Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | in_dress | stage | position | program | type |
|
|
3548 | 1du9 RC | 4585 | cing | recoord | dress | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H VAL 1 HT1 VAL 1 -9.443 1.620 2.016
2 2H VAL 1 HT2 VAL 1 -9.360 2.333 0.457
3 3H VAL 1 HT3 VAL 1 -9.676 3.309 1.834
4 HA VAL 1 HA VAL 1 -7.496 2.633 2.707
5 HB VAL 1 HB VAL 1 -6.847 1.874 -0.127
6 1HG1 VAL 1 1HG1 VAL 1 -5.457 1.983 2.459
7 2HG1 VAL 1 2HG1 VAL 1 -4.827 2.149 0.820
8 3HG1 VAL 1 3HG1 VAL 1 -5.130 0.546 1.491
9 1HG2 VAL 1 1HG2 VAL 1 -6.981 -0.484 0.493
10 2HG2 VAL 1 2HG2 VAL 1 -8.557 0.295 0.631
11 3HG2 VAL 1 3HG2 VAL 1 -7.609 -0.039 2.080
12 H GLY 2 HN GLY 2 -5.574 3.951 2.117
13 1HA GLY 2 HA2 GLY 2 -6.013 6.001 0.101
14 2HA GLY 2 HA1 GLY 2 -6.000 6.556 1.768
15 H CYS 3 HN CYS 3 -4.182 7.678 0.215
16 HA CYS 3 HA CYS 3 -1.723 6.263 0.020
17 1HB CYS 3 HB2 CYS 3 -2.734 8.719 -0.887
18 2HB CYS 3 HB1 CYS 3 -1.370 9.132 0.147
19 H GLU 4 HN GLU 4 -3.238 8.176 2.503
20 HA GLU 4 HA GLU 4 -0.785 8.201 4.089
21 1HB GLU 4 HB2 GLU 4 -3.444 9.564 4.433
22 2HB GLU 4 HB1 GLU 4 -2.180 9.616 5.654
23 1HG GLU 4 HG2 GLU 4 -0.845 10.996 4.419
24 2HG GLU 4 HG1 GLU 4 -1.494 10.429 2.881
25 H GLU 5 HN GLU 5 -3.113 6.078 3.564
26 HA GLU 5 HA GLU 5 -2.914 4.968 6.263
27 1HB GLU 5 HB2 GLU 5 -5.423 5.435 4.684
28 2HB GLU 5 HB1 GLU 5 -5.341 4.137 5.867
29 1HG GLU 5 HG2 GLU 5 -4.465 6.074 7.422
30 2HG GLU 5 HG1 GLU 5 -5.342 7.077 6.269
31 H CYS 6 HN CYS 6 -1.693 4.436 3.549
32 HA CYS 6 HA CYS 6 -2.736 1.881 2.784
33 1HB CYS 6 HB2 CYS 6 -1.265 3.796 1.483
34 2HB CYS 6 HB1 CYS 6 -0.073 2.537 1.785
35 HA PRO 7 HA PRO 7 1.715 0.648 4.642
36 1HB PRO 7 HB2 PRO 7 1.515 2.662 6.834
37 2HB PRO 7 HB1 PRO 7 2.945 2.048 5.997
38 1HG PRO 7 HG2 PRO 7 1.951 4.470 5.449
39 2HG PRO 7 HG1 PRO 7 2.649 3.446 4.181
40 1HD PRO 7 HD2 PRO 7 -0.204 4.080 4.740
41 2HD PRO 7 HD1 PRO 7 0.588 3.707 3.202
42 H MET 8 HN MET 8 -0.977 1.908 6.572
43 HA MET 8 HA MET 8 -0.742 0.020 8.673
44 1HB MET 8 HB2 MET 8 -2.798 1.987 7.792
45 2HB MET 8 HB1 MET 8 -3.296 0.724 8.908
46 1HG MET 8 HG2 MET 8 -1.322 1.437 10.343
47 2HG MET 8 HG1 MET 8 -1.239 2.865 9.314
48 1HE MET 8 HE1 MET 8 -4.835 1.229 10.287
49 2HE MET 8 HE2 MET 8 -4.794 1.706 11.984
50 3HE MET 8 HE3 MET 8 -3.556 0.627 11.341
51 H HIS 9 HN HIS 9 -2.947 0.201 5.881
52 HA HIS 9 HA HIS 9 -4.341 -2.165 6.374
53 1HB HIS 9 HB2 HIS 9 -3.975 -0.342 4.105
54 2HB HIS 9 HB1 HIS 9 -4.331 -2.000 3.632
55 HD1 HIS 9 HD1 HIS 9 -6.373 -2.815 5.713
56 HD2 HIS 9 HD2 HIS 9 -6.364 0.909 3.873
57 HE1 HIS 9 HE1 HIS 9 -8.728 -1.959 5.918
58 HE2 HIS 9 HE2 HIS 9 -8.718 0.260 4.725
59 H CYS 10 HN CYS 10 -2.103 -1.894 3.631
60 HA CYS 10 HA CYS 10 -1.500 -4.711 3.824
61 1HB CYS 10 HB2 CYS 10 -1.781 -3.241 1.678
62 2HB CYS 10 HB1 CYS 10 -0.090 -2.837 1.955
63 H LYS 11 HN LYS 11 -0.039 -5.426 5.219
64 HA LYS 11 HA LYS 11 2.535 -4.047 5.400
65 1HB LYS 11 HB2 LYS 11 2.477 -4.506 7.917
66 2HB LYS 11 HB1 LYS 11 1.516 -3.160 7.321
67 1HG LYS 11 HG2 LYS 11 -0.462 -4.177 7.791
68 2HG LYS 11 HG1 LYS 11 0.187 -5.800 7.546
69 1HD LYS 11 HD2 LYS 11 0.952 -4.057 9.879
70 2HD LYS 11 HD1 LYS 11 -0.398 -5.192 9.928
71 1HE LYS 11 HE2 LYS 11 1.572 -6.784 8.971
72 2HE LYS 11 HE1 LYS 11 2.502 -5.688 9.992
73 1HZ LYS 11 HZ1 LYS 11 1.922 -7.265 11.505
74 2HZ LYS 11 HZ2 LYS 11 0.460 -7.645 10.744
75 3HZ LYS 11 HZ3 LYS 11 0.587 -6.239 11.675
76 H GLY 12 HN GLY 12 4.017 -5.494 4.854
77 1HA GLY 12 HA2 GLY 12 3.838 -8.192 5.999
78 2HA GLY 12 HA1 GLY 12 4.037 -8.015 4.263
79 H LYS 13 HN LYS 13 6.034 -7.692 3.440
80 HA LYS 13 HA LYS 13 8.194 -6.739 5.060
81 1HB LYS 13 HB2 LYS 13 7.729 -9.447 5.155
82 2HB LYS 13 HB1 LYS 13 8.947 -9.314 3.895
83 1HG LYS 13 HG2 LYS 13 10.157 -9.637 5.865
84 2HG LYS 13 HG1 LYS 13 10.273 -7.904 5.549
85 1HD LYS 13 HD2 LYS 13 8.498 -7.474 7.158
86 2HD LYS 13 HD1 LYS 13 8.317 -9.206 7.443
87 1HE LYS 13 HE2 LYS 13 9.664 -8.650 9.205
88 2HE LYS 13 HE1 LYS 13 10.886 -9.041 7.996
89 1HZ LYS 13 HZ1 LYS 13 9.927 -6.274 8.207
90 2HZ LYS 13 HZ2 LYS 13 11.437 -6.853 7.712
91 3HZ LYS 13 HZ3 LYS 13 11.033 -6.844 9.354
92 H ASN 14 HN ASN 14 7.196 -8.249 2.033
93 HA ASN 14 HA ASN 14 9.084 -6.516 0.642
94 1HB ASN 14 HB2 ASN 14 8.344 -9.376 0.046
95 2HB ASN 14 HB1 ASN 14 9.080 -8.328 -1.163
96 1HD2 ASN 14 1HD2 ASN 14 9.665 -10.532 1.241
97 2HD2 ASN 14 2HD2 ASN 14 11.342 -10.212 1.505
98 H ALA 15 HN ALA 15 6.406 -5.959 1.403
99 HA ALA 15 HA ALA 15 5.110 -5.847 -1.235
100 1HB ALA 15 HB1 ALA 15 3.539 -7.058 -0.151
101 2HB ALA 15 HB2 ALA 15 3.025 -5.465 0.402
102 3HB ALA 15 HB3 ALA 15 4.032 -6.475 1.439
103 H LYS 16 HN LYS 16 5.724 -3.856 -1.945
104 HA LYS 16 HA LYS 16 5.565 -1.575 -0.147
105 1HB LYS 16 HB2 LYS 16 7.511 -1.573 -1.492
106 2HB LYS 16 HB1 LYS 16 6.599 -1.928 -2.952
107 1HG LYS 16 HG2 LYS 16 6.224 0.228 -3.361
108 2HG LYS 16 HG1 LYS 16 5.758 0.550 -1.691
109 1HD LYS 16 HD2 LYS 16 7.925 1.040 -1.044
110 2HD LYS 16 HD1 LYS 16 8.637 0.123 -2.374
111 1HE LYS 16 HE2 LYS 16 7.265 2.016 -3.739
112 2HE LYS 16 HE1 LYS 16 7.691 2.910 -2.280
113 1HZ LYS 16 HZ1 LYS 16 9.502 3.281 -3.616
114 2HZ LYS 16 HZ2 LYS 16 9.455 1.746 -4.324
115 3HZ LYS 16 HZ3 LYS 16 10.031 1.930 -2.745
116 HA PRO 17 HA PRO 17 1.513 -0.547 -1.687
117 1HB PRO 17 HB2 PRO 17 1.133 1.711 -0.298
118 2HB PRO 17 HB1 PRO 17 1.158 0.132 0.499
119 1HG PRO 17 HG2 PRO 17 3.314 2.201 0.324
120 2HG PRO 17 HG1 PRO 17 2.815 1.220 1.714
121 1HD PRO 17 HD2 PRO 17 4.980 0.644 0.121
122 2HD PRO 17 HD1 PRO 17 4.083 -0.567 1.057
123 H THR 18 HN THR 18 0.571 0.836 -3.177
124 HA THR 18 HA THR 18 2.151 3.097 -4.140
125 HB THR 18 HB THR 18 2.628 1.070 -5.537
126 HG1 THR 18 HG1 THR 18 3.011 2.598 -6.902
127 1HG2 THR 18 1HG2 THR 18 -0.176 0.859 -5.545
128 2HG2 THR 18 2HG2 THR 18 1.008 -0.182 -6.334
129 3HG2 THR 18 3HG2 THR 18 0.342 1.208 -7.192
130 H CYS 19 HN CYS 19 0.955 4.701 -5.277
131 HA CYS 19 HA CYS 19 -1.946 4.542 -4.782
132 1HB CYS 19 HB2 CYS 19 0.013 6.776 -4.454
133 2HB CYS 19 HB1 CYS 19 -1.658 7.157 -4.859
134 H ASP 20 HN ASP 20 -3.115 4.409 -6.566
135 HA ASP 20 HA ASP 20 -2.218 5.812 -8.963
136 1HB ASP 20 HB2 ASP 20 -1.994 3.198 -8.871
137 2HB ASP 20 HB1 ASP 20 -3.725 3.244 -9.179
138 H ASP 21 HN ASP 21 -3.621 7.472 -9.084
139 HA ASP 21 HA ASP 21 -5.572 8.649 -9.135
140 1HB ASP 21 HB2 ASP 21 -6.325 6.023 -10.389
141 2HB ASP 21 HB1 ASP 21 -7.525 7.296 -10.190
142 H GLY 22 HN GLY 22 -5.076 7.921 -6.635
143 1HA GLY 22 HA2 GLY 22 -6.075 7.780 -4.592
144 2HA GLY 22 HA1 GLY 22 -7.606 7.898 -5.432
145 H VAL 23 HN VAL 23 -5.592 5.347 -6.478
146 HA VAL 23 HA VAL 23 -7.210 3.432 -4.929
147 HB VAL 23 HB VAL 23 -5.910 2.955 -7.612
148 1HG1 VAL 23 1HG1 VAL 23 -7.109 0.903 -7.664
149 2HG1 VAL 23 2HG1 VAL 23 -8.022 1.326 -6.216
150 3HG1 VAL 23 3HG1 VAL 23 -6.296 0.984 -6.100
151 1HG2 VAL 23 1HG2 VAL 23 -8.857 3.276 -7.149
152 2HG2 VAL 23 2HG2 VAL 23 -7.963 3.324 -8.668
153 3HG2 VAL 23 3HG2 VAL 23 -7.825 4.657 -7.522
154 H CYS 24 HN CYS 24 -5.944 2.875 -3.242
155 HA CYS 24 HA CYS 24 -3.109 2.633 -3.411
156 1HB CYS 24 HB2 CYS 24 -5.088 2.633 -1.355
157 2HB CYS 24 HB1 CYS 24 -4.098 1.191 -1.159
158 H ASN 25 HN ASN 25 -1.829 0.821 -3.536
159 HA ASN 25 HA ASN 25 -2.937 -1.820 -3.534
160 1HB ASN 25 HB2 ASN 25 -2.753 -0.409 -6.012
161 2HB ASN 25 HB1 ASN 25 -1.621 -1.756 -6.028
162 1HD2 ASN 25 1HD2 ASN 25 -4.227 -1.214 -7.410
163 2HD2 ASN 25 2HD2 ASN 25 -5.181 -2.621 -7.100
164 H CYS 26 HN CYS 26 -1.467 -3.110 -2.687
165 HA CYS 26 HA CYS 26 1.338 -2.258 -2.694
166 1HB CYS 26 HB2 CYS 26 1.582 -3.963 -0.861
167 2HB CYS 26 HB1 CYS 26 0.493 -2.632 -0.484
168 H ASN 27 HN ASN 27 2.897 -3.387 -3.700
169 HA ASN 27 HA ASN 27 2.216 -6.038 -4.769
170 1HB ASN 27 HB2 ASN 27 3.514 -3.731 -6.201
171 2HB ASN 27 HB1 ASN 27 3.660 -5.391 -6.773
172 1HD2 ASN 27 1HD2 ASN 27 2.048 -2.649 -7.274
173 2HD2 ASN 27 2HD2 ASN 27 0.543 -3.265 -7.859
174 H VAL 28 HN VAL 28 5.169 -4.197 -5.183
175 HA VAL 28 HA VAL 28 6.565 -5.936 -3.289
176 HB VAL 28 HB VAL 28 7.607 -5.484 -6.085
177 1HG1 VAL 28 1HG1 VAL 28 9.336 -5.834 -4.416
178 2HG1 VAL 28 2HG1 VAL 28 9.213 -7.239 -5.475
179 3HG1 VAL 28 3HG1 VAL 28 8.523 -7.294 -3.853
180 1HG2 VAL 28 1HG2 VAL 28 6.081 -7.795 -4.916
181 2HG2 VAL 28 2HG2 VAL 28 7.127 -7.971 -6.325
182 3HG2 VAL 28 3HG2 VAL 28 5.739 -6.885 -6.387
Start of MODEL 2
1 1H VAL 1 HT1 VAL 1 -8.706 2.651 4.795
2 2H VAL 1 HT2 VAL 1 -8.375 4.079 5.687
3 3H VAL 1 HT3 VAL 1 -7.100 3.241 4.901
4 HA VAL 1 HA VAL 1 -8.204 3.671 2.781
5 HB VAL 1 HB VAL 1 -9.763 5.786 4.238
6 1HG1 VAL 1 1HG1 VAL 1 -11.174 5.199 2.041
7 2HG1 VAL 1 2HG1 VAL 1 -9.567 4.732 1.484
8 3HG1 VAL 1 3HG1 VAL 1 -9.860 6.375 2.055
9 1HG2 VAL 1 1HG2 VAL 1 -10.835 3.070 3.480
10 2HG2 VAL 1 2HG2 VAL 1 -11.729 4.392 4.230
11 3HG2 VAL 1 3HG2 VAL 1 -10.449 3.573 5.125
12 H GLY 2 HN GLY 2 -7.739 5.727 1.621
13 1HA GLY 2 HA2 GLY 2 -6.707 7.863 1.525
14 2HA GLY 2 HA1 GLY 2 -6.059 7.593 3.135
15 H CYS 3 HN CYS 3 -4.733 8.421 0.626
16 HA CYS 3 HA CYS 3 -3.084 6.185 -0.149
17 1HB CYS 3 HB2 CYS 3 -3.561 8.908 -1.084
18 2HB CYS 3 HB1 CYS 3 -1.857 8.470 -1.127
19 H GLU 4 HN GLU 4 -2.931 8.807 2.121
20 HA GLU 4 HA GLU 4 -0.088 8.519 2.560
21 1HB GLU 4 HB2 GLU 4 -1.585 10.667 2.759
22 2HB GLU 4 HB1 GLU 4 -1.876 10.059 4.382
23 1HG GLU 4 HG2 GLU 4 0.266 10.439 5.065
24 2HG GLU 4 HG1 GLU 4 0.933 10.257 3.443
25 H GLU 5 HN GLU 5 -2.562 6.659 3.358
26 HA GLU 5 HA GLU 5 -1.363 5.852 5.914
27 1HB GLU 5 HB2 GLU 5 -4.260 6.055 5.145
28 2HB GLU 5 HB1 GLU 5 -3.739 4.972 6.428
29 1HG GLU 5 HG2 GLU 5 -3.089 7.903 6.410
30 2HG GLU 5 HG1 GLU 5 -4.555 7.247 7.138
31 H CYS 6 HN CYS 6 -0.849 4.936 3.159
32 HA CYS 6 HA CYS 6 -2.043 2.354 2.914
33 1HB CYS 6 HB2 CYS 6 -0.794 4.058 1.163
34 2HB CYS 6 HB1 CYS 6 0.403 2.785 1.380
35 HA PRO 7 HA PRO 7 2.667 1.158 4.043
36 1HB PRO 7 HB2 PRO 7 2.847 3.375 6.037
37 2HB PRO 7 HB1 PRO 7 4.120 2.638 5.058
38 1HG PRO 7 HG2 PRO 7 3.092 5.017 4.413
39 2HG PRO 7 HG1 PRO 7 3.549 3.842 3.166
40 1HD PRO 7 HD2 PRO 7 0.843 4.637 4.111
41 2HD PRO 7 HD1 PRO 7 1.357 4.069 2.515
42 H MET 8 HN MET 8 0.149 2.469 6.105
43 HA MET 8 HA MET 8 0.762 0.576 8.235
44 1HB MET 8 HB2 MET 8 -0.078 3.101 8.409
45 2HB MET 8 HB1 MET 8 -1.651 2.318 8.333
46 1HG MET 8 HG2 MET 8 -1.121 0.986 10.278
47 2HG MET 8 HG1 MET 8 0.505 1.664 10.328
48 1HE MET 8 HE1 MET 8 -2.899 2.392 12.459
49 2HE MET 8 HE2 MET 8 -3.040 1.843 10.789
50 3HE MET 8 HE3 MET 8 -3.483 3.496 11.214
51 H HIS 9 HN HIS 9 -1.596 1.132 5.711
52 HA HIS 9 HA HIS 9 -3.170 -1.170 6.612
53 1HB HIS 9 HB2 HIS 9 -3.775 0.815 4.411
54 2HB HIS 9 HB1 HIS 9 -4.869 -0.415 5.036
