -2.002 -6.400 0.081
107 HB3 CYS 14 1HB CYS 14 -3.041 -5.615 -1.095
108 H ILE 15 H ILE 15 -3.304 -2.616 -0.434
109 HA ILE 15 HA ILE 15 -3.953 -2.845 2.397
110 HB ILE 15 HB ILE 15 -2.418 -0.967 2.198
111 HG12 ILE 15 2HG1 ILE 15 -5.253 0.044 2.551
112 HG13 ILE 15 1HG1 ILE 15 -4.299 -0.758 3.791
113 HG21 ILE 15 1HG2 ILE 15 -2.657 -0.436 -0.138
114 HG22 ILE 15 2HG2 ILE 15 -2.924 1.015 0.830
115 HG23 ILE 15 3HG2 ILE 15 -4.298 0.152 0.132
116 HD11 ILE 15 3HD1 ILE 15 -3.632 1.873 2.500
117 HD12 ILE 15 1HD1 ILE 15 -2.710 1.070 3.770
118 HD13 ILE 15 2HD1 ILE 15 -4.343 1.649 4.102
119 H CYS 16 H CYS 16 -6.094 -2.506 2.869
120 HA CYS 16 HA CYS 16 -7.834 -2.116 0.555
121 HB2 CYS 16 2HB CYS 16 -8.437 -3.603 3.102
122 HB3 CYS 16 1HB CYS 16 -9.527 -3.419 1.740
123 H THR 17 H THR 17 -8.977 -0.457 0.540
124 HA THR 17 HA THR 17 -9.713 0.910 3.013
125 HB THR 17 HB THR 17 -8.497 2.291 0.585
126 HG1 THR 17 1HG THR 17 -7.358 1.052 2.663
127 HG21 THR 17 3HG2 THR 17 -10.092 3.678 1.826
128 HG22 THR 17 1HG2 THR 17 -8.443 4.263 2.048
129 HG23 THR 17 2HG2 THR 17 -9.231 3.332 3.326
130 H ARG 18 H ARG 18 -11.858 1.303 2.929
131 HA ARG 18 HA ARG 18 -14.012 1.542 2.237
132 HB2 ARG 18 2HB ARG 18 -12.813 2.339 -0.426
133 HB3 ARG 18 1HB ARG 18 -14.501 2.510 0.011
134 HG2 ARG 18 2HG ARG 18 -13.885 4.106 1.744
135 HG3 ARG 18 1HG ARG 18 -12.188 3.903 1.309
136 HD2 ARG 18 2HD ARG 18 -14.354 4.890 -0.533
137 HD3 ARG 18 1HD ARG 18 -13.174 5.903 0.297
138 HE ARG 18 HE ARG 18 -11.742 4.009 -1.152
139 HH11 ARG 18 1HH1 ARG 18 -13.967 6.673 -1.873
140 HH12 ARG 18 2HH1 ARG 18 -13.273 7.033 -3.376
141 HH21 ARG 18 1HH2 ARG 18 -10.740 4.550 -3.222
142 HH22 ARG 18 2HH2 ARG 18 -11.398 5.816 -4.152
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