55 HD1 HIS 9 HD1 HIS 9 -4.366 0.111 8.077
56 HD2 HIS 9 HD2 HIS 9 -5.140 3.041 5.233
57 HE1 HIS 9 HE1 HIS 9 -5.294 2.065 9.360
58 HE2 HIS 9 HE2 HIS 9 -5.838 3.792 7.608
59 H CYS 10 HN CYS 10 -1.142 -2.419 5.919
60 HA CYS 10 HA CYS 10 -1.726 -3.868 3.593
61 1HB CYS 10 HB2 CYS 10 -0.439 -1.484 2.980
62 2HB CYS 10 HB1 CYS 10 0.858 -2.673 2.967
63 H LYS 11 HN LYS 11 -0.976 -5.833 3.986
64 HA LYS 11 HA LYS 11 1.185 -6.176 5.916
65 1HB LYS 11 HB2 LYS 11 -1.063 -7.437 5.968
66 2HB LYS 11 HB1 LYS 11 -0.401 -8.395 4.651
67 1HG LYS 11 HG2 LYS 11 1.587 -8.360 6.613
68 2HG LYS 11 HG1 LYS 11 0.068 -8.595 7.480
69 1HD LYS 11 HD2 LYS 11 -0.427 -10.378 5.685
70 2HD LYS 11 HD1 LYS 11 1.302 -10.297 5.340
71 1HE LYS 11 HE2 LYS 11 1.042 -12.058 6.885
72 2HE LYS 11 HE1 LYS 11 1.674 -10.699 7.812
73 1HZ LYS 11 HZ1 LYS 11 -0.931 -11.987 7.946
74 2HZ LYS 11 HZ2 LYS 11 -0.926 -10.304 8.117
75 3HZ LYS 11 HZ3 LYS 11 -0.015 -11.263 9.172
76 H GLY 12 HN GLY 12 3.003 -7.539 5.491
77 1HA GLY 12 HA2 GLY 12 3.996 -9.015 3.684
78 2HA GLY 12 HA1 GLY 12 3.660 -7.659 2.618
79 H LYS 13 HN LYS 13 5.876 -9.068 4.741
80 HA LYS 13 HA LYS 13 7.351 -6.894 5.670
81 1HB LYS 13 HB2 LYS 13 8.328 -9.640 4.868
82 2HB LYS 13 HB1 LYS 13 9.249 -8.482 5.819
83 1HG LYS 13 HG2 LYS 13 6.582 -9.094 6.875
84 2HG LYS 13 HG1 LYS 13 7.709 -10.452 6.854
85 1HD LYS 13 HD2 LYS 13 9.078 -9.515 8.406
86 2HD LYS 13 HD1 LYS 13 8.753 -7.870 7.855
87 1HE LYS 13 HE2 LYS 13 7.012 -7.605 9.263
88 2HE LYS 13 HE1 LYS 13 6.463 -9.268 9.061
89 1HZ LYS 13 HZ1 LYS 13 7.184 -9.042 11.282
90 2HZ LYS 13 HZ2 LYS 13 8.626 -8.282 10.830
91 3HZ LYS 13 HZ3 LYS 13 8.394 -9.922 10.491
92 H ASN 14 HN ASN 14 7.055 -8.199 2.511
93 HA ASN 14 HA ASN 14 9.058 -6.311 1.551
94 1HB ASN 14 HB2 ASN 14 8.811 -9.215 0.963
95 2HB ASN 14 HB1 ASN 14 9.260 -8.156 -0.371
96 1HD2 ASN 14 1HD2 ASN 14 11.321 -7.635 -0.584
97 2HD2 ASN 14 2HD2 ASN 14 12.548 -7.866 0.611
98 H ALA 15 HN ALA 15 6.278 -5.916 1.830
99 HA ALA 15 HA ALA 15 5.438 -5.798 -0.985
100 1HB ALA 15 HB1 ALA 15 4.123 -7.256 0.735
101 2HB ALA 15 HB2 ALA 15 3.253 -6.257 -0.428
102 3HB ALA 15 HB3 ALA 15 3.449 -5.705 1.236
103 H LYS 16 HN LYS 16 6.019 -3.767 -1.561
104 HA LYS 16 HA LYS 16 5.591 -1.539 0.232
105 1HB LYS 16 HB2 LYS 16 7.588 -1.428 -1.044
106 2HB LYS 16 HB1 LYS 16 6.737 -1.762 -2.545
107 1HG LYS 16 HG2 LYS 16 6.320 0.394 -2.891
108 2HG LYS 16 HG1 LYS 16 5.734 0.623 -1.243
109 1HD LYS 16 HD2 LYS 16 7.814 1.213 -0.444
110 2HD LYS 16 HD1 LYS 16 8.667 0.344 -1.722
111 1HE LYS 16 HE2 LYS 16 7.435 2.152 -3.231
112 2HE LYS 16 HE1 LYS 16 7.487 3.068 -1.725
113 1HZ LYS 16 HZ1 LYS 16 9.968 2.320 -1.757
114 2HZ LYS 16 HZ2 LYS 16 9.468 3.650 -2.675
115 3HZ LYS 16 HZ3 LYS 16 9.701 2.149 -3.419
116 HA PRO 17 HA PRO 17 1.525 -0.719 -1.385
117 1HB PRO 17 HB2 PRO 17 1.059 1.589 -0.081
118 2HB PRO 17 HB1 PRO 17 1.063 0.027 0.746
119 1HG PRO 17 HG2 PRO 17 3.209 2.109 0.615
120 2HG PRO 17 HG1 PRO 17 2.659 1.156 2.005
121 1HD PRO 17 HD2 PRO 17 4.897 0.554 0.560
122 2HD PRO 17 HD1 PRO 17 3.929 -0.662 1.417
123 H THR 18 HN THR 18 0.616 0.463 -3.009
124 HA THR 18 HA THR 18 2.035 2.827 -3.981
125 HB THR 18 HB THR 18 2.756 0.815 -5.281
126 HG1 THR 18 HG1 THR 18 3.037 2.511 -6.516
127 1HG2 THR 18 1HG2 THR 18 0.711 0.528 -7.095
128 2HG2 THR 18 2HG2 THR 18 -0.093 0.482 -5.528
129 3HG2 THR 18 3HG2 THR 18 1.215 -0.646 -5.880
130 H CYS 19 HN CYS 19 0.759 4.275 -5.239
131 HA CYS 19 HA CYS 19 -2.114 3.983 -4.685
132 1HB CYS 19 HB2 CYS 19 -0.337 6.387 -5.031
133 2HB CYS 19 HB1 CYS 19 -2.086 6.518 -5.185
134 H ASP 20 HN ASP 20 -3.442 3.602 -6.324
135 HA ASP 20 HA ASP 20 -2.652 4.422 -9.014
136 1HB ASP 20 HB2 ASP 20 -2.550 1.877 -8.380
137 2HB ASP 20 HB1 ASP 20 -4.295 1.966 -8.586
138 H ASP 21 HN ASP 21 -3.972 6.120 -9.379
139 HA ASP 21 HA ASP 21 -5.864 7.380 -9.561
140 1HB ASP 21 HB2 ASP 21 -7.190 4.691 -9.979
141 2HB ASP 21 HB1 ASP 21 -7.808 6.255 -10.501
142 H GLY 22 HN GLY 22 -5.229 7.137 -7.001
143 1HA GLY 22 HA2 GLY 22 -6.076 7.439 -4.908
144 2HA GLY 22 HA1 GLY 22 -7.654 7.520 -5.661
145 H VAL 23 HN VAL 23 -5.862 4.672 -6.294
146 HA VAL 23 HA VAL 23 -7.464 3.213 -4.295
147 HB VAL 23 HB VAL 23 -6.527 2.170 -6.968
148 1HG1 VAL 23 1HG1 VAL 23 -8.735 0.848 -5.559
149 2HG1 VAL 23 2HG1 VAL 23 -7.173 0.741 -4.746
150 3HG1 VAL 23 3HG1 VAL 23 -7.348 0.157 -6.401
151 1HG2 VAL 23 1HG2 VAL 23 -9.406 2.515 -6.490
152 2HG2 VAL 23 2HG2 VAL 23 -8.451 2.813 -7.943
153 3HG2 VAL 23 3HG2 VAL 23 -8.488 4.012 -6.650
154 H CYS 24 HN CYS 24 -6.079 2.771 -2.674
155 HA CYS 24 HA CYS 24 -3.303 2.383 -2.962
156 1HB CYS 24 HB2 CYS 24 -5.249 2.343 -0.819
157 2HB CYS 24 HB1 CYS 24 -4.087 1.035 -0.624
158 H ASN 25 HN ASN 25 -2.066 0.579 -3.235
159 HA ASN 25 HA ASN 25 -3.149 -2.061 -3.014
160 1HB ASN 25 HB2 ASN 25 -3.297 -0.739 -5.533
161 2HB ASN 25 HB1 ASN 25 -2.129 -2.048 -5.655
162 1HD2 ASN 25 1HD2 ASN 25 -5.310 -1.261 -5.941
163 2HD2 ASN 25 2HD2 ASN 25 -6.008 -2.833 -5.781
164 H CYS 26 HN CYS 26 -1.585 -3.353 -2.351
165 HA CYS 26 HA CYS 26 1.128 -2.437 -2.247
166 1HB CYS 26 HB2 CYS 26 -0.430 -4.670 -1.130
167 2HB CYS 26 HB1 CYS 26 1.252 -5.057 -1.474
168 H ASN 27 HN ASN 27 2.950 -3.908 -2.925
169 HA ASN 27 HA ASN 27 2.465 -5.653 -5.156
170 1HB ASN 27 HB2 ASN 27 3.341 -2.862 -5.561
171 2HB ASN 27 HB1 ASN 27 4.245 -4.084 -6.451
172 1HD2 ASN 27 1HD2 ASN 27 3.337 -5.050 -8.179
173 2HD2 ASN 27 2HD2 ASN 27 1.759 -4.685 -8.780
174 H VAL 28 HN VAL 28 5.334 -3.705 -4.666
175 HA VAL 28 HA VAL 28 6.691 -5.812 -3.211
176 HB VAL 28 HB VAL 28 7.786 -4.947 -5.888
177 1HG1 VAL 28 1HG1 VAL 28 9.286 -6.929 -5.494
178 2HG1 VAL 28 2HG1 VAL 28 8.668 -6.971 -3.843
179 3HG1 VAL 28 3HG1 VAL 28 9.549 -5.556 -4.420
180 1HG2 VAL 28 1HG2 VAL 28 7.252 -7.267 -6.615
181 2HG2 VAL 28 2HG2 VAL 28 5.829 -6.270 -6.311
182 3HG2 VAL 28 3HG2 VAL 28 6.332 -7.475 -5.125
Start of MODEL 3
1 1H VAL 1 HT1 VAL 1 -10.213 4.426 2.777
2 2H VAL 1 HT2 VAL 1 -9.831 6.092 2.618
3 3H VAL 1 HT3 VAL 1 -9.584 5.292 4.116
4 HA VAL 1 HA VAL 1 -7.773 4.194 3.417
5 HB VAL 1 HB VAL 1 -7.175 3.916 1.025
6 1HG1 VAL 1 1HG1 VAL 1 -8.587 2.282 2.407
7 2HG1 VAL 1 2HG1 VAL 1 -8.580 2.087 0.654
8 3HG1 VAL 1 3HG1 VAL 1 -9.951 2.860 1.450
9 1HG2 VAL 1 1HG2 VAL 1 -9.398 4.257 -0.443
10 2HG2 VAL 1 2HG2 VAL 1 -8.135 5.480 -0.298
11 3HG2 VAL 1 3HG2 VAL 1 -9.587 5.589 0.698
12 H GLY 2 HN GLY 2 -5.679 5.006 2.868
13 1HA GLY 2 HA2 GLY 2 -5.557 7.788 1.961
14 2HA GLY 2 HA1 GLY 2 -4.925 7.424 3.559
15 H CYS 3 HN CYS 3 -3.595 8.424 1.103
16 HA CYS 3 HA CYS 3 -1.908 6.281 0.187
17 1HB CYS 3 HB2 CYS 3 -2.636 8.556 -0.985
18 2HB CYS 3 HB1 CYS 3 -1.156 9.136 -0.229
19 H GLU 4 HN GLU 4 -1.762 8.769 2.626
20 HA GLU 4 HA GLU 4 1.058 8.337 3.128
21 1HB GLU 4 HB2 GLU 4 -1.015 10.095 4.415
22 2HB GLU 4 HB1 GLU 4 0.631 9.972 5.019
23 1HG GLU 4 HG2 GLU 4 0.447 10.540 2.157
24 2HG GLU 4 HG1 GLU 4 -0.242 11.789 3.193
25 H GLU 5 HN GLU 5 -1.530 6.583 3.787
26 HA GLU 5 HA GLU 5 -0.322 5.427 6.177
27 1HB GLU 5 HB2 GLU 5 -3.119 6.483 5.965
28 2HB GLU 5 HB1 GLU 5 -2.775 5.119 7.020
29 1HG GLU 5 HG2 GLU 5 -1.129 6.464 8.224
30 2HG GLU 5 HG1 GLU 5 -1.479 7.832 7.168
31 H CYS 6 HN CYS 6 -0.482 4.658 3.355
32 HA CYS 6 HA CYS 6 -2.365 2.530 3.144
33 1HB CYS 6 HB2 CYS 6 -0.340 3.759 1.431
34 2HB CYS 6 HB1 CYS 6 -0.516 2.024 1.190
35 HA PRO 7 HA PRO 7 1.901 -0.025 3.570
36 1HB PRO 7 HB2 PRO 7 2.938 1.874 5.629
37 2HB PRO 7 HB1 PRO 7 3.824 0.899 4.451
38 1HG PRO 7 HG2 PRO 7 3.450 3.520 4.076
39 2HG PRO 7 HG1 PRO 7 3.419 2.379 2.721
40 1HD PRO 7 HD2 PRO 7 1.170 3.809 4.034
41 2HD PRO 7 HD1 PRO 7 1.322 3.241 2.365
42 H MET 8 HN MET 8 0.129 1.756 6.022
43 HA MET 8 HA MET 8 0.511 -0.225 8.070
44 1HB MET 8 HB2 MET 8 -1.217 2.226 7.829
45 2HB MET 8 HB1 MET 8 -1.367 1.128 9.194
46 1HG MET 8 HG2 MET 8 1.361 2.041 8.572
47 2HG MET 8 HG1 MET 8 0.246 3.272 9.161
48 1HE MET 8 HE1 MET 8 -0.091 -0.443 9.976
49 2HE MET 8 HE2 MET 8 0.730 -0.642 11.524
50 3HE MET 8 HE3 MET 8 1.671 -0.403 10.052
51 H HIS 9 HN HIS 9 -1.854 0.441 5.593
52 HA HIS 9 HA HIS 9 -3.839 -1.344 6.665
53 1HB HIS 9 HB2 HIS 9 -3.555 0.219 4.118
54 2HB HIS 9 HB1 HIS 9 -4.799 -1.017 4.265
55 HD1 HIS 9 HD1 HIS 9 -5.808 -0.516 7.088
56 HD2 HIS 9 HD2 HIS 9 -4.951 2.527 4.391
57 HE1 HIS 9 HE1 HIS 9 -7.149 1.466 7.862
58 HE2 HIS 9 HE2 HIS 9 -6.549 3.319 6.264
59 H CYS 10 HN CYS 10 -2.064 -1.418 3.570
60 HA CYS 10 HA CYS 10 -2.566 -4.177 3.147
61 1HB CYS 10 HB2 CYS 10 -1.522 -2.038 1.652
62 2HB CYS 10 HB1 CYS 10 -0.239 -3.242 1.711
63 H LYS 11 HN LYS 11 -1.517 -5.925 3.842
64 HA LYS 11 HA LYS 11 0.724 -5.610 5.637
65 1HB LYS 11 HB2 LYS 11 0.519 -8.120 5.831
66 2HB LYS 11 HB1 LYS 11 -0.904 -7.206 6.310
67 1HG LYS 11 HG2 LYS 11 -2.167 -8.030 4.635
68 2HG LYS 11 HG1 LYS 11 -0.819 -8.078 3.496
69 1HD LYS 11 HD2 LYS 11 0.062 -10.063 4.653
70 2HD LYS 11 HD1 LYS 11 -1.320 -10.024 5.749
71 1HE LYS 11 HE2 LYS 11 -1.703 -11.654 4.003
72 2HE LYS 11 HE1 LYS 11 -2.826 -10.307 3.823
73 1HZ LYS 11 HZ1 LYS 11 -1.848 -9.624 1.910
74 2HZ LYS 11 HZ2 LYS 11 -1.466 -11.268 1.798
75 3HZ LYS 11 HZ3 LYS 11 -0.307 -10.168 2.350
76 H GLY 12 HN GLY 12 2.661 -7.019 5.427
77 1HA GLY 12 HA2 GLY 12 3.841 -8.446 3.680
78 2HA GLY 12 HA1 GLY 12 3.517 -7.094 2.606
79 H LYS 13 HN LYS 13 5.627 -8.412 4.917
80 HA LYS 13 HA LYS 13 6.932 -6.126 5.876
81 1HB LYS 13 HB2 LYS 13 7.210 -8.474 6.733
82 2HB LYS 13 HB1 LYS 13 8.211 -8.807 5.326
83 1HG LYS 13 HG2 LYS 13 9.835 -8.304 6.827
84 2HG LYS 13 HG1 LYS 13 9.520 -6.685 6.200
85 1HD LYS 13 HD2 LYS 13 7.817 -7.511 8.453
86 2HD LYS 13 HD1 LYS 13 9.531 -7.331 8.833
87 1HE LYS 13 HE2 LYS 13 9.047 -5.161 9.101
88 2HE LYS 13 HE1 LYS 13 9.045 -5.098 7.339
89 1HZ LYS 13 HZ1 LYS 13 6.995 -4.274 7.661
90 2HZ LYS 13 HZ2 LYS 13 6.826 -4.954 9.200
91 3HZ LYS 13 HZ3 LYS 13 6.549 -5.898 7.824
92 H ASN 14 HN ASN 14 7.007 -7.668 2.798
93 HA ASN 14 HA ASN 14 9.047 -5.788 1.917
94 1HB ASN 14 HB2 ASN 14 10.109 -7.415 0.569
95 2HB ASN 14 HB1 ASN 14 9.828 -8.213 2.113
96 1HD2 ASN 14 1HD2 ASN 14 10.286 -9.563 -0.291
97 2HD2 ASN 14 2HD2 ASN 14 8.859 -10.446 -0.700
98 H ALA 15 HN ALA 15 6.232 -5.477 1.913
99 HA ALA 15 HA ALA 15 5.701 -5.462 -0.974
100 1HB ALA 15 HB1 ALA 15 4.290 -6.943 0.771
101 2HB ALA 15 HB2 ALA 15 3.607 -6.261 -0.705
102 3HB ALA 15 HB3 ALA 15 3.376 -5.436 0.837
103 H LYS 16 HN LYS 16 6.103 -3.406 -1.547
104 HA LYS 16 HA LYS 16 5.403 -1.207 0.194
105 1HB LYS 16 HB2 LYS 16 7.451 -0.926 -0.946
106 2HB LYS 16 HB1 LYS 16 6.751 -1.386 -2.490
107 1HG LYS 16 HG2 LYS 16 5.937 0.685 -2.892
108 2HG LYS 16 HG1 LYS 16 5.611 1.007 -1.188
109 1HD LYS 16 HD2 LYS 16 8.456 0.745 -1.864
110 2HD LYS 16 HD1 LYS 16 7.643 2.118 -2.619
111 1HE LYS 16 HE2 LYS 16 6.701 2.290 -0.084
112 2HE LYS 16 HE1 LYS 16 8.308 1.626 0.203
113 1HZ LYS 16 HZ1 LYS 16 7.679 4.112 -1.294
114 2HZ LYS 16 HZ2 LYS 16 9.229 3.460 -1.111
115 3HZ LYS 16 HZ3 LYS 16 8.383 4.017 0.243
116 HA PRO 17 HA PRO 17 1.413 -0.682 -1.719
117 1HB PRO 17 HB2 PRO 17 0.618 1.483 -0.356
118 2HB PRO 17 HB1 PRO 17 0.759 -0.099 0.422
119 1HG PRO 17 HG2 PRO 17 2.649 2.221 0.489
120 2HG PRO 17 HG1 PRO 17 2.137 1.156 1.811
121 1HD PRO 17 HD2 PRO 17 4.506 0.881 0.451
122 2HD PRO 17 HD1 PRO 17 3.669 -0.455 1.264
123 H THR 18 HN THR 18 0.417 0.620 -3.246
124 HA THR 18 HA THR 18 1.827 3.041 -4.090
125 HB THR 18 HB THR 18 2.510 1.081 -5.499
126 HG1 THR 18 HG1 THR 18 1.071 3.142 -6.813
127 1HG2 THR 18 1HG2 THR 18 1.030 -0.276 -6.392
128 2HG2 THR 18 2HG2 THR 18 0.250 1.078 -7.211
129 3HG2 THR 18 3HG2 THR 18 -0.252 0.623 -5.584
130 H CYS 19 HN CYS 19 0.540 4.566 -5.236
131 HA CYS 19 HA CYS 19 -2.340 4.209 -4.740
132 1HB CYS 19 HB2 CYS 19 -0.541 6.597 -4.648
133 2HB CYS 19 HB1 CYS 19 -2.246 6.821 -5.021
134 H ASP 20 HN ASP 20 -3.531 3.847 -6.480
135 HA ASP 20 HA ASP 20 -2.795 5.128 -8.997
136 1HB ASP 20 HB2 ASP 20 -2.370 2.552 -8.718
137 2HB ASP 20 HB1 ASP 20 -4.106 2.447 -8.984
138 H ASP 21 HN ASP 21 -4.322 6.674 -9.174
139 HA ASP 21 HA ASP 21 -6.360 7.692 -9.258
140 1HB ASP 21 HB2 ASP 21 -6.791 4.987 -10.428
141 2HB ASP 21 HB1 ASP 21 -8.218 5.960 -10.086
142 H GLY 22 HN GLY 22 -5.763 7.184 -6.729
143 1HA GLY 22 HA2 GLY 22 -6.699 7.090 -4.654
144 2HA GLY 22 HA1 GLY 22 -8.252 7.056 -5.459
145 H VAL 23 HN VAL 23 -6.106 4.581 -6.411
146 HA VAL 23 HA VAL 23 -7.525 2.668 -4.675
147 HB VAL 23 HB VAL 23 -6.373 2.119 -7.412
148 1HG1 VAL 23 1HG1 VAL 23 -8.251 0.450 -5.746
149 2HG1 VAL 23 2HG1 VAL 23 -6.507 0.199 -5.827
150 3HG1 VAL 23 3HG1 VAL 23 -7.495 0.005 -7.276
151 1HG2 VAL 23 1HG2 VAL 23 -8.935 1.865 -7.896
152 2HG2 VAL 23 2HG2 VAL 23 -8.166 3.451 -7.956
153 3HG2 VAL 23 3HG2 VAL 23 -9.092 2.973 -6.533
154 H CYS 24 HN CYS 24 -6.136 2.222 -3.058
155 HA CYS 24 HA CYS 24 -3.304 2.166 -3.392
156 1HB CYS 24 HB2 CYS 24 -4.589 2.684 -1.249
157 2HB CYS 24 HB1 CYS 24 -4.836 0.948 -1.096
158 H ASN 25 HN ASN 25 -1.903 0.389 -3.349
159 HA ASN 25 HA ASN 25 -2.903 -2.295 -3.323
160 1HB ASN 25 HB2 ASN 25 -2.693 -0.929 -5.825
161 2HB ASN 25 HB1 ASN 25 -1.510 -2.230 -5.775
162 1HD2 ASN 25 1HD2 ASN 25 -4.905 -1.434 -5.560
163 2HD2 ASN 25 2HD2 ASN 25 -5.497 -3.020 -5.904
164 H CYS 26 HN CYS 26 -1.412 -3.504 -2.399
165 HA CYS 26 HA CYS 26 1.349 -2.533 -2.313
166 1HB CYS 26 HB2 CYS 26 1.603 -4.206 -0.460
167 2HB CYS 26 HB1 CYS 26 0.423 -2.940 -0.139
168 H ASN 27 HN ASN 27 3.104 -3.819 -2.864
169 HA ASN 27 HA ASN 27 2.619 -6.456 -3.984
170 1HB ASN 27 HB2 ASN 27 3.653 -4.125 -5.583
171 2HB ASN 27 HB1 ASN 27 3.952 -5.796 -6.055
172 1HD2 ASN 27 1HD2 ASN 27 1.847 -3.198 -6.247
173 2HD2 ASN 27 2HD2 ASN 27 0.487 -4.017 -6.930
174 H VAL 28 HN VAL 28 5.333 -4.300 -4.522
175 HA VAL 28 HA VAL 28 6.944 -5.646 -2.513
176 HB VAL 28 HB VAL 28 7.853 -5.646 -5.391
177 1HG1 VAL 28 1HG1 VAL 28 9.007 -6.670 -2.820
178 2HG1 VAL 28 2HG1 VAL 28 9.752 -5.631 -4.035
179 3HG1 VAL 28 3HG1 VAL 28 9.492 -7.342 -4.377
180 1HG2 VAL 28 1HG2 VAL 28 6.586 -7.826 -3.748
181 2HG2 VAL 28 2HG2 VAL 28 7.549 -8.147 -5.191
182 3HG2 VAL 28 3HG2 VAL 28 6.068 -7.198 -5.313
Start of MODEL 4
1 1H VAL 1 HT1 VAL 1 -8.699 0.795 1.190
2 2H VAL 1 HT2 VAL 1 -7.595 1.317 2.396
3 3H VAL 1 HT3 VAL 1 -7.175 1.434 0.736
4 HA VAL 1 HA VAL 1 -8.664 3.112 0.341
5 HB VAL 1 HB VAL 1 -10.229 3.910 2.130
6 1HG1 VAL 1 1HG1 VAL 1 -11.895 2.623 1.304
7 2HG1 VAL 1 2HG1 VAL 1 -11.044 1.115 1.637
8 3HG1 VAL 1 3HG1 VAL 1 -10.621 2.070 0.216
9 1HG2 VAL 1 1HG2 VAL 1 -10.511 2.848 4.119
10 2HG2 VAL 1 2HG2 VAL 1 -8.816 2.442 3.849
11 3HG2 VAL 1 3HG2 VAL 1 -10.076 1.269 3.465
12 H GLY 2 HN GLY 2 -7.979 5.183 0.594
13 1HA GLY 2 HA2 GLY 2 -7.020 7.027 1.661
14 2HA GLY 2 HA1 GLY 2 -6.687 6.016 3.059
15 H CYS 3 HN CYS 3 -5.318 7.646 0.517
16 HA CYS 3 HA CYS 3 -3.163 5.918 -0.150
17 1HB CYS 3 HB2 CYS 3 -3.991 7.895 -1.505
18 2HB CYS 3 HB1 CYS 3 -3.167 8.931 -0.346
19 H GLU 4 HN GLU 4 -3.652 8.389 2.294
20 HA GLU 4 HA GLU 4 -0.899 8.249 3.180
21 1HB GLU 4 HB2 GLU 4 -3.300 9.809 4.079
22 2HB GLU 4 HB1 GLU 4 -1.804 9.811 5.002
23 1HG GLU 4 HG2 GLU 4 -0.843 10.412 2.566
24 2HG GLU 4 HG1 GLU 4 -2.456 11.111 2.442
25 H GLU 5 HN GLU 5 -3.356 6.234 3.518
26 HA GLU 5 HA GLU 5 -2.502 5.376 6.190
27 1HB GLU 5 HB2 GLU 5 -5.301 5.474 5.081
28 2HB GLU 5 HB1 GLU 5 -4.871 4.496 6.477
29 1HG GLU 5 HG2 GLU 5 -3.999 7.279 6.659
30 2HG GLU 5 HG1 GLU 5 -5.747 7.072 6.561
31 H CYS 6 HN CYS 6 -1.682 4.568 3.458
32 HA CYS 6 HA CYS 6 -2.792 1.974 3.017
33 1HB CYS 6 HB2 CYS 6 -1.345 3.771 1.482
34 2HB CYS 6 HB1 CYS 6 -0.235 2.426 1.726
35 HA PRO 7 HA PRO 7 1.809 0.812 4.550
36 1HB PRO 7 HB2 PRO 7 1.784 2.992 6.593
37 2HB PRO 7 HB1 PRO 7 3.148 2.288 5.716
38 1HG PRO 7 HG2 PRO 7 2.147 4.669 5.028
39 2HG PRO 7 HG1 PRO 7 2.734 3.526 3.806
40 1HD PRO 7 HD2 PRO 7 -0.057 4.269 4.509
41 2HD PRO 7 HD1 PRO 7 0.609 3.731 2.961
42 H MET 8 HN MET 8 -0.894 2.059 6.410
43 HA MET 8 HA MET 8 -0.448 0.417 8.705
44 1HB MET 8 HB2 MET 8 -2.916 1.889 7.766
45 2HB MET 8 HB1 MET 8 -2.760 1.100 9.330
46 1HG MET 8 HG2 MET 8 -0.643 3.029 8.663
47 2HG MET 8 HG1 MET 8 -2.255 3.704 8.890
48 1HE MET 8 HE1 MET 8 0.269 1.135 10.476
49 2HE MET 8 HE2 MET 8 -1.316 0.410 10.748
50 3HE MET 8 HE3 MET 8 -0.371 1.004 12.114
51 H HIS 9 HN HIS 9 -2.168 0.056 5.690
52 HA HIS 9 HA HIS 9 -3.568 -2.324 6.549
53 1HB HIS 9 HB2 HIS 9 -3.531 -0.609 4.139
54 2HB HIS 9 HB1 HIS 9 -3.882 -2.311 3.858
55 HD1 HIS 9 HD1 HIS 9 -5.637 -2.958 6.257
56 HD2 HIS 9 HD2 HIS 9 -5.986 0.539 4.039
57 HE1 HIS 9 HE1 HIS 9 -7.985 -2.147 6.645
58 HE2 HIS 9 HE2 HIS 9 -8.201 -0.080 5.220
59 H CYS 10 HN CYS 10 -1.556 -1.869 3.653
60 HA CYS 10 HA CYS 10 -0.593 -4.601 3.926
61 1HB CYS 10 HB2 CYS 10 -0.332 -2.540 1.736
62 2HB CYS 10 HB1 CYS 10 0.479 -4.101 1.681
63 H LYS 11 HN LYS 11 1.245 -5.063 4.920
64 HA LYS 11 HA LYS 11 3.669 -3.702 4.478
65 1HB LYS 11 HB2 LYS 11 3.991 -2.852 6.830
66 2HB LYS 11 HB1 LYS 11 2.857 -1.936 5.848
67 1HG LYS 11 HG2 LYS 11 1.097 -2.461 7.147
68 2HG LYS 11 HG1 LYS 11 1.682 -4.095 7.467
69 1HD LYS 11 HD2 LYS 11 3.539 -2.581 8.767
70 2HD LYS 11 HD1 LYS 11 2.078 -1.615 8.984
71 1HE LYS 11 HE2 LYS 11 1.878 -4.536 9.459
72 2HE LYS 11 HE1 LYS 11 2.756 -3.577 10.650
73 1HZ LYS 11 HZ1 LYS 11 -0.085 -3.576 9.991
74 2HZ LYS 11 HZ2 LYS 11 0.603 -2.085 10.395
75 3HZ LYS 11 HZ3 LYS 11 0.679 -3.374 11.487
76 H GLY 12 HN GLY 12 5.024 -5.359 4.531
77 1HA GLY 12 HA2 GLY 12 4.973 -7.152 6.849
78 2HA GLY 12 HA1 GLY 12 4.870 -7.856 5.243
79 H LYS 13 HN LYS 13 6.673 -7.600 3.807
80 HA LYS 13 HA LYS 13 9.131 -6.536 4.815
81 1HB LYS 13 HB2 LYS 13 8.594 -9.118 5.535
82 2HB LYS 13 HB1 LYS 13 9.519 -9.343 4.057
83 1HG LYS 13 HG2 LYS 13 11.141 -9.375 5.705
84 2HG LYS 13 HG1 LYS 13 11.204 -7.711 5.119
85 1HD LYS 13 HD2 LYS 13 9.671 -7.083 6.995
86 2HD LYS 13 HD1 LYS 13 9.857 -8.723 7.619
87 1HE LYS 13 HE2 LYS 13 12.006 -8.372 8.290
88 2HE LYS 13 HE1 LYS 13 12.330 -7.205 7.009
89 1HZ LYS 13 HZ1 LYS 13 11.597 -5.494 8.257
90 2HZ LYS 13 HZ2 LYS 13 12.004 -6.516 9.542
91 3HZ LYS 13 HZ3 LYS 13 10.396 -6.403 9.030
92 H ASN 14 HN ASN 14 7.366 -8.216 2.315
93 HA ASN 14 HA ASN 14 9.130 -7.010 0.345
94 1HB ASN 14 HB2 ASN 14 8.382 -9.862 0.634
95 2HB ASN 14 HB1 ASN 14 8.326 -9.211 -1.001
96 1HD2 ASN 14 1HD2 ASN 14 10.448 -9.093 1.843
97 2HD2 ASN 14 2HD2 ASN 14 11.920 -9.311 0.964
98 H ALA 15 HN ALA 15 6.688 -6.105 1.483
99 HA ALA 15 HA ALA 15 5.093 -5.952 -0.959
100 1HB ALA 15 HB1 ALA 15 3.616 -7.366 -0.024
101 2HB ALA 15 HB2 ALA 15 3.110 -5.937 0.878
102 3HB ALA 15 HB3 ALA 15 4.230 -7.089 1.606
103 H LYS 16 HN LYS 16 5.164 -3.851 -1.472
104 HA LYS 16 HA LYS 16 4.842 -1.892 0.703
105 1HB LYS 16 HB2 LYS 16 7.035 -1.685 -0.271
106 2HB LYS 16 HB1 LYS 16 6.359 -1.639 -1.892
107 1HG LYS 16 HG2 LYS 16 5.273 0.495 -1.366
108 2HG LYS 16 HG1 LYS 16 5.992 0.449 0.245
109 1HD LYS 16 HD2 LYS 16 7.650 1.638 -0.699
110 2HD LYS 16 HD1 LYS 16 8.179 0.077 -1.329
111 1HE LYS 16 HE2 LYS 16 6.253 1.865 -2.793
112 2HE LYS 16 HE1 LYS 16 8.000 1.967 -3.006
113 1HZ LYS 16 HZ1 LYS 16 8.017 -0.333 -3.727
114 2HZ LYS 16 HZ2 LYS 16 6.966 0.574 -4.693
115 3HZ LYS 16 HZ3 LYS 16 6.344 -0.450 -3.499
116 HA PRO 17 HA PRO 17 1.085 -0.756 -1.377
117 1HB PRO 17 HB2 PRO 17 0.519 1.486 0.009
118 2HB PRO 17 HB1 PRO 17 0.362 -0.124 0.722
119 1HG PRO 17 HG2 PRO 17 2.579 1.868 1.011
120 2HG PRO 17 HG1 PRO 17 1.810 0.862 2.253
121 1HD PRO 17 HD2 PRO 17 4.197 0.238 1.096
122 2HD PRO 17 HD1 PRO 17 3.068 -0.984 1.714
123 H THR 18 HN THR 18 0.404 0.620 -2.991
124 HA THR 18 HA THR 18 2.140 2.885 -3.660
125 HB THR 18 HB THR 18 2.681 0.885 -5.061
126 HG1 THR 18 HG1 THR 18 2.947 3.090 -5.795
127 1HG2 THR 18 1HG2 THR 18 1.097 -0.296 -6.022
128 2HG2 THR 18 2HG2 THR 18 0.594 1.124 -6.939
129 3HG2 THR 18 3HG2 THR 18 -0.121 0.793 -5.363
130 H CYS 19 HN CYS 19 1.154 4.563 -4.890
131 HA CYS 19 HA CYS 19 -1.773 4.603 -4.603
132 1HB CYS 19 HB2 CYS 19 0.019 6.333 -3.534
133 2HB CYS 19 HB1 CYS 19 -0.365 7.153 -5.042
134 H ASP 20 HN ASP 20 -2.884 4.442 -6.434
135 HA ASP 20 HA ASP 20 -1.757 5.581 -8.875
136 1HB ASP 20 HB2 ASP 20 -1.785 2.973 -8.592
137 2HB ASP 20 HB1 ASP 20 -3.490 3.152 -8.987
138 H ASP 21 HN ASP 21 -2.987 7.386 -9.062
139 HA ASP 21 HA ASP 21 -4.817 8.727 -9.285
140 1HB ASP 21 HB2 ASP 21 -5.539 6.180 -10.649
141 2HB ASP 21 HB1 ASP 21 -6.826 7.354 -10.390
142 H GLY 22 HN GLY 22 -4.600 8.065 -6.741
143 1HA GLY 22 HA2 GLY 22 -5.774 8.064 -4.788
144 2HA GLY 22 HA1 GLY 22 -7.218 8.244 -5.760
145 H VAL 23 HN VAL 23 -5.363 5.537 -6.623
146 HA VAL 23 HA VAL 23 -7.168 3.785 -5.089
147 HB VAL 23 HB VAL 23 -5.815 3.140 -7.709
148 1HG1 VAL 23 1HG1 VAL 23 -7.084 1.166 -7.744
149 2HG1 VAL 23 2HG1 VAL 23 -8.142 1.722 -6.448
150 3HG1 VAL 23 3HG1 VAL 23 -6.472 1.279 -6.094
151 1HG2 VAL 23 1HG2 VAL 23 -8.610 4.112 -7.145
152 2HG2 VAL 23 2HG2 VAL 23 -8.122 3.358 -8.663
153 3HG2 VAL 23 3HG2 VAL 23 -7.385 4.878 -8.157
154 H CYS 24 HN CYS 24 -5.999 3.180 -3.347
155 HA CYS 24 HA CYS 24 -3.184 2.729 -3.423
156 1HB CYS 24 HB2 CYS 24 -5.179 2.997 -1.430
157 2HB CYS 24 HB1 CYS 24 -4.408 1.436 -1.170
158 H ASN 25 HN ASN 25 -2.038 0.835 -3.486
159 HA ASN 25 HA ASN 25 -3.324 -1.723 -3.418
160 1HB ASN 25 HB2 ASN 25 -3.009 -0.409 -5.936
161 2HB ASN 25 HB1 ASN 25 -1.976 -1.833 -5.892
162 1HD2 ASN 25 1HD2 ASN 25 -4.403 -1.277 -7.437
163 2HD2 ASN 25 2HD2 ASN 25 -5.504 -2.554 -7.056
164 H CYS 26 HN CYS 26 -1.955 -3.080 -2.505
165 HA CYS 26 HA CYS 26 0.888 -2.399 -2.441
166 1HB CYS 26 HB2 CYS 26 0.991 -4.138 -0.634
167 2HB CYS 26 HB1 CYS 26 -0.061 -2.774 -0.271
168 H ASN 27 HN ASN 27 2.477 -3.699 -3.233
169 HA ASN 27 HA ASN 27 1.697 -6.254 -4.438
170 1HB ASN 27 HB2 ASN 27 3.129 -3.984 -5.796
171 2HB ASN 27 HB1 ASN 27 3.242 -5.641 -6.381
172 1HD2 ASN 27 1HD2 ASN 27 1.694 -2.822 -6.827
173 2HD2 ASN 27 2HD2 ASN 27 0.211 -3.390 -7.508
174 H VAL 28 HN VAL 28 4.745 -4.571 -4.784
175 HA VAL 28 HA VAL 28 6.001 -6.519 -2.973
176 HB VAL 28 HB VAL 28 6.434 -7.196 -5.289
177 1HG1 VAL 28 1HG1 VAL 28 8.195 -5.432 -6.369
178 2HG1 VAL 28 2HG1 VAL 28 7.052 -4.344 -5.583
179 3HG1 VAL 28 3HG1 VAL 28 6.480 -5.513 -6.773
180 1HG2 VAL 28 1HG2 VAL 28 8.217 -7.114 -3.298
181 2HG2 VAL 28 2HG2 VAL 28 9.069 -6.119 -4.480
182 3HG2 VAL 28 3HG2 VAL 28 8.593 -7.767 -4.893
Start of MODEL 5
1 1H VAL 1 HT1 VAL 1 -10.492 5.974 4.195
2 2H VAL 1 HT2 VAL 1 -10.785 5.954 2.504
3 3H VAL 1 HT3 VAL 1 -9.985 7.291 3.223
4 HA VAL 1 HA VAL 1 -8.094 6.085 3.664
5 HB VAL 1 HB VAL 1 -7.991 3.629 3.072
6 1HG1 VAL 1 1HG1 VAL 1 -9.345 4.851 5.386
7 2HG1 VAL 1 2HG1 VAL 1 -7.936 3.793 5.321
8 3HG1 VAL 1 3HG1 VAL 1 -9.557 3.110 5.202
9 1HG2 VAL 1 1HG2 VAL 1 -10.035 3.560 1.712
10 2HG2 VAL 1 2HG2 VAL 1 -10.997 3.878 3.155
11 3HG2 VAL 1 3HG2 VAL 1 -10.077 2.379 3.021
12 H GLY 2 HN GLY 2 -6.639 6.491 2.134
13 1HA GLY 2 HA2 GLY 2 -7.080 5.578 -0.595
14 2HA GLY 2 HA1 GLY 2 -6.998 7.318 -0.369
15 H CYS 3 HN CYS 3 -5.034 8.284 0.194
16 HA CYS 3 HA CYS 3 -2.689 6.558 -0.242
17 1HB CYS 3 HB2 CYS 3 -3.410 8.712 -1.711
18 2HB CYS 3 HB1 CYS 3 -2.388 9.490 -0.508
19 H GLU 4 HN GLU 4 -4.251 8.641 1.996
20 HA GLU 4 HA GLU 4 -1.866 9.173 3.540
21 1HB GLU 4 HB2 GLU 4 -4.774 9.814 3.938
22 2HB GLU 4 HB1 GLU 4 -3.561 10.173 5.158
23 1HG GLU 4 HG2 GLU 4 -3.261 11.163 2.351
24 2HG GLU 4 HG1 GLU 4 -4.259 12.025 3.522
25 H GLU 5 HN GLU 5 -3.582 6.505 3.137
26 HA GLU 5 HA GLU 5 -2.994 5.538 5.835
27 1HB GLU 5 HB2 GLU 5 -5.578 5.226 4.329
28 2HB GLU 5 HB1 GLU 5 -5.112 4.105 5.599
29 1HG GLU 5 HG2 GLU 5 -5.028 6.996 6.230
30 2HG GLU 5 HG1 GLU 5 -6.611 6.240 6.058
31 H CYS 6 HN CYS 6 -1.470 5.271 3.443
32 HA CYS 6 HA CYS 6 -1.925 2.692 2.321
33 1HB CYS 6 HB2 CYS 6 0.008 4.868 1.944
34 2HB CYS 6 HB1 CYS 6 0.639 3.256 1.627
35 HA PRO 7 HA PRO 7 2.184 1.828 5.018
36 1HB PRO 7 HB2 PRO 7 1.174 3.527 7.259
37 2HB PRO 7 HB1 PRO 7 2.837 3.190 6.765
38 1HG PRO 7 HG2 PRO 7 1.665 5.517 6.168
39 2HG PRO 7 HG1 PRO 7 2.779 4.727 5.038
40 1HD PRO 7 HD2 PRO 7 -0.182 4.963 4.916
41 2HD PRO 7 HD1 PRO 7 0.993 4.827 3.600
42 H MET 8 HN MET 8 -0.749 2.649 6.889
43 HA MET 8 HA MET 8 -0.709 0.399 8.541
44 1HB MET 8 HB2 MET 8 -2.753 2.406 7.753
45 2HB MET 8 HB1 MET 8 -3.332 0.927 8.506
46 1HG MET 8 HG2 MET 8 -1.486 1.464 10.278
47 2HG MET 8 HG1 MET 8 -1.647 3.100 9.641
48 1HE MET 8 HE1 MET 8 -5.343 3.936 10.235
49 2HE MET 8 HE2 MET 8 -4.074 3.907 9.010
50 3HE MET 8 HE3 MET 8 -3.812 4.761 10.531
51 H HIS 9 HN HIS 9 -1.880 0.815 5.284
52 HA HIS 9 HA HIS 9 -3.248 -1.749 5.291
53 1HB HIS 9 HB2 HIS 9 -2.925 0.454 3.271
54 2HB HIS 9 HB1 HIS 9 -3.537 -1.125 2.791
55 HD1 HIS 9 HD1 HIS 9 -5.308 -1.636 5.325
56 HD2 HIS 9 HD2 HIS 9 -5.273 1.860 3.080
57 HE1 HIS 9 HE1 HIS 9 -7.532 -0.541 5.749
58 HE2 HIS 9 HE2 HIS 9 -7.454 1.614 4.448
59 H CYS 10 HN CYS 10 -2.615 -3.555 4.138
60 HA CYS 10 HA CYS 10 -1.157 -5.095 3.333
61 1HB CYS 10 HB2 CYS 10 -0.696 -2.653 1.738
62 2HB CYS 10 HB1 CYS 10 0.570 -3.868 1.652
63 H LYS 11 HN LYS 11 0.107 -5.859 4.924
64 HA LYS 11 HA LYS 11 2.712 -4.573 5.306
65 1HB LYS 11 HB2 LYS 11 0.848 -5.430 7.523
66 2HB LYS 11 HB1 LYS 11 2.547 -5.047 7.763
67 1HG LYS 11 HG2 LYS 11 1.880 -2.796 6.595
68 2HG LYS 11 HG1 LYS 11 0.264 -3.245 7.143
69 1HD LYS 11 HD2 LYS 11 1.122 -1.945 8.889
70 2HD LYS 11 HD1 LYS 11 1.350 -3.607 9.436
71 1HE LYS 11 HE2 LYS 11 3.681 -3.526 8.669
72 2HE LYS 11 HE1 LYS 11 3.446 -1.855 8.156
73 1HZ LYS 11 HZ1 LYS 11 3.665 -2.955 10.864
74 2HZ LYS 11 HZ2 LYS 11 2.703 -1.582 10.634
75 3HZ LYS 11 HZ3 LYS 11 4.341 -1.546 10.214
76 H GLY 12 HN GLY 12 4.208 -6.018 4.804
77 1HA GLY 12 HA2 GLY 12 3.919 -8.762 5.792
78 2HA GLY 12 HA1 GLY 12 4.185 -8.517 4.073
79 H LYS 13 HN LYS 13 6.214 -8.073 3.331
80 HA LYS 13 HA LYS 13 8.325 -7.279 5.079
81 1HB LYS 13 HB2 LYS 13 7.844 -10.079 4.639
82 2HB LYS 13 HB1 LYS 13 9.402 -9.630 3.960
83 1HG LYS 13 HG2 LYS 13 9.563 -8.406 6.350
84 2HG LYS 13 HG1 LYS 13 8.526 -9.772 6.765
85 1HD LYS 13 HD2 LYS 13 10.482 -10.857 7.036
86 2HD LYS 13 HD1 LYS 13 10.421 -11.009 5.279
87 1HE LYS 13 HE2 LYS 13 11.670 -8.609 6.561
88 2HE LYS 13 HE1 LYS 13 12.578 -10.112 6.400
89 1HZ LYS 13 HZ1 LYS 13 11.235 -8.844 4.090
90 2HZ LYS 13 HZ2 LYS 13 12.460 -10.010 4.081
91 3HZ LYS 13 HZ3 LYS 13 12.808 -8.422 4.549
92 H ASN 14 HN ASN 14 7.431 -8.624 1.944
93 HA ASN 14 HA ASN 14 9.352 -6.811 0.712
94 1HB ASN 14 HB2 ASN 14 8.781 -9.686 0.099
95 2HB ASN 14 HB1 ASN 14 9.300 -8.612 -1.196
96 1HD2 ASN 14 1HD2 ASN 14 11.348 -9.024 -1.597
97 2HD2 ASN 14 2HD2 ASN 14 12.602 -9.182 -0.419
98 H ALA 15 HN ALA 15 6.624 -6.369 1.400
99 HA ALA 15 HA ALA 15 5.457 -6.087 -1.285
100 1HB ALA 15 HB1 ALA 15 3.455 -6.834 -0.596
101 2HB ALA 15 HB2 ALA 15 3.581 -6.028 0.968
102 3HB ALA 15 HB3 ALA 15 4.381 -7.578 0.708
103 H LYS 16 HN LYS 16 5.974 -4.011 -1.779
104 HA LYS 16 HA LYS 16 5.585 -1.932 0.222
105 1HB LYS 16 HB2 LYS 16 7.645 -1.806 -1.009
106 2HB LYS 16 HB1 LYS 16 6.790 -1.870 -2.543
107 1HG LYS 16 HG2 LYS 16 5.659 0.321 -1.453
108 2HG LYS 16 HG1 LYS 16 7.264 0.391 -0.724
109 1HD LYS 16 HD2 LYS 16 7.330 1.635 -2.764
110 2HD LYS 16 HD1 LYS 16 8.230 0.138 -3.015
111 1HE LYS 16 HE2 LYS 16 6.611 -0.761 -4.389
112 2HE LYS 16 HE1 LYS 16 5.328 0.237 -3.706
113 1HZ LYS 16 HZ1 LYS 16 6.128 2.123 -4.877
114 2HZ LYS 16 HZ2 LYS 16 6.031 0.859 -5.997
115 3HZ LYS 16 HZ3 LYS 16 7.533 1.319 -5.370
116 HA PRO 17 HA PRO 17 1.598 -0.936 -1.463
117 1HB PRO 17 HB2 PRO 17 1.171 1.366 -0.124
118 2HB PRO 17 HB1 PRO 17 1.095 -0.215 0.662
119 1HG PRO 17 HG2 PRO 17 3.315 1.792 0.652
120 2HG PRO 17 HG1 PRO 17 2.693 0.819 1.997
121 1HD PRO 17 HD2 PRO 17 4.952 0.179 0.606
122 2HD PRO 17 HD1 PRO 17 3.913 -1.029 1.388
123 H THR 18 HN THR 18 0.800 0.244 -3.122
124 HA THR 18 HA THR 18 2.407 2.499 -4.106
125 HB THR 18 HB THR 18 1.062 1.398 -6.273
126 HG1 THR 18 HG1 THR 18 2.490 -0.600 -4.874
127 1HG2 THR 18 1HG2 THR 18 3.952 0.976 -5.630
128 2HG2 THR 18 2HG2 THR 18 3.294 2.494 -6.242
129 3HG2 THR 18 3HG2 THR 18 3.191 1.030 -7.220
130 H CYS 19 HN CYS 19 1.325 4.265 -4.906
131 HA CYS 19 HA CYS 19 -1.537 4.328 -4.286
132 1HB CYS 19 HB2 CYS 19 0.289 6.008 -3.385
133 2HB CYS 19 HB1 CYS 19 0.016 6.794 -4.935
134 H ASP 20 HN ASP 20 -2.888 4.091 -5.932
135 HA ASP 20 HA ASP 20 -2.188 5.254 -8.516
136 1HB ASP 20 HB2 ASP 20 -2.083 2.647 -8.234
137 2HB ASP 20 HB1 ASP 20 -3.833 2.768 -8.363
138 H ASP 21 HN ASP 21 -3.503 6.995 -8.574
139 HA ASP 21 HA ASP 21 -5.389 8.272 -8.523
140 1HB ASP 21 HB2 ASP 21 -6.523 5.621 -9.425
141 2HB ASP 21 HB1 ASP 21 -7.468 7.106 -9.386
142 H GLY 22 HN GLY 22 -4.694 7.684 -6.037
143 1HA GLY 22 HA2 GLY 22 -5.496 7.717 -3.905
144 2HA GLY 22 HA1 GLY 22 -7.093 7.866 -4.605
145 H VAL 23 HN VAL 23 -5.360 5.149 -5.698
146 HA VAL 23 HA VAL 23 -6.862 3.426 -3.838
147 HB VAL 23 HB VAL 23 -5.981 2.735 -6.643
148 1HG1 VAL 23 1HG1 VAL 23 -6.533 1.026 -4.617
149 2HG1 VAL 23 2HG1 VAL 23 -6.794 0.661 -6.323
150 3HG1 VAL 23 3HG1 VAL 23 -8.135 1.228 -5.327
151 1HG2 VAL 23 1HG2 VAL 23 -8.851 2.981 -6.058
152 2HG2 VAL 23 2HG2 VAL 23 -7.936 3.467 -7.485
153 3HG2 VAL 23 3HG2 VAL 23 -7.952 4.499 -6.054
154 H CYS 24 HN CYS 24 -5.417 2.853 -2.312
155 HA CYS 24 HA CYS 24 -2.649 2.386 -2.903
156 1HB CYS 24 HB2 CYS 24 -3.668 3.248 -0.698
157 2HB CYS 24 HB1 CYS 24 -4.036 1.560 -0.362
158 H ASN 25 HN ASN 25 -1.588 0.487 -3.171
159 HA ASN 25 HA ASN 25 -2.791 -2.040 -2.568
160 1HB ASN 25 HB2 ASN 25 -3.161 -0.931 -5.175
161 2HB ASN 25 HB1 ASN 25 -2.135 -2.356 -5.294
162 1HD2 ASN 25 1HD2 ASN 25 -3.753 -3.493 -6.372
163 2HD2 ASN 25 2HD2 ASN 25 -5.139 -4.111 -5.546
164 H CYS 26 HN CYS 26 -1.218 -3.342 -1.946
165 HA CYS 26 HA CYS 26 1.538 -2.630 -2.479
166 1HB CYS 26 HB2 CYS 26 2.081 -4.423 -0.882
167 2HB CYS 26 HB1 CYS 26 0.905 -3.295 -0.216
168 H ASN 27 HN ASN 27 3.070 -3.954 -3.483
169 HA ASN 27 HA ASN 27 1.976 -6.172 -5.074
170 1HB ASN 27 HB2 ASN 27 3.805 -3.947 -5.943
171 2HB ASN 27 HB1 ASN 27 3.705 -5.466 -6.828
172 1HD2 ASN 27 1HD2 ASN 27 1.859 -2.693 -5.718
173 2HD2 ASN 27 2HD2 ASN 27 0.639 -2.782 -6.938
174 H VAL 28 HN VAL 28 5.246 -4.912 -4.896
175 HA VAL 28 HA VAL 28 6.135 -7.159 -3.285
176 HB VAL 28 HB VAL 28 6.193 -8.070 -5.559
177 1HG1 VAL 28 1HG1 VAL 28 8.256 -6.844 -6.870
178 2HG1 VAL 28 2HG1 VAL 28 7.412 -5.479 -6.139
179 3HG1 VAL 28 3HG1 VAL 28 6.542 -6.588 -7.199
180 1HG2 VAL 28 1HG2 VAL 28 8.141 -9.155 -5.215
181 2HG2 VAL 28 2HG2 VAL 28 8.136 -8.254 -3.699
182 3HG2 VAL 28 3HG2 VAL 28 9.070 -7.663 -5.073
Start of MODEL 6
1 1H VAL 1 HT1 VAL 1 -10.476 2.465 -0.082
2 2H VAL 1 HT2 VAL 1 -9.894 3.667 -1.161
3 3H VAL 1 HT3 VAL 1 -10.891 4.110 0.164
4 HA VAL 1 HA VAL 1 -9.257 3.567 1.706
5 HB VAL 1 HB VAL 1 -7.023 2.758 0.961
6 1HG1 VAL 1 1HG1 VAL 1 -9.193 0.826 0.181
7 2HG1 VAL 1 2HG1 VAL 1 -8.860 1.275 1.853
8 3HG1 VAL 1 3HG1 VAL 1 -7.621 0.467 0.893
9 1HG2 VAL 1 1HG2 VAL 1 -7.218 3.464 -1.393
10 2HG2 VAL 1 2HG2 VAL 1 -8.419 2.200 -1.654
11 3HG2 VAL 1 3HG2 VAL 1 -6.762 1.768 -1.234
12 H GLY 2 HN GLY 2 -7.144 4.758 2.036
13 1HA GLY 2 HA2 GLY 2 -7.012 7.100 0.239
14 2HA GLY 2 HA1 GLY 2 -6.971 7.266 1.987
15 H CYS 3 HN CYS 3 -5.005 8.141 0.033
16 HA CYS 3 HA CYS 3 -2.773 6.445 -0.066
17 1HB CYS 3 HB2 CYS 3 -3.241 9.359 -0.439
18 2HB CYS 3 HB1 CYS 3 -1.580 8.830 -0.192
19 H GLU 4 HN GLU 4 -4.094 8.249 2.535
20 HA GLU 4 HA GLU 4 -1.624 8.389 4.025
21 1HB GLU 4 HB2 GLU 4 -3.632 10.038 4.094
22 2HB GLU 4 HB1 GLU 4 -4.333 8.864 5.199
23 1HG GLU 4 HG2 GLU 4 -2.668 9.205 6.804
24 2HG GLU 4 HG1 GLU 4 -1.599 10.003 5.650
25 H GLU 5 HN GLU 5 -3.520 5.918 3.295
26 HA GLU 5 HA GLU 5 -2.968 4.539 5.823
27 1HB GLU 5 HB2 GLU 5 -5.492 4.521 4.198
28 2HB GLU 5 HB1 GLU 5 -5.082 3.162 5.235
29 1HG GLU 5 HG2 GLU 5 -4.880 5.764 6.549
30 2HG GLU 5 HG1 GLU 5 -6.503 5.356 5.993
31 H CYS 6 HN CYS 6 -1.535 4.691 3.229
32 HA CYS 6 HA CYS 6 -1.885 2.196 1.910
33 1HB CYS 6 HB2 CYS 6 -0.372 4.583 1.494
34 2HB CYS 6 HB1 CYS 6 0.701 3.194 1.360
35 HA PRO 7 HA PRO 7 2.067 0.927 4.288
36 1HB PRO 7 HB2 PRO 7 3.014 2.585 6.203
37 2HB PRO 7 HB1 PRO 7 3.456 2.741 4.501
38 1HG PRO 7 HG2 PRO 7 1.528 4.335 6.113
39 2HG PRO 7 HG1 PRO 7 2.602 4.856 4.804
40 1HD PRO 7 HD2 PRO 7 -0.114 4.345 4.539
41 2HD PRO 7 HD1 PRO 7 1.044 4.370 3.202
42 H MET 8 HN MET 8 -0.793 2.049 5.648
43 HA MET 8 HA MET 8 -0.359 0.669 8.195
44 1HB MET 8 HB2 MET 8 -1.542 3.046 7.748
45 2HB MET 8 HB1 MET 8 -2.948 1.998 7.619
46 1HG MET 8 HG2 MET 8 -1.822 1.048 9.884
47 2HG MET 8 HG1 MET 8 -1.352 2.745 9.965
48 1HE MET 8 HE1 MET 8 -5.321 0.937 10.983
49 2HE MET 8 HE2 MET 8 -3.696 0.252 10.993
50 3HE MET 8 HE3 MET 8 -4.596 0.364 9.481
51 H HIS 9 HN HIS 9 -2.152 0.507 5.210
52 HA HIS 9 HA HIS 9 -3.911 -1.595 6.083
53 1HB HIS 9 HB2 HIS 9 -3.587 0.082 3.728
54 2HB HIS 9 HB1 HIS 9 -3.919 -1.590 3.296
55 HD1 HIS 9 HD1 HIS 9 -5.957 -2.414 5.352
56 HD2 HIS 9 HD2 HIS 9 -5.970 1.319 3.532
57 HE1 HIS 9 HE1 HIS 9 -8.319 -1.574 5.559
58 HE2 HIS 9 HE2 HIS 9 -8.281 0.726 4.533
59 H CYS 10 HN CYS 10 -1.368 -1.468 3.581
60 HA CYS 10 HA CYS 10 -1.075 -4.365 3.758
61 1HB CYS 10 HB2 CYS 10 -0.264 -2.271 1.791
62 2HB CYS 10 HB1 CYS 10 0.667 -3.764 1.851
63 H LYS 11 HN LYS 11 0.476 -5.303 4.911
64 HA LYS 11 HA LYS 11 3.069 -4.079 5.224
65 1HB LYS 11 HB2 LYS 11 3.055 -4.047 7.658
66 2HB LYS 11 HB1 LYS 11 1.793 -2.999 7.026
67 1HG LYS 11 HG2 LYS 11 0.440 -4.030 8.460
68 2HG LYS 11 HG1 LYS 11 0.488 -5.393 7.340
69 1HD LYS 11 HD2 LYS 11 2.444 -6.281 8.582
70 2HD LYS 11 HD1 LYS 11 2.262 -4.964 9.743
71 1HE LYS 11 HE2 LYS 11 -0.037 -5.766 10.215
72 2HE LYS 11 HE1 LYS 11 0.255 -7.134 9.141
73 1HZ LYS 11 HZ1 LYS 11 1.970 -7.921 10.577
74 2HZ LYS 11 HZ2 LYS 11 0.600 -7.631 11.526
75 3HZ LYS 11 HZ3 LYS 11 1.889 -6.535 11.545
76 H GLY 12 HN GLY 12 4.417 -5.694 4.843
77 1HA GLY 12 HA2 GLY 12 3.992 -8.252 6.203
78 2HA GLY 12 HA1 GLY 12 4.153 -8.259 4.453
79 H LYS 13 HN LYS 13 6.153 -8.023 3.529
80 HA LYS 13 HA LYS 13 8.429 -7.267 5.097
81 1HB LYS 13 HB2 LYS 13 7.785 -9.880 5.288
82 2HB LYS 13 HB1 LYS 13 8.799 -9.923 3.854
83 1HG LYS 13 HG2 LYS 13 10.210 -10.365 5.691
84 2HG LYS 13 HG1 LYS 13 10.552 -8.708 5.190
85 1HD LYS 13 HD2 LYS 13 8.687 -8.166 6.989
86 2HD LYS 13 HD1 LYS 13 9.210 -9.719 7.644
87 1HE LYS 13 HE2 LYS 13 10.674 -8.368 8.740
88 2HE LYS 13 HE1 LYS 13 11.604 -8.637 7.267
89 1HZ LYS 13 HZ1 LYS 13 11.667 -6.347 7.601
90 2HZ LYS 13 HZ2 LYS 13 10.036 -6.254 8.039
91 3HZ LYS 13 HZ3 LYS 13 10.463 -6.540 6.428
92 H ASN 14 HN ASN 14 7.212 -8.619 2.081
93 HA ASN 14 HA ASN 14 9.168 -6.997 0.659
94 1HB ASN 14 HB2 ASN 14 9.125 -9.765 0.635
95 2HB ASN 14 HB1 ASN 14 8.247 -9.337 -0.830
96 1HD2 ASN 14 1HD2 ASN 14 10.893 -10.568 -0.426
97 2HD2 ASN 14 2HD2 ASN 14 12.003 -9.570 -1.297
98 H ALA 15 HN ALA 15 6.531 -6.355 1.508
99 HA ALA 15 HA ALA 15 5.249 -6.012 -1.114
100 1HB ALA 15 HB1 ALA 15 4.130 -7.090 1.377
101 2HB ALA 15 HB2 ALA 15 3.639 -7.351 -0.296
102 3HB ALA 15 HB3 ALA 15 3.124 -5.896 0.557
103 H LYS 16 HN LYS 16 5.675 -3.926 -1.575
104 HA LYS 16 HA LYS 16 5.356 -1.926 0.540
105 1HB LYS 16 HB2 LYS 16 7.459 -1.765 -0.594
106 2HB LYS 16 HB1 LYS 16 6.677 -1.791 -2.168
107 1HG LYS 16 HG2 LYS 16 5.652 0.386 -1.677
108 2HG LYS 16 HG1 LYS 16 6.484 0.410 -0.121
109 1HD LYS 16 HD2 LYS 16 8.066 0.022 -2.623
110 2HD LYS 16 HD1 LYS 16 7.508 1.640 -2.194
111 1HE LYS 16 HE2 LYS 16 9.648 1.474 -1.249
112 2HE LYS 16 HE1 LYS 16 8.539 1.209 0.095
113 1HZ LYS 16 HZ1 LYS 16 10.593 -0.382 -0.439
114 2HZ LYS 16 HZ2 LYS 16 9.396 -1.168 -1.339
115 3HZ LYS 16 HZ3 LYS 16 9.181 -0.922 0.321
116 HA PRO 17 HA PRO 17 1.466 -0.753 -1.265
117 1HB PRO 17 HB2 PRO 17 0.997 1.454 0.201
118 2HB PRO 17 HB1 PRO 17 0.899 -0.169 0.896
119 1HG PRO 17 HG2 PRO 17 3.120 1.831 1.061
120 2HG PRO 17 HG1 PRO 17 2.451 0.796 2.335
121 1HD PRO 17 HD2 PRO 17 4.751 0.218 0.979
122 2HD PRO 17 HD1 PRO 17 3.691 -1.021 1.681
123 H THR 18 HN THR 18 0.700 0.635 -2.816
124 HA THR 18 HA THR 18 2.359 2.940 -3.533
125 HB THR 18 HB THR 18 2.884 0.979 -4.993
126 HG1 THR 18 HG1 THR 18 3.181 2.325 -6.590
127 1HG2 THR 18 1HG2 THR 18 0.721 1.179 -6.777
128 2HG2 THR 18 2HG2 THR 18 0.068 0.834 -5.177
129 3HG2 THR 18 3HG2 THR 18 1.281 -0.233 -5.882
130 H CYS 19 HN CYS 19 1.273 4.614 -4.685
131 HA CYS 19 HA CYS 19 -1.629 4.590 -4.215
132 1HB CYS 19 HB2 CYS 19 0.449 6.718 -4.108
133 2HB CYS 19 HB1 CYS 19 -1.173 7.179 -4.611
134 H ASP 20 HN ASP 20 -2.857 4.323 -5.949
135 HA ASP 20 HA ASP 20 -1.971 5.443 -8.496
136 1HB ASP 20 HB2 ASP 20 -1.895 2.842 -8.158
137 2HB ASP 20 HB1 ASP 20 -3.631 2.963 -8.416
138 H ASP 21 HN ASP 21 -3.271 7.187 -8.682
139 HA ASP 21 HA ASP 21 -5.153 8.470 -8.782
140 1HB ASP 21 HB2 ASP 21 -5.937 5.839 -9.937
141 2HB ASP 21 HB1 ASP 21 -7.224 6.995 -9.606
142 H GLY 22 HN GLY 22 -4.641 7.913 -6.247
143 1HA GLY 22 HA2 GLY 22 -5.591 7.965 -4.177
144 2HA GLY 22 HA1 GLY 22 -7.133 8.116 -4.990
145 H VAL 23 HN VAL 23 -5.303 5.381 -5.899
146 HA VAL 23 HA VAL 23 -6.952 3.681 -4.144
147 HB VAL 23 HB VAL 23 -5.898 2.967 -6.881
148 1HG1 VAL 23 1HG1 VAL 23 -7.341 1.031 -6.714
149 2HG1 VAL 23 2HG1 VAL 23 -7.919 1.564 -5.136
150 3HG1 VAL 23 3HG1 VAL 23 -6.238 1.072 -5.338
151 1HG2 VAL 23 1HG2 VAL 23 -8.780 3.479 -6.239
152 2HG2 VAL 23 2HG2 VAL 23 -7.980 3.439 -7.810
153 3HG2 VAL 23 3HG2 VAL 23 -7.708 4.795 -6.717
154 H CYS 24 HN CYS 24 -5.612 3.096 -2.526
155 HA CYS 24 HA CYS 24 -2.817 2.676 -2.859
156 1HB CYS 24 HB2 CYS 24 -4.785 2.397 -0.655
157 2HB CYS 24 HB1 CYS 24 -3.312 1.443 -0.518
158 H ASN 25 HN ASN 25 -1.658 0.811 -3.107
159 HA ASN 25 HA ASN 25 -2.875 -1.774 -2.910
160 1HB ASN 25 HB2 ASN 25 -2.900 -0.434 -5.432
161 2HB ASN 25 HB1 ASN 25 -1.832 -1.828 -5.532
162 1HD2 ASN 25 1HD2 ASN 25 -5.069 -0.826 -4.560
163 2HD2 ASN 25 2HD2 ASN 25 -5.836 -2.332 -4.916
164 H CYS 26 HN CYS 26 -1.382 -3.115 -2.192
165 HA CYS 26 HA CYS 26 1.433 -2.372 -2.421
166 1HB CYS 26 HB2 CYS 26 1.787 -4.148 -0.710
167 2HB CYS 26 HB1 CYS 26 0.678 -2.887 -0.184
168 H ASN 27 HN ASN 27 3.027 -3.794 -3.195
169 HA ASN 27 HA ASN 27 2.097 -6.191 -4.588
170 1HB ASN 27 HB2 ASN 27 3.449 -3.826 -5.824
171 2HB ASN 27 HB1 ASN 27 3.727 -5.434 -6.486
172 1HD2 ASN 27 1HD2 ASN 27 2.687 -3.914 -8.244
173 2HD2 ASN 27 2HD2 ASN 27 0.984 -4.131 -8.438
174 H VAL 28 HN VAL 28 5.208 -4.625 -4.926
175 HA VAL 28 HA VAL 28 6.428 -6.843 -3.418
176 HB VAL 28 HB VAL 28 7.710 -5.379 -5.724
177 1HG1 VAL 28 1HG1 VAL 28 8.530 -7.562 -3.892
178 2HG1 VAL 28 2HG1 VAL 28 9.487 -6.273 -4.621
179 3HG1 VAL 28 3HG1 VAL 28 9.028 -7.681 -5.579
180 1HG2 VAL 28 1HG2 VAL 28 6.513 -8.143 -5.789
181 2HG2 VAL 28 2HG2 VAL 28 7.180 -7.222 -7.137
182 3HG2 VAL 28 3HG2 VAL 28 5.678 -6.704 -6.373
Start of MODEL 7
1 1H VAL 1 HT1 VAL 1 -7.611 1.542 -1.324
2 2H VAL 1 HT2 VAL 1 -9.255 1.780 -0.896
3 3H VAL 1 HT3 VAL 1 -8.450 0.332 -0.447
4 HA VAL 1 HA VAL 1 -8.807 2.166 1.257
5 HB VAL 1 HB VAL 1 -6.503 1.648 2.225
6 1HG1 VAL 1 1HG1 VAL 1 -7.861 -0.889 1.450
7 2HG1 VAL 1 2HG1 VAL 1 -8.752 0.307 2.391
8 3HG1 VAL 1 3HG1 VAL 1 -7.251 -0.371 3.021
9 1HG2 VAL 1 1HG2 VAL 1 -4.952 0.514 1.061
10 2HG2 VAL 1 2HG2 VAL 1 -5.840 1.081 -0.353
11 3HG2 VAL 1 3HG2 VAL 1 -6.148 -0.530 0.294
12 H GLY 2 HN GLY 2 -7.311 3.766 2.355
13 1HA GLY 2 HA2 GLY 2 -6.835 5.930 0.570
14 2HA GLY 2 HA1 GLY 2 -6.440 5.895 2.282
15 H CYS 3 HN CYS 3 -4.714 7.201 0.761
16 HA CYS 3 HA CYS 3 -2.566 5.379 -0.008
17 1HB CYS 3 HB2 CYS 3 -3.305 8.156 -0.657
18 2HB CYS 3 HB1 CYS 3 -1.577 7.879 -0.472
19 H GLU 4 HN GLU 4 -3.419 7.675 2.464
20 HA GLU 4 HA GLU 4 -0.734 7.632 3.591
21 1HB GLU 4 HB2 GLU 4 -3.233 9.145 4.298
22 2HB GLU 4 HB1 GLU 4 -1.783 9.200 5.290
23 1HG GLU 4 HG2 GLU 4 -1.465 11.058 4.017
24 2HG GLU 4 HG1 GLU 4 -0.646 9.860 3.016
25 H GLU 5 HN GLU 5 -3.189 5.590 3.660
26 HA GLU 5 HA GLU 5 -2.585 4.703 6.387
27 1HB GLU 5 HB2 GLU 5 -5.286 4.918 5.080
28 2HB GLU 5 HB1 GLU 5 -4.999 3.856 6.451
29 1HG GLU 5 HG2 GLU 5 -4.788 5.575 7.922
30 2HG GLU 5 HG1 GLU 5 -4.163 6.687 6.705
31 H CYS 6 HN CYS 6 -1.537 3.897 3.762
32 HA CYS 6 HA CYS 6 -2.683 1.353 3.154
33 1HB CYS 6 HB2 CYS 6 -0.926 3.128 1.873
34 2HB CYS 6 HB1 CYS 6 -0.024 1.636 2.111
35 HA PRO 7 HA PRO 7 1.692 -0.015 5.119
36 1HB PRO 7 HB2 PRO 7 1.550 2.142 7.182
37 2HB PRO 7 HB1 PRO 7 2.965 1.391 6.437
38 1HG PRO 7 HG2 PRO 7 2.135 3.818 5.685
39 2HG PRO 7 HG1 PRO 7 2.797 2.664 4.513
40 1HD PRO 7 HD2 PRO 7 -0.018 3.518 4.936
41 2HD PRO 7 HD1 PRO 7 0.781 2.959 3.459
42 H MET 8 HN MET 8 -1.130 1.317 6.728
43 HA MET 8 HA MET 8 -0.957 -0.512 8.956
44 1HB MET 8 HB2 MET 8 -2.070 1.926 8.716
45 2HB MET 8 HB1 MET 8 -3.487 0.932 8.407
46 1HG MET 8 HG2 MET 8 -3.472 0.017 10.526
47 2HG MET 8 HG1 MET 8 -1.768 0.383 10.784
48 1HE MET 8 HE1 MET 8 -5.395 1.491 11.411
49 2HE MET 8 HE2 MET 8 -5.091 2.246 9.846
50 3HE MET 8 HE3 MET 8 -5.321 3.248 11.278
51 H HIS 9 HN HIS 9 -2.581 -0.337 5.877
52 HA HIS 9 HA HIS 9 -4.311 -2.589 6.506
53 1HB HIS 9 HB2 HIS 9 -3.993 -0.924 4.003
54 2HB HIS 9 HB1 HIS 9 -5.129 -2.260 4.160
55 HD1 HIS 9 HD1 HIS 9 -6.338 -1.699 6.891
56 HD2 HIS 9 HD2 HIS 9 -5.603 1.257 4.065
57 HE1 HIS 9 HE1 HIS 9 -7.890 0.191 7.476
58 HE2 HIS 9 HE2 HIS 9 -7.484 1.936 5.704
59 H CYS 10 HN CYS 10 -1.381 -1.885 4.741
60 HA CYS 10 HA CYS 10 -1.110 -4.757 4.163
61 1HB CYS 10 HB2 CYS 10 -0.761 -2.429 2.322
62 2HB CYS 10 HB1 CYS 10 0.283 -3.831 2.116
63 H LYS 11 HN LYS 11 0.621 -5.589 5.113
64 HA LYS 11 HA LYS 11 2.500 -4.087 6.544
65 1HB LYS 11 HB2 LYS 11 3.776 -6.206 6.711
66 2HB LYS 11 HB1 LYS 11 2.072 -6.401 7.101
67 1HG LYS 11 HG2 LYS 11 2.599 -6.869 4.291
68 2HG LYS 11 HG1 LYS 11 3.552 -7.927 5.334
69 1HD LYS 11 HD2 LYS 11 1.499 -8.601 6.503
70 2HD LYS 11 HD1 LYS 11 0.557 -7.561 5.433
71 1HE LYS 11 HE2 LYS 11 0.312 -9.541 4.331
72 2HE LYS 11 HE1 LYS 11 1.799 -8.975 3.571
73 1HZ LYS 11 HZ1 LYS 11 2.950 -10.272 5.433
74 2HZ LYS 11 HZ2 LYS 11 2.268 -11.151 4.160
75 3HZ LYS 11 HZ3 LYS 11 1.462 -11.049 5.643
76 H GLY 12 HN GLY 12 4.585 -3.430 6.119
77 1HA GLY 12 HA2 GLY 12 5.309 -3.409 3.265
78 2HA GLY 12 HA1 GLY 12 5.841 -2.229 4.453
79 H LYS 13 HN LYS 13 5.899 -5.780 4.431
80 HA LYS 13 HA LYS 13 8.789 -5.634 4.803
81 1HB LYS 13 HB2 LYS 13 7.555 -6.388 6.829
82 2HB LYS 13 HB1 LYS 13 6.951 -7.755 5.902
83 1HG LYS 13 HG2 LYS 13 8.731 -8.669 7.048
84 2HG LYS 13 HG1 LYS 13 9.449 -8.274 5.485
85 1HD LYS 13 HD2 LYS 13 10.520 -6.355 6.351
86 2HD LYS 13 HD1 LYS 13 9.556 -6.391 7.828
87 1HE LYS 13 HE2 LYS 13 10.722 -8.825 7.939
88 2HE LYS 13 HE1 LYS 13 11.973 -7.910 7.099
89 1HZ LYS 13 HZ1 LYS 13 11.745 -6.231 8.937
90 2HZ LYS 13 HZ2 LYS 13 12.424 -7.714 9.386
91 3HZ LYS 13 HZ3 LYS 13 10.813 -7.372 9.771
92 H ASN 14 HN ASN 14 6.191 -7.028 3.058
93 HA ASN 14 HA ASN 14 8.080 -8.298 1.281
94 1HB ASN 14 HB2 ASN 14 6.942 -9.938 3.025
95 2HB ASN 14 HB1 ASN 14 5.585 -9.820 1.908
96 1HD2 ASN 14 1HD2 ASN 14 5.534 -11.543 0.673
97 2HD2 ASN 14 2HD2 ASN 14 6.891 -12.299 -0.083
98 H ALA 15 HN ALA 15 6.501 -5.898 1.304
99 HA ALA 15 HA ALA 15 5.582 -5.871 -1.320
100 1HB ALA 15 HB1 ALA 15 3.075 -5.511 -0.684
101 2HB ALA 15 HB2 ALA 15 3.493 -6.505 0.711
102 3HB ALA 15 HB3 ALA 15 3.704 -7.142 -0.920
103 H LYS 16 HN LYS 16 5.539 -3.804 -1.976
104 HA LYS 16 HA LYS 16 5.438 -1.735 0.104
105 1HB LYS 16 HB2 LYS 16 7.505 -1.684 -1.104
106 2HB LYS 16 HB1 LYS 16 6.669 -1.729 -2.649
107 1HG LYS 16 HG2 LYS 16 5.699 0.500 -2.114
108 2HG LYS 16 HG1 LYS 16 6.714 0.538 -0.671
109 1HD LYS 16 HD2 LYS 16 8.545 -0.073 -2.577
110 2HD LYS 16 HD1 LYS 16 7.424 0.932 -3.498
111 1HE LYS 16 HE2 LYS 16 7.964 2.806 -2.360
112 2HE LYS 16 HE1 LYS 16 8.153 1.949 -0.831
113 1HZ LYS 16 HZ1 LYS 16 10.333 1.549 -1.219
114 2HZ LYS 16 HZ2 LYS 16 10.195 2.958 -2.144
115 3HZ LYS 16 HZ3 LYS 16 10.151 1.445 -2.898
116 HA PRO 17 HA PRO 17 1.511 -0.501 -1.574
117 1HB PRO 17 HB2 PRO 17 1.214 1.810 -0.210
118 2HB PRO 17 HB1 PRO 17 1.042 0.228 0.560
119 1HG PRO 17 HG2 PRO 17 3.384 2.093 0.568
120 2HG PRO 17 HG1 PRO 17 2.693 1.160 1.908
121 1HD PRO 17 HD2 PRO 17 4.911 0.373 0.539
122 2HD PRO 17 HD1 PRO 17 3.777 -0.771 1.286
123 H THR 18 HN THR 18 0.760 0.784 -3.196
124 HA THR 18 HA THR 18 2.470 2.985 -4.110
125 HB THR 18 HB THR 18 2.807 0.922 -5.484
126 HG1 THR 18 HG1 THR 18 3.196 2.266 -7.030
127 1HG2 THR 18 1HG2 THR 18 0.526 1.171 -7.131
128 2HG2 THR 18 2HG2 THR 18 -0.004 0.886 -5.475
129 3HG2 THR 18 3HG2 THR 18 1.108 -0.241 -6.249
130 H CYS 19 HN CYS 19 1.401 4.652 -5.291
131 HA CYS 19 HA CYS 19 -1.483 4.771 -4.712
132 1HB CYS 19 HB2 CYS 19 0.628 6.913 -4.854
133 2HB CYS 19 HB1 CYS 19 -1.086 7.300 -4.952
134 H ASP 20 HN ASP 20 -2.764 4.579 -6.418
135 HA ASP 20 HA ASP 20 -1.879 5.651 -8.985
136 1HB ASP 20 HB2 ASP 20 -1.897 3.049 -8.641
137 2HB ASP 20 HB1 ASP 20 -3.631 3.237 -8.868
138 H ASP 21 HN ASP 21 -3.113 7.452 -9.121
139 HA ASP 21 HA ASP 21 -4.947 8.803 -9.195
140 1HB ASP 21 HB2 ASP 21 -6.353 6.254 -10.021
141 2HB ASP 21 HB1 ASP 21 -6.897 7.899 -10.339
142 H GLY 22 HN GLY 22 -4.438 8.225 -6.667
143 1HA GLY 22 HA2 GLY 22 -5.373 8.309 -4.592
144 2HA GLY 22 HA1 GLY 22 -6.916 8.498 -5.394
145 H VAL 23 HN VAL 23 -5.218 5.717 -6.358
146 HA VAL 23 HA VAL 23 -6.880 4.061 -4.574
147 HB VAL 23 HB VAL 23 -5.850 3.306 -7.310
148 1HG1 VAL 23 1HG1 VAL 23 -6.594 1.644 -5.314
149 2HG1 VAL 23 2HG1 VAL 23 -6.786 1.275 -7.028
150 3HG1 VAL 23 3HG1 VAL 23 -8.147 1.913 -6.105
151 1HG2 VAL 23 1HG2 VAL 23 -8.561 4.316 -6.464
152 2HG2 VAL 23 2HG2 VAL 23 -8.226 3.555 -8.020
153 3HG2 VAL 23 3HG2 VAL 23 -7.441 5.076 -7.594
154 H CYS 24 HN CYS 24 -5.543 3.455 -2.958
155 HA CYS 24 HA CYS 24 -2.763 2.920 -3.366
156 1HB CYS 24 HB2 CYS 24 -4.160 3.650 -1.199
157 2HB CYS 24 HB1 CYS 24 -4.122 1.912 -0.924
158 H ASN 25 HN ASN 25 -1.682 0.940 -3.241
159 HA ASN 25 HA ASN 25 -3.117 -1.528 -3.021
160 1HB ASN 25 HB2 ASN 25 -2.765 -0.367 -5.609
161 2HB ASN 25 HB1 ASN 25 -1.821 -1.847 -5.505
162 1HD2 ASN 25 1HD2 ASN 25 -5.031 -0.481 -5.132
163 2HD2 ASN 25 2HD2 ASN 25 -5.893 -1.953 -5.408
164 H CYS 26 HN CYS 26 -1.817 -2.916 -2.058
165 HA CYS 26 HA CYS 26 1.056 -2.395 -2.027
166 1HB CYS 26 HB2 CYS 26 1.137 -3.923 -0.132
167 2HB CYS 26 HB1 CYS 26 -0.119 -2.717 0.124
168 H ASN 27 HN ASN 27 2.434 -3.528 -3.224
169 HA ASN 27 HA ASN 27 1.683 -6.234 -4.074
170 1HB ASN 27 HB2 ASN 27 2.411 -3.910 -5.776
171 2HB ASN 27 HB1 ASN 27 3.032 -5.489 -6.250
172 1HD2 ASN 27 1HD2 ASN 27 0.306 -3.435 -6.091
173 2HD2 ASN 27 2HD2 ASN 27 -0.830 -4.506 -6.831
174 H VAL 28 HN VAL 28 4.481 -4.333 -4.996
175 HA VAL 28 HA VAL 28 6.188 -5.898 -3.210
176 HB VAL 28 HB VAL 28 6.171 -7.139 -5.322
177 1HG1 VAL 28 1HG1 VAL 28 6.450 -6.239 -7.373
178 2HG1 VAL 28 2HG1 VAL 28 7.606 -5.033 -6.806
179 3HG1 VAL 28 3HG1 VAL 28 5.877 -4.777 -6.569
180 1HG2 VAL 28 1HG2 VAL 28 8.468 -7.472 -5.466
181 2HG2 VAL 28 2HG2 VAL 28 8.266 -6.778 -3.857
182 3HG2 VAL 28 3HG2 VAL 28 8.832 -5.769 -5.189
Start of MODEL 8
1 1H VAL 1 HT1 VAL 1 -9.355 6.441 -1.827
2 2H VAL 1 HT2 VAL 1 -9.818 4.826 -1.476
3 3H VAL 1 HT3 VAL 1 -8.261 5.154 -2.118
4 HA VAL 1 HA VAL 1 -9.295 5.982 0.508
5 HB VAL 1 HB VAL 1 -7.488 4.488 1.356
6 1HG1 VAL 1 1HG1 VAL 1 -9.964 3.859 1.012
7 2HG1 VAL 1 2HG1 VAL 1 -8.802 2.569 1.322
8 3HG1 VAL 1 3HG1 VAL 1 -9.369 2.868 -0.321
9 1HG2 VAL 1 1HG2 VAL 1 -6.150 4.455 -0.722
10 2HG2 VAL 1 2HG2 VAL 1 -7.398 3.467 -1.481
11 3HG2 VAL 1 3HG2 VAL 1 -6.494 2.839 -0.104
12 H GLY 2 HN GLY 2 -7.413 6.686 1.910
13 1HA GLY 2 HA2 GLY 2 -6.170 8.929 0.720
14 2HA GLY 2 HA1 GLY 2 -5.827 8.296 2.323
15 H CYS 3 HN CYS 3 -3.845 9.384 0.716
16 HA CYS 3 HA CYS 3 -2.406 7.181 -0.517
17 1HB CYS 3 HB2 CYS 3 -2.194 10.126 -0.503
18 2HB CYS 3 HB1 CYS 3 -0.660 9.266 -0.580
19 H GLU 4 HN GLU 4 -2.354 9.079 2.411
20 HA GLU 4 HA GLU 4 0.186 7.948 3.252
21 1HB GLU 4 HB2 GLU 4 -0.685 10.370 3.669
22 2HB GLU 4 HB1 GLU 4 -1.567 9.627 4.996
23 1HG GLU 4 HG2 GLU 4 0.868 8.636 5.487
24 2HG GLU 4 HG1 GLU 4 1.322 10.140 4.686
25 H GLU 5 HN GLU 5 -2.786 6.782 3.139
26 HA GLU 5 HA GLU 5 -2.609 5.393 5.718
27 1HB GLU 5 HB2 GLU 5 -4.956 6.123 3.994
28 2HB GLU 5 HB1 GLU 5 -5.076 4.831 5.180
29 1HG GLU 5 HG2 GLU 5 -4.081 7.529 5.987
30 2HG GLU 5 HG1 GLU 5 -5.809 7.225 5.818
31 H CYS 6 HN CYS 6 -1.342 4.801 3.000
32 HA CYS 6 HA CYS 6 -2.577 2.360 2.166
33 1HB CYS 6 HB2 CYS 6 -0.428 4.077 1.224
34 2HB CYS 6 HB1 CYS 6 -0.056 2.366 1.044
35 HA PRO 7 HA PRO 7 1.687 0.690 4.142
36 1HB PRO 7 HB2 PRO 7 1.560 2.693 6.355
37 2HB PRO 7 HB1 PRO 7 2.969 1.947 5.593
38 1HG PRO 7 HG2 PRO 7 2.248 4.452 5.004
39 2HG PRO 7 HG1 PRO 7 2.900 3.364 3.766
40 1HD PRO 7 HD2 PRO 7 0.105 4.285 4.186
41 2HD PRO 7 HD1 PRO 7 0.924 3.818 2.688
42 H MET 8 HN MET 8 -1.136 2.005 5.758
43 HA MET 8 HA MET 8 -1.109 0.137 7.927
44 1HB MET 8 HB2 MET 8 -2.237 2.455 7.825
45 2HB MET 8 HB1 MET 8 -3.539 1.633 6.975
46 1HG MET 8 HG2 MET 8 -3.352 0.007 9.065
47 2HG MET 8 HG1 MET 8 -2.721 1.472 9.814
48 1HE MET 8 HE1 MET 8 -5.452 1.031 6.995
49 2HE MET 8 HE2 MET 8 -6.926 1.060 7.962
50 3HE MET 8 HE3 MET 8 -5.784 -0.272 8.136
51 H HIS 9 HN HIS 9 -2.458 0.206 4.713
52 HA HIS 9 HA HIS 9 -4.311 -1.925 5.086
53 1HB HIS 9 HB2 HIS 9 -3.287 -0.334 2.817
54 2HB HIS 9 HB1 HIS 9 -3.846 -1.953 2.412
55 HD1 HIS 9 HD1 HIS 9 -6.307 -2.240 4.129
56 HD2 HIS 9 HD2 HIS 9 -5.345 1.270 2.129
57 HE1 HIS 9 HE1 HIS 9 -8.478 -0.997 3.873
58 HE2 HIS 9 HE2 HIS 9 -7.859 1.160 2.727
59 H CYS 10 HN CYS 10 -1.575 -2.008 2.823
60 HA CYS 10 HA CYS 10 -1.270 -4.849 3.305
61 1HB CYS 10 HB2 CYS 10 -1.047 -3.412 1.049
62 2HB CYS 10 HB1 CYS 10 0.640 -3.398 1.552
63 H LYS 11 HN LYS 11 0.282 -5.797 4.481
64 HA LYS 11 HA LYS 11 2.752 -4.444 5.107
65 1HB LYS 11 HB2 LYS 11 0.682 -4.992 7.229
66 2HB LYS 11 HB1 LYS 11 2.387 -4.781 7.603
67 1HG LYS 11 HG2 LYS 11 2.059 -2.562 6.215
68 2HG LYS 11 HG1 LYS 11 0.378 -2.791 6.703
69 1HD LYS 11 HD2 LYS 11 1.127 -1.567 8.481
70 2HD LYS 11 HD1 LYS 11 1.498 -3.189 9.067
71 1HE LYS 11 HE2 LYS 11 3.460 -1.440 7.593
72 2HE LYS 11 HE1 LYS 11 3.343 -1.520 9.350
73 1HZ LYS 11 HZ1 LYS 11 5.056 -2.989 8.672
74 2HZ LYS 11 HZ2 LYS 11 4.079 -3.715 7.498
75 3HZ LYS 11 HZ3 LYS 11 3.747 -3.955 9.138
76 H GLY 12 HN GLY 12 4.241 -5.961 4.849
77 1HA GLY 12 HA2 GLY 12 3.822 -8.591 6.057
78 2HA GLY 12 HA1 GLY 12 4.156 -8.524 4.334
79 H LYS 13 HN LYS 13 6.219 -8.083 3.619
80 HA LYS 13 HA LYS 13 8.285 -7.263 5.407
81 1HB LYS 13 HB2 LYS 13 7.764 -10.068 5.059
82 2HB LYS 13 HB1 LYS 13 9.354 -9.675 4.421
83 1HG LYS 13 HG2 LYS 13 9.837 -8.541 6.612
84 2HG LYS 13 HG1 LYS 13 8.333 -9.241 7.214
85 1HD LYS 13 HD2 LYS 13 10.130 -10.682 7.862
86 2HD LYS 13 HD1 LYS 13 9.218 -11.491 6.585
87 1HE LYS 13 HE2 LYS 13 11.468 -9.807 5.693
88 2HE LYS 13 HE1 LYS 13 11.905 -11.254 6.600
89 1HZ LYS 13 HZ1 LYS 13 10.106 -12.241 4.897
90 2HZ LYS 13 HZ2 LYS 13 11.769 -12.210 4.589
91 3HZ LYS 13 HZ3 LYS 13 10.768 -11.007 3.946
92 H ASN 14 HN ASN 14 7.382 -8.583 2.284
93 HA ASN 14 HA ASN 14 9.403 -6.886 1.063
94 1HB ASN 14 HB2 ASN 14 8.962 -9.791 0.689
95 2HB ASN 14 HB1 ASN 14 9.224 -8.855 -0.780
96 1HD2 ASN 14 1HD2 ASN 14 10.891 -10.885 0.510
97 2HD2 ASN 14 2HD2 ASN 14 12.420 -10.131 0.789
98 H ALA 15 HN ALA 15 6.652 -6.438 1.666
99 HA ALA 15 HA ALA 15 5.696 -5.925 -1.047
100 1HB ALA 15 HB1 ALA 15 4.247 -7.629 -0.785
101 2HB ALA 15 HB2 ALA 15 3.339 -6.444 0.154
102 3HB ALA 15 HB3 ALA 15 4.380 -7.608 0.973
103 H LYS 16 HN LYS 16 5.621 -3.767 -1.150
104 HA LYS 16 HA LYS 16 4.635 -2.298 1.200
105 1HB LYS 16 HB2 LYS 16 6.874 -1.640 0.661
106 2HB LYS 16 HB1 LYS 16 6.464 -1.430 -1.035
107 1HG LYS 16 HG2 LYS 16 5.026 0.456 -0.457
108 2HG LYS 16 HG1 LYS 16 5.425 0.238 1.248
109 1HD LYS 16 HD2 LYS 16 7.032 1.755 0.831
110 2HD LYS 16 HD1 LYS 16 7.901 0.384 0.140
111 1HE LYS 16 HE2 LYS 16 6.010 1.739 -1.666
112 2HE LYS 16 HE1 LYS 16 7.411 2.692 -1.178
113 1HZ LYS 16 HZ1 LYS 16 8.344 1.638 -2.916
114 2HZ LYS 16 HZ2 LYS 16 7.271 0.332 -2.866
115 3HZ LYS 16 HZ3 LYS 16 8.581 0.390 -1.798
116 HA PRO 17 HA PRO 17 1.100 -1.253 -1.283
117 1HB PRO 17 HB2 PRO 17 -0.065 0.493 0.392
118 2HB PRO 17 HB1 PRO 17 -0.017 -1.240 0.736
119 1HG PRO 17 HG2 PRO 17 1.702 0.956 1.820
120 2HG PRO 17 HG1 PRO 17 0.984 -0.427 2.667
121 1HD PRO 17 HD2 PRO 17 3.594 -0.336 1.827
122 2HD PRO 17 HD1 PRO 17 2.675 -1.839 2.043
123 H THR 18 HN THR 18 0.479 0.321 -2.706
124 HA THR 18 HA THR 18 1.779 2.937 -2.528
125 HB THR 18 HB THR 18 2.828 1.161 -4.173
126 HG1 THR 18 HG1 THR 18 2.350 3.881 -4.803
127 1HG2 THR 18 1HG2 THR 18 0.725 2.443 -5.883
128 2HG2 THR 18 2HG2 THR 18 0.767 0.744 -5.419
129 3HG2 THR 18 3HG2 THR 18 2.044 1.413 -6.436
130 H CYS 19 HN CYS 19 0.445 4.605 -2.866
131 HA CYS 19 HA CYS 19 -2.316 4.037 -3.491
132 1HB CYS 19 HB2 CYS 19 -2.783 6.232 -2.725
133 2HB CYS 19 HB1 CYS 19 -1.532 5.600 -1.662
134 H ASP 20 HN ASP 20 -3.222 4.234 -5.419
135 HA ASP 20 HA ASP 20 -1.990 5.972 -7.412
136 1HB ASP 20 HB2 ASP 20 -1.635 3.377 -7.618
137 2HB ASP 20 HB1 ASP 20 -3.281 3.412 -8.236
138 H ASP 21 HN ASP 21 -3.466 7.588 -7.499
139 HA ASP 21 HA ASP 21 -5.456 8.677 -7.734
140 1HB ASP 21 HB2 ASP 21 -6.043 6.231 -9.418
141 2HB ASP 21 HB1 ASP 21 -7.002 7.708 -9.428
142 H GLY 22 HN GLY 22 -5.399 7.604 -5.327
143 1HA GLY 22 HA2 GLY 22 -6.755 7.087 -3.571
144 2HA GLY 22 HA1 GLY 22 -8.100 7.213 -4.684
145 H VAL 23 HN VAL 23 -5.715 5.012 -5.694
146 HA VAL 23 HA VAL 23 -7.306 2.761 -4.650
147 HB VAL 23 HB VAL 23 -5.793 2.842 -7.261
148 1HG1 VAL 23 1HG1 VAL 23 -6.286 0.668 -7.545
149 2HG1 VAL 23 2HG1 VAL 23 -7.891 0.837 -6.835
150 3HG1 VAL 23 3HG1 VAL 23 -6.481 0.657 -5.792
151 1HG2 VAL 23 1HG2 VAL 23 -8.181 2.728 -8.201
152 2HG2 VAL 23 2HG2 VAL 23 -7.591 4.284 -7.619
153 3HG2 VAL 23 3HG2 VAL 23 -8.682 3.325 -6.619
154 H CYS 24 HN CYS 24 -6.054 2.206 -2.907
155 HA CYS 24 HA CYS 24 -3.211 2.118 -2.974
156 1HB CYS 24 HB2 CYS 24 -4.742 2.346 -0.923
157 2HB CYS 24 HB1 CYS 24 -4.934 0.599 -1.024
158 H ASN 25 HN ASN 25 -1.829 0.455 -3.349
159 HA ASN 25 HA ASN 25 -2.727 -2.264 -3.568
160 1HB ASN 25 HB2 ASN 25 -1.957 -2.490 -5.961
161 2HB ASN 25 HB1 ASN 25 -3.454 -1.590 -5.742
162 1HD2 ASN 25 1HD2 ASN 25 -0.973 -1.634 -7.646
163 2HD2 ASN 25 2HD2 ASN 25 -0.672 0.049 -7.894
164 H CYS 26 HN CYS 26 -1.134 -3.465 -2.796
165 HA CYS 26 HA CYS 26 1.580 -2.382 -2.761
166 1HB CYS 26 HB2 CYS 26 2.020 -4.260 -1.156
167 2HB CYS 26 HB1 CYS 26 0.794 -3.117 -0.616
168 H ASN 27 HN ASN 27 3.388 -3.583 -3.442
169 HA ASN 27 HA ASN 27 2.790 -5.831 -5.240
170 1HB ASN 27 HB2 ASN 27 4.545 -3.439 -5.745
171 2HB ASN 27 HB1 ASN 27 4.710 -4.932 -6.666
172 1HD2 ASN 27 1HD2 ASN 27 2.940 -2.051 -6.221
173 2HD2 ASN 27 2HD2 ASN 27 1.777 -2.299 -7.475
174 H VAL 28 HN VAL 28 5.864 -4.306 -4.520
175 HA VAL 28 HA VAL 28 6.703 -6.748 -3.106
176 HB VAL 28 HB VAL 28 8.501 -5.140 -4.919
177 1HG1 VAL 28 1HG1 VAL 28 9.988 -6.262 -3.638
178 2HG1 VAL 28 2HG1 VAL 28 9.613 -7.576 -4.753
179 3HG1 VAL 28 3HG1 VAL 28 8.823 -7.503 -3.178
180 1HG2 VAL 28 1HG2 VAL 28 6.577 -6.285 -6.103
181 2HG2 VAL 28 2HG2 VAL 28 7.286 -7.812 -5.577
182 3HG2 VAL 28 3HG2 VAL 28 8.197 -6.735 -6.636
Start of MODEL 9
1 1H VAL 1 HT1 VAL 1 -10.205 2.599 0.325
2 2H VAL 1 HT2 VAL 1 -10.406 2.712 2.026
3 3H VAL 1 HT3 VAL 1 -10.146 1.184 1.289
4 HA VAL 1 HA VAL 1 -8.240 2.330 2.465
5 HB VAL 1 HB VAL 1 -6.640 1.467 0.774
6 1HG1 VAL 1 1HG1 VAL 1 -8.904 -0.482 1.024
7 2HG1 VAL 1 2HG1 VAL 1 -7.985 0.042 2.436
8 3HG1 VAL 1 3HG1 VAL 1 -7.168 -0.780 1.106
9 1HG2 VAL 1 1HG2 VAL 1 -9.107 1.459 -0.898
10 2HG2 VAL 1 2HG2 VAL 1 -7.894 0.206 -1.160
11 3HG2 VAL 1 3HG2 VAL 1 -7.455 1.906 -1.326
12 H GLY 2 HN GLY 2 -6.794 3.981 2.425
13 1HA GLY 2 HA2 GLY 2 -7.121 5.956 0.250
14 2HA GLY 2 HA1 GLY 2 -6.822 6.397 1.924
15 H CYS 3 HN CYS 3 -5.058 7.647 0.894
16 HA CYS 3 HA CYS 3 -2.741 6.000 0.171
17 1HB CYS 3 HB2 CYS 3 -3.606 8.769 -0.457
18 2HB CYS 3 HB1 CYS 3 -1.875 8.502 -0.288
19 H GLU 4 HN GLU 4 -3.954 8.169 2.599
20 HA GLU 4 HA GLU 4 -1.378 8.521 3.858
21 1HB GLU 4 HB2 GLU 4 -3.556 10.083 3.802
22 2HB GLU 4 HB1 GLU 4 -3.867 9.218 5.299
23 1HG GLU 4 HG2 GLU 4 -2.404 10.460 6.400
24 2HG GLU 4 HG1 GLU 4 -1.142 10.119 5.217
25 H GLU 5 HN GLU 5 -3.333 5.995 3.686
26 HA GLU 5 HA GLU 5 -2.465 4.956 6.273
27 1HB GLU 5 HB2 GLU 5 -5.282 5.033 5.242
28 2HB GLU 5 HB1 GLU 5 -4.771 3.758 6.338
29 1HG GLU 5 HG2 GLU 5 -4.556 5.172 8.112
30 2HG GLU 5 HG1 GLU 5 -4.197 6.569 7.098
31 H CYS 6 HN CYS 6 -1.516 4.583 3.554
32 HA CYS 6 HA CYS 6 -2.409 2.138 2.497
33 1HB CYS 6 HB2 CYS 6 -0.154 3.964 2.017
34 2HB CYS 6 HB1 CYS 6 0.123 2.288 1.554
35 HA PRO 7 HA PRO 7 1.719 0.456 4.741
36 1HB PRO 7 HB2 PRO 7 1.240 2.190 7.126
37 2HB PRO 7 HB1 PRO 7 2.764 1.602 6.450
38 1HG PRO 7 HG2 PRO 7 1.958 4.121 6.057
39 2HG PRO 7 HG1 PRO 7 2.808 3.214 4.794
40 1HD PRO 7 HD2 PRO 7 -0.065 3.951 4.977
41 2HD PRO 7 HD1 PRO 7 0.941 3.682 3.547
42 H MET 8 HN MET 8 -0.923 1.668 6.819
43 HA MET 8 HA MET 8 -1.099 -0.669 8.392
44 1HB MET 8 HB2 MET 8 -1.998 1.683 8.898
45 2HB MET 8 HB1 MET 8 -3.384 1.232 7.915
46 1HG MET 8 HG2 MET 8 -3.482 -0.836 9.488
47 2HG MET 8 HG1 MET 8 -2.515 0.174 10.562
48 1HE MET 8 HE1 MET 8 -6.614 0.008 9.270
49 2HE MET 8 HE2 MET 8 -5.280 0.216 8.136
50 3HE MET 8 HE3 MET 8 -6.272 1.600 8.593
51 H HIS 9 HN HIS 9 -2.510 0.243 5.339
52 HA HIS 9 HA HIS 9 -4.508 -1.813 5.329
53 1HB HIS 9 HB2 HIS 9 -3.440 0.098 3.271
54 2HB HIS 9 HB1 HIS 9 -4.525 -1.208 2.803
55 HD1 HIS 9 HD1 HIS 9 -6.516 -1.106 5.137
56 HD2 HIS 9 HD2 HIS 9 -5.095 2.252 3.144
57 HE1 HIS 9 HE1 HIS 9 -8.243 0.682 5.516
58 HE2 HIS 9 HE2 HIS 9 -7.321 2.729 4.373
59 H CYS 10 HN CYS 10 -1.193 -1.524 4.265
60 HA CYS 10 HA CYS 10 -1.171 -4.388 3.689
61 1HB CYS 10 HB2 CYS 10 -0.479 -2.211 1.751
62 2HB CYS 10 HB1 CYS 10 0.380 -3.745 1.673
63 H LYS 11 HN LYS 11 0.545 -5.364 4.558
64 HA LYS 11 HA LYS 11 2.358 -4.044 6.210
65 1HB LYS 11 HB2 LYS 11 2.549 -6.757 4.895
66 2HB LYS 11 HB1 LYS 11 3.653 -6.193 6.141
67 1HG LYS 11 HG2 LYS 11 0.814 -5.980 6.838
68 2HG LYS 11 HG1 LYS 11 1.400 -7.627 6.598
69 1HD LYS 11 HD2 LYS 11 1.690 -7.105 8.903
70 2HD LYS 11 HD1 LYS 11 3.290 -7.078 8.158
71 1HE LYS 11 HE2 LYS 11 1.867 -4.506 8.154
72 2HE LYS 11 HE1 LYS 11 2.295 -5.117 9.752
73 1HZ LYS 11 HZ1 LYS 11 3.944 -3.690 8.237
74 2HZ LYS 11 HZ2 LYS 11 4.387 -5.244 7.741
75 3HZ LYS 11 HZ3 LYS 11 4.480 -4.821 9.376
76 H GLY 12 HN GLY 12 4.731 -3.949 5.999
77 1HA GLY 12 HA2 GLY 12 5.543 -3.436 3.205
78 2HA GLY 12 HA1 GLY 12 6.003 -2.372 4.525
79 H LYS 13 HN LYS 13 6.011 -5.908 4.212
80 HA LYS 13 HA LYS 13 8.886 -5.856 4.702
81 1HB LYS 13 HB2 LYS 13 6.752 -7.423 6.039
82 2HB LYS 13 HB1 LYS 13 8.285 -8.234 5.755
83 1HG LYS 13 HG2 LYS 13 9.077 -5.839 6.819
84 2HG LYS 13 HG1 LYS 13 7.582 -6.175 7.694
85 1HD LYS 13 HD2 LYS 13 9.913 -8.072 7.415
86 2HD LYS 13 HD1 LYS 13 9.556 -7.094 8.840
87 1HE LYS 13 HE2 LYS 13 7.878 -8.446 9.507
88 2HE LYS 13 HE1 LYS 13 7.333 -8.753 7.859
89 1HZ LYS 13 HZ1 LYS 13 8.539 -10.575 9.365
90 2HZ LYS 13 HZ2 LYS 13 9.891 -9.918 8.590
91 3HZ LYS 13 HZ3 LYS 13 8.626 -10.569 7.675
92 H ASN 14 HN ASN 14 6.253 -7.211 2.949
93 HA ASN 14 HA ASN 14 8.129 -8.484 1.156
94 1HB ASN 14 HB2 ASN 14 6.725 -10.035 2.926
95 2HB ASN 14 HB1 ASN 14 5.651 -10.028 1.531
96 1HD2 ASN 14 1HD2 ASN 14 6.257 -12.369 1.730
97 2HD2 ASN 14 2HD2 ASN 14 7.637 -12.898 0.835
98 H ALA 15 HN ALA 15 6.607 -6.049 1.198
99 HA ALA 15 HA ALA 15 5.656 -6.030 -1.432
100 1HB ALA 15 HB1 ALA 15 3.810 -7.278 0.013
101 2HB ALA 15 HB2 ALA 15 3.392 -6.217 -1.332
102 3HB ALA 15 HB3 ALA 15 3.307 -5.617 0.324
103 H LYS 16 HN LYS 16 5.773 -3.990 -2.141
104 HA LYS 16 HA LYS 16 6.007 -1.868 -0.148
105 1HB LYS 16 HB2 LYS 16 7.840 -1.941 -1.671
106 2HB LYS 16 HB1 LYS 16 6.767 -2.016 -3.061
107 1HG LYS 16 HG2 LYS 16 6.001 0.274 -2.548
108 2HG LYS 16 HG1 LYS 16 7.166 0.337 -1.224
109 1HD LYS 16 HD2 LYS 16 8.955 0.516 -2.625
110 2HD LYS 16 HD1 LYS 16 8.185 -0.425 -3.904
111 1HE LYS 16 HE2 LYS 16 6.602 1.602 -4.127
112 2HE LYS 16 HE1 LYS 16 7.840 2.473 -3.223
113 1HZ LYS 16 HZ1 LYS 16 8.565 0.921 -5.622
114 2HZ LYS 16 HZ2 LYS 16 9.367 2.234 -4.921
115 3HZ LYS 16 HZ3 LYS 16 7.929 2.481 -5.777
116 HA PRO 17 HA PRO 17 1.916 -0.452 -1.176
117 1HB PRO 17 HB2 PRO 17 1.971 1.889 0.170
118 2HB PRO 17 HB1 PRO 17 1.838 0.329 0.988
119 1HG PRO 17 HG2 PRO 17 4.250 2.055 0.583
120 2HG PRO 17 HG1 PRO 17 3.735 1.177 2.035
121 1HD PRO 17 HD2 PRO 17 5.656 0.250 0.345
122 2HD PRO 17 HD1 PRO 17 4.594 -0.820 1.282
123 H THR 18 HN THR 18 0.980 0.848 -2.685
124 HA THR 18 HA THR 18 2.552 3.027 -3.835
125 HB THR 18 HB THR 18 2.902 0.966 -5.193
126 HG1 THR 18 HG1 THR 18 2.717 2.061 -7.070
127 1HG2 THR 18 1HG2 THR 18 0.094 0.779 -4.968
128 2HG2 THR 18 2HG2 THR 18 1.219 -0.330 -5.750
129 3HG2 THR 18 3HG2 THR 18 0.506 0.997 -6.667
130 H CYS 19 HN CYS 19 1.319 4.595 -4.998
131 HA CYS 19 HA CYS 19 -1.548 4.542 -4.319
132 1HB CYS 19 HB2 CYS 19 0.496 6.694 -4.089
133 2HB CYS 19 HB1 CYS 19 -1.146 7.160 -4.517
134 H ASP 20 HN ASP 20 -2.822 4.430 -6.036
135 HA ASP 20 HA ASP 20 -1.980 5.725 -8.514
136 1HB ASP 20 HB2 ASP 20 -1.913 3.106 -8.365
137 2HB ASP 20 HB1 ASP 20 -3.654 3.253 -8.576
138 H ASP 21 HN ASP 21 -3.274 7.482 -8.553
139 HA ASP 21 HA ASP 21 -5.149 8.779 -8.520
140 1HB ASP 21 HB2 ASP 21 -5.977 6.239 -9.841
141 2HB ASP 21 HB1 ASP 21 -7.244 7.384 -9.411
142 H GLY 22 HN GLY 22 -4.593 8.038 -6.042
143 1HA GLY 22 HA2 GLY 22 -5.503 7.945 -3.956
144 2HA GLY 22 HA1 GLY 22 -7.060 8.160 -4.726
145 H VAL 23 HN VAL 23 -5.253 5.490 -5.855
146 HA VAL 23 HA VAL 23 -6.877 3.675 -4.196
147 HB VAL 23 HB VAL 23 -5.889 3.160 -7.001
148 1HG1 VAL 23 1HG1 VAL 23 -6.712 1.075 -6.843
149 2HG1 VAL 23 2HG1 VAL 23 -8.115 1.592 -5.907
150 3HG1 VAL 23 3HG1 VAL 23 -6.566 1.333 -5.104
151 1HG2 VAL 23 1HG2 VAL 23 -8.625 3.974 -6.028
152 2HG2 VAL 23 2HG2 VAL 23 -8.264 3.407 -7.659
153 3HG2 VAL 23 3HG2 VAL 23 -7.549 4.907 -7.068
154 H CYS 24 HN CYS 24 -5.503 2.973 -2.653
155 HA CYS 24 HA CYS 24 -2.736 2.681 -2.892
156 1HB CYS 24 HB2 CYS 24 -4.201 2.696 -0.773
157 2HB CYS 24 HB1 CYS 24 -4.413 0.973 -1.063
158 H ASN 25 HN ASN 25 -1.439 0.739 -2.958
159 HA ASN 25 HA ASN 25 -2.602 -1.720 -3.853
160 1HB ASN 25 HB2 ASN 25 -1.774 0.208 -5.799
161 2HB ASN 25 HB1 ASN 25 -0.738 -1.210 -5.902
162 1HD2 ASN 25 1HD2 ASN 25 -1.607 -3.169 -6.517
163 2HD2 ASN 25 2HD2 ASN 25 -3.180 -3.310 -7.218
164 H CYS 26 HN CYS 26 -1.423 -3.297 -3.045
165 HA CYS 26 HA CYS 26 1.455 -2.845 -2.607
166 1HB CYS 26 HB2 CYS 26 1.318 -4.143 -0.550
167 2HB CYS 26 HB1 CYS 26 0.201 -2.785 -0.478
168 H ASN 27 HN ASN 27 2.744 -4.278 -3.568
169 HA ASN 27 HA ASN 27 1.645 -6.915 -4.258
170 1HB ASN 27 HB2 ASN 27 3.185 -5.004 -5.984
171 2HB ASN 27 HB1 ASN 27 3.203 -6.734 -6.313
172 1HD2 ASN 27 1HD2 ASN 27 1.291 -3.841 -6.267
173 2HD2 ASN 27 2HD2 ASN 27 -0.051 -4.469 -7.156
174 H VAL 28 HN VAL 28 4.834 -5.602 -4.886
175 HA VAL 28 HA VAL 28 5.973 -7.381 -2.847
176 HB VAL 28 HB VAL 28 7.141 -7.141 -5.619
177 1HG1 VAL 28 1HG1 VAL 28 8.896 -8.213 -4.785
178 2HG1 VAL 28 2HG1 VAL 28 7.863 -9.503 -4.170
179 3HG1 VAL 28 3HG1 VAL 28 8.183 -8.080 -3.178
180 1HG2 VAL 28 1HG2 VAL 28 4.976 -8.250 -5.767
181 2HG2 VAL 28 2HG2 VAL 28 5.447 -9.367 -4.485
182 3HG2 VAL 28 3HG2 VAL 28 6.287 -9.399 -6.036
Start of MODEL 10
1 1H VAL 1 HT1 VAL 1 -10.872 5.452 2.301
2 2H VAL 1 HT2 VAL 1 -10.084 6.422 3.478
3 3H VAL 1 HT3 VAL 1 -10.701 4.879 3.907
4 HA VAL 1 HA VAL 1 -8.359 4.791 3.680
5 HB VAL 1 HB VAL 1 -8.211 3.036 1.909
6 1HG1 VAL 1 1HG1 VAL 1 -10.683 2.635 3.566
7 2HG1 VAL 1 2HG1 VAL 1 -9.074 2.692 4.284
8 3HG1 VAL 1 3HG1 VAL 1 -9.465 1.449 3.097
9 1HG2 VAL 1 1HG2 VAL 1 -10.176 4.354 0.644
10 2HG2 VAL 1 2HG2 VAL 1 -11.132 3.125 1.473
11 3HG2 VAL 1 3HG2 VAL 1 -9.834 2.644 0.380
12 H GLY 2 HN GLY 2 -6.492 5.329 2.631
13 1HA GLY 2 HA2 GLY 2 -6.662 6.530 -0.032
14 2HA GLY 2 HA1 GLY 2 -6.055 7.540 1.271
15 H CYS 3 HN CYS 3 -4.042 7.747 0.231
16 HA CYS 3 HA CYS 3 -2.463 5.354 -0.228
17 1HB CYS 3 HB2 CYS 3 -2.234 8.228 -0.918
18 2HB CYS 3 HB1 CYS 3 -0.720 7.359 -0.687
19 H GLU 4 HN GLU 4 -2.865 7.789 2.193
20 HA GLU 4 HA GLU 4 -0.335 7.227 3.476
21 1HB GLU 4 HB2 GLU 4 -2.656 8.999 4.194
22 2HB GLU 4 HB1 GLU 4 -1.258 8.796 5.241
23 1HG GLU 4 HG2 GLU 4 0.196 9.695 3.528
24 2HG GLU 4 HG1 GLU 4 -1.164 9.825 2.413
25 H GLU 5 HN GLU 5 -3.042 5.537 3.275
26 HA GLU 5 HA GLU 5 -2.871 4.533 6.029
27 1HB GLU 5 HB2 GLU 5 -5.235 4.604 4.161
28 2HB GLU 5 HB1 GLU 5 -5.217 3.704 5.670
29 1HG GLU 5 HG2 GLU 5 -4.425 6.494 5.967
30 2HG GLU 5 HG1 GLU 5 -6.065 6.281 5.355
31 H CYS 6 HN CYS 6 -1.324 3.767 3.598
32 HA CYS 6 HA CYS 6 -2.270 1.178 2.848
33 1HB CYS 6 HB2 CYS 6 -0.320 3.004 1.896
34 2HB CYS 6 HB1 CYS 6 0.487 1.471 2.208
35 HA PRO 7 HA PRO 7 1.770 -0.006 5.523
36 1HB PRO 7 HB2 PRO 7 1.223 2.169 7.496
37 2HB PRO 7 HB1 PRO 7 2.765 1.461 7.002
38 1HG PRO 7 HG2 PRO 7 1.985 3.847 6.085
39 2HG PRO 7 HG1 PRO 7 2.866 2.705 5.055
40 1HD PRO 7 HD2 PRO 7 -0.009 3.459 5.007
41 2HD PRO 7 HD1 PRO 7 1.036 2.917 3.685
42 H MET 8 HN MET 8 -1.036 1.533 7.098
43 HA MET 8 HA MET 8 -1.242 -0.389 9.170
44 1HB MET 8 HB2 MET 8 -2.315 2.053 8.781
45 2HB MET 8 HB1 MET 8 -3.689 1.053 8.326
46 1HG MET 8 HG2 MET 8 -2.337 0.317 10.835
47 2HG MET 8 HG1 MET 8 -3.184 1.862 10.834
48 1HE MET 8 HE1 MET 8 -6.832 1.062 10.582
49 2HE MET 8 HE2 MET 8 -5.585 2.135 9.945
50 3HE MET 8 HE3 MET 8 -5.724 1.879 11.684
51 H HIS 9 HN HIS 9 -2.647 -0.126 5.962
52 HA HIS 9 HA HIS 9 -4.438 -2.349 6.350
53 1HB HIS 9 HB2 HIS 9 -3.806 -0.458 4.152
54 2HB HIS 9 HB1 HIS 9 -4.430 -2.034 3.678
55 HD1 HIS 9 HD1 HIS 9 -6.478 -2.418 5.981
56 HD2 HIS 9 HD2 HIS 9 -6.041 1.062 3.753
57 HE1 HIS 9 HE1 HIS 9 -8.681 -1.220 6.167
58 HE2 HIS 9 HE2 HIS 9 -8.363 0.924 4.883
59 H CYS 10 HN CYS 10 -2.018 -1.935 3.779
60 HA CYS 10 HA CYS 10 -1.587 -4.777 3.661
61 1HB CYS 10 HB2 CYS 10 -0.561 -2.410 2.133
62 2HB CYS 10 HB1 CYS 10 0.236 -3.971 1.967
63 H LYS 11 HN LYS 11 0.743 -5.585 3.529
64 HA LYS 11 HA LYS 11 2.049 -4.859 6.011
65 1HB LYS 11 HB2 LYS 11 2.646 -7.012 3.976
66 2HB LYS 11 HB1 LYS 11 3.540 -6.791 5.474
67 1HG LYS 11 HG2 LYS 11 2.098 -8.311 6.267
68 2HG LYS 11 HG1 LYS 11 1.018 -6.925 6.426
69 1HD LYS 11 HD2 LYS 11 0.401 -7.511 3.947
70 2HD LYS 11 HD1 LYS 11 1.033 -9.100 4.382
71 1HE LYS 11 HE2 LYS 11 -0.705 -9.563 5.746
72 2HE LYS 11 HE1 LYS 11 -0.831 -7.901 6.319
73 1HZ LYS 11 HZ1 LYS 11 -2.612 -9.033 4.710
74 2HZ LYS 11 HZ2 LYS 11 -1.586 -8.354 3.550
75 3HZ LYS 11 HZ3 LYS 11 -2.305 -7.369 4.721
76 H GLY 12 HN GLY 12 4.438 -4.610 6.075
77 1HA GLY 12 HA2 GLY 12 5.472 -3.269 3.659
78 2HA GLY 12 HA1 GLY 12 5.606 -2.508 5.237
79 H LYS 13 HN LYS 13 6.305 -5.694 3.797
80 HA LYS 13 HA LYS 13 9.065 -5.466 4.541
81 1HB LYS 13 HB2 LYS 13 8.062 -6.262 6.631
82 2HB LYS 13 HB1 LYS 13 7.349 -7.621 5.773
83 1HG LYS 13 HG2 LYS 13 9.598 -8.446 5.238
84 2HG LYS 13 HG1 LYS 13 10.292 -7.101 6.146
85 1HD LYS 13 HD2 LYS 13 8.564 -8.138 7.970
86 2HD LYS 13 HD1 LYS 13 9.057 -9.592 7.099
87 1HE LYS 13 HE2 LYS 13 11.182 -9.491 7.864
88 2HE LYS 13 HE1 LYS 13 11.222 -7.728 7.830
89 1HZ LYS 13 HZ1 LYS 13 9.493 -8.138 9.803
90 2HZ LYS 13 HZ2 LYS 13 11.160 -7.990 10.050
91 3HZ LYS 13 HZ3 LYS 13 10.450 -9.523 9.978
92 H ASN 14 HN ASN 14 6.495 -7.113 2.927
93 HA ASN 14 HA ASN 14 8.426 -8.272 1.113
94 1HB ASN 14 HB2 ASN 14 6.469 -9.764 2.763
95 2HB ASN 14 HB1 ASN 14 6.568 -10.237 1.069
96 1HD2 ASN 14 1HD2 ASN 14 7.276 -12.263 2.139
97 2HD2 ASN 14 2HD2 ASN 14 8.962 -12.450 2.467
98 H ALA 15 HN ALA 15 6.728 -5.960 1.120
99 HA ALA 15 HA ALA 15 5.704 -6.118 -1.483
100 1HB ALA 15 HB1 ALA 15 3.241 -5.608 -0.518
101 2HB ALA 15 HB2 ALA 15 3.817 -6.769 0.677
102 3HB ALA 15 HB3 ALA 15 3.783 -7.206 -1.031
103 H LYS 16 HN LYS 16 5.713 -4.110 -2.286
104 HA LYS 16 HA LYS 16 5.779 -1.885 -0.380
105 1HB LYS 16 HB2 LYS 16 7.718 -1.952 -1.772
106 2HB LYS 16 HB1 LYS 16 6.746 -2.129 -3.225
107 1HG LYS 16 HG2 LYS 16 5.956 0.122 -3.049
108 2HG LYS 16 HG1 LYS 16 6.712 0.312 -1.466
109 1HD LYS 16 HD2 LYS 16 8.835 -0.446 -2.995
110 2HD LYS 16 HD1 LYS 16 7.882 0.485 -4.153
111 1HE LYS 16 HE2 LYS 16 9.260 2.086 -3.176
112 2HE LYS 16 HE1 LYS 16 7.744 2.257 -2.294
113 1HZ LYS 16 HZ1 LYS 16 9.268 2.211 -0.602
114 2HZ LYS 16 HZ2 LYS 16 10.299 1.126 -1.389
115 3HZ LYS 16 HZ3 LYS 16 8.863 0.570 -0.689
116 HA PRO 17 HA PRO 17 1.713 -0.720 -1.750
117 1HB PRO 17 HB2 PRO 17 1.592 1.714 -0.578
118 2HB PRO 17 HB1 PRO 17 1.454 0.208 0.335
119 1HG PRO 17 HG2 PRO 17 3.825 2.000 -0.018
120 2HG PRO 17 HG1 PRO 17 3.243 1.190 1.448
121 1HD PRO 17 HD2 PRO 17 5.311 0.245 -0.045
122 2HD PRO 17 HD1 PRO 17 4.228 -0.810 0.885
123 H THR 18 HN THR 18 0.848 0.365 -3.435
124 HA THR 18 HA THR 18 2.514 2.386 -4.770
125 HB THR 18 HB THR 18 0.845 1.290 -6.681
126 HG1 THR 18 HG1 THR 18 0.962 -0.848 -6.488
127 1HG2 THR 18 1HG2 THR 18 2.818 0.497 -7.750
128 2HG2 THR 18 2HG2 THR 18 3.714 0.558 -6.232
129 3HG2 THR 18 3HG2 THR 18 3.170 2.052 -6.996
130 H CYS 19 HN CYS 19 1.426 4.080 -5.854
131 HA CYS 19 HA CYS 19 -1.314 4.504 -4.871
132 1HB CYS 19 HB2 CYS 19 0.952 6.409 -5.387
133 2HB CYS 19 HB1 CYS 19 -0.713 6.979 -5.353
134 H ASP 20 HN ASP 20 -2.837 4.344 -6.368
135 HA ASP 20 HA ASP 20 -2.251 5.226 -9.087
136 1HB ASP 20 HB2 ASP 20 -2.401 2.652 -8.602
137 2HB ASP 20 HB1 ASP 20 -4.133 2.962 -8.598
138 H ASP 21 HN ASP 21 -3.367 7.104 -9.161
139 HA ASP 21 HA ASP 21 -5.094 8.586 -9.064
140 1HB ASP 21 HB2 ASP 21 -6.329 6.013 -9.915
141 2HB ASP 21 HB1 ASP 21 -7.415 7.326 -9.470
142 H GLY 22 HN GLY 22 -4.259 8.102 -6.602
143 1HA GLY 22 HA2 GLY 22 -4.871 8.374 -4.424
144 2HA GLY 22 HA1 GLY 22 -6.498 8.643 -5.009
145 H VAL 23 HN VAL 23 -5.185 5.687 -6.035
146 HA VAL 23 HA VAL 23 -6.681 4.271 -3.929
147 HB VAL 23 HB VAL 23 -6.100 3.280 -6.721
148 1HG1 VAL 23 1HG1 VAL 23 -6.519 1.334 -5.653
149 2HG1 VAL 23 2HG1 VAL 23 -8.197 1.837 -5.858
150 3HG1 VAL 23 3HG1 VAL 23 -7.373 2.121 -4.325
151 1HG2 VAL 23 1HG2 VAL 23 -7.638 4.858 -7.258
152 2HG2 VAL 23 2HG2 VAL 23 -8.313 4.913 -5.629
153 3HG2 VAL 23 3HG2 VAL 23 -8.753 3.600 -6.722
154 H CYS 24 HN CYS 24 -5.186 3.652 -2.470
155 HA CYS 24 HA CYS 24 -2.531 2.873 -3.207
156 1HB CYS 24 HB2 CYS 24 -3.567 3.850 -0.930
157 2HB CYS 24 HB1 CYS 24 -3.598 2.134 -0.536
158 H ASN 25 HN ASN 25 -1.633 0.851 -3.302
159 HA ASN 25 HA ASN 25 -3.095 -1.498 -2.562
160 1HB ASN 25 HB2 ASN 25 -3.342 -0.508 -5.232
161 2HB ASN 25 HB1 ASN 25 -2.479 -2.041 -5.260
162 1HD2 ASN 25 1HD2 ASN 25 -5.238 -1.190 -6.078
163 2HD2 ASN 25 2HD2 ASN 25 -6.286 -2.325 -5.304
164 H CYS 26 HN CYS 26 -1.667 -2.916 -1.854
165 HA CYS 26 HA CYS 26 1.148 -2.524 -2.364
166 1HB CYS 26 HB2 CYS 26 1.427 -4.425 -0.764
167 2HB CYS 26 HB1 CYS 26 0.506 -3.075 -0.110
168 H ASN 27 HN ASN 27 2.539 -3.941 -3.394
169 HA ASN 27 HA ASN 27 1.274 -6.116 -4.917
170 1HB ASN 27 HB2 ASN 27 3.274 -4.070 -5.853
171 2HB ASN 27 HB1 ASN 27 3.009 -5.585 -6.711
172 1HD2 ASN 27 1HD2 ASN 27 2.590 -3.421 -8.131
173 2HD2 ASN 27 2HD2 ASN 27 0.906 -3.103 -8.350
174 H VAL 28 HN VAL 28 4.630 -5.099 -4.799
175 HA VAL 28 HA VAL 28 5.397 -7.284 -3.074
176 HB VAL 28 HB VAL 28 5.213 -8.426 -5.237
177 1HG1 VAL 28 1HG1 VAL 28 7.300 -7.590 -6.782
178 2HG1 VAL 28 2HG1 VAL 28 6.677 -6.064 -6.154
179 3HG1 VAL 28 3HG1 VAL 28 5.611 -7.155 -7.038
180 1HG2 VAL 28 1HG2 VAL 28 6.968 -9.036 -3.559
181 2HG2 VAL 28 2HG2 VAL 28 8.112 -8.076 -4.497
182 3HG2 VAL 28 3HG2 VAL 28 7.349 -9.492 -5.220
Start of MODEL 11
1 1H VAL 1 HT1 VAL 1 -8.450 5.424 -1.332
2 2H VAL 1 HT2 VAL 1 -9.904 5.972 -0.602
3 3H VAL 1 HT3 VAL 1 -9.649 4.294 -0.858
4 HA VAL 1 HA VAL 1 -9.319 5.316 1.443
5 HB VAL 1 HB VAL 1 -7.488 3.682 1.883
6 1HG1 VAL 1 1HG1 VAL 1 -8.800 1.751 1.456
7 2HG1 VAL 1 2HG1 VAL 1 -9.606 2.518 0.088
8 3HG1 VAL 1 3HG1 VAL 1 -9.927 3.080 1.729
9 1HG2 VAL 1 1HG2 VAL 1 -7.317 3.798 -1.067
10 2HG2 VAL 1 2HG2 VAL 1 -7.144 2.207 -0.327
11 3HG2 VAL 1 3HG2 VAL 1 -6.057 3.516 0.134
12 H GLY 2 HN GLY 2 -7.577 6.022 2.840
13 1HA GLY 2 HA2 GLY 2 -6.188 8.257 1.769
14 2HA GLY 2 HA1 GLY 2 -6.017 7.617 3.396
15 H CYS 3 HN CYS 3 -4.379 8.248 0.631
16 HA CYS 3 HA CYS 3 -2.758 6.011 0.210
17 1HB CYS 3 HB2 CYS 3 -2.615 8.895 -0.422
18 2HB CYS 3 HB1 CYS 3 -1.072 8.048 -0.397
19 H GLU 4 HN GLU 4 -2.681 8.456 2.686
20 HA GLU 4 HA GLU 4 -0.051 7.646 3.611
21 1HB GLU 4 HB2 GLU 4 -1.113 10.049 3.605
22 2HB GLU 4 HB1 GLU 4 -1.816 9.512 5.124
23 1HG GLU 4 HG2 GLU 4 0.261 9.307 6.155
24 2HG GLU 4 HG1 GLU 4 1.125 9.288 4.619
25 H GLU 5 HN GLU 5 -2.942 6.311 3.862
26 HA GLU 5 HA GLU 5 -2.486 5.357 6.602
27 1HB GLU 5 HB2 GLU 5 -4.982 6.146 5.198
28 2HB GLU 5 HB1 GLU 5 -5.076 4.780 6.301
29 1HG GLU 5 HG2 GLU 5 -3.763 7.270 7.247
30 2HG GLU 5 HG1 GLU 5 -5.520 7.244 7.105
31 H CYS 6 HN CYS 6 -1.947 4.429 3.603
32 HA CYS 6 HA CYS 6 -3.202 1.858 3.585
33 1HB CYS 6 HB2 CYS 6 -1.004 2.884 1.802
34 2HB CYS 6 HB1 CYS 6 -2.014 1.474 1.506
35 HA PRO 7 HA PRO 7 1.602 0.759 4.378
36 1HB PRO 7 HB2 PRO 7 1.807 2.859 6.489
37 2HB PRO 7 HB1 PRO 7 3.051 2.233 5.401
38 1HG PRO 7 HG2 PRO 7 1.920 4.608 4.962
39 2HG PRO 7 HG1 PRO 7 2.333 3.527 3.619
40 1HD PRO 7 HD2 PRO 7 -0.334 4.151 4.794
41 2HD PRO 7 HD1 PRO 7 0.095 3.754 3.123
42 H MET 8 HN MET 8 -0.908 1.828 6.573
43 HA MET 8 HA MET 8 -0.108 0.048 8.696
44 1HB MET 8 HB2 MET 8 -1.451 2.331 8.779
45 2HB MET 8 HB1 MET 8 -2.832 1.259 8.589
46 1HG MET 8 HG2 MET 8 -0.795 0.694 10.692
47 2HG MET 8 HG1 MET 8 -2.018 1.935 10.958
48 1HE MET 8 HE1 MET 8 -4.310 1.504 9.995
49 2HE MET 8 HE2 MET 8 -5.173 0.592 11.233
50 3HE MET 8 HE3 MET 8 -4.972 -0.086 9.618
51 H HIS 9 HN HIS 9 -2.234 -0.047 5.951
52 HA HIS 9 HA HIS 9 -3.789 -2.277 6.855
53 1HB HIS 9 HB2 HIS 9 -3.449 -0.993 4.143
54 2HB HIS 9 HB1 HIS 9 -4.526 -2.353 4.437
55 HD1 HIS 9 HD1 HIS 9 -5.880 -1.513 7.019
56 HD2 HIS 9 HD2 HIS 9 -5.147 1.100 3.873
57 HE1 HIS 9 HE1 HIS 9 -7.539 0.355 7.297
58 HE2 HIS 9 HE2 HIS 9 -7.129 1.884 5.337
59 H CYS 10 HN CYS 10 -1.855 -2.174 3.879
60 HA CYS 10 HA CYS 10 -1.244 -4.986 4.168
61 1HB CYS 10 HB2 CYS 10 -1.731 -3.480 1.993
62 2HB CYS 10 HB1 CYS 10 0.027 -3.396 2.010
63 H LYS 11 HN LYS 11 0.431 -5.679 5.307
64 HA LYS 11 HA LYS 11 3.005 -4.355 5.051
65 1HB LYS 11 HB2 LYS 11 1.408 -4.420 7.554
66 2HB LYS 11 HB1 LYS 11 3.140 -4.683 7.682
67 1HG LYS 11 HG2 LYS 11 2.271 -2.375 6.061
68 2HG LYS 11 HG1 LYS 11 2.019 -2.268 7.804
69 1HD LYS 11 HD2 LYS 11 4.201 -1.976 8.197
70 2HD LYS 11 HD1 LYS 11 4.651 -3.302 7.124
71 1HE LYS 11 HE2 LYS 11 3.686 -0.871 5.779
72 2HE LYS 11 HE1 LYS 11 5.205 -0.690 6.655
73 1HZ LYS 11 HZ1 LYS 11 4.756 -2.910 4.753
74 2HZ LYS 11 HZ2 LYS 11 6.224 -2.329 5.359
75 3HZ LYS 11 HZ3 LYS 11 5.344 -1.407 4.246
76 H GLY 12 HN GLY 12 4.463 -5.874 4.664
77 1HA GLY 12 HA2 GLY 12 4.268 -8.432 6.088
78 2HA GLY 12 HA1 GLY 12 4.374 -8.443 4.334
79 H LYS 13 HN LYS 13 6.314 -7.834 3.328
80 HA LYS 13 HA LYS 13 8.584 -7.058 4.877
81 1HB LYS 13 HB2 LYS 13 8.082 -9.786 4.693
82 2HB LYS 13 HB1 LYS 13 9.310 -9.494 3.470
83 1HG LYS 13 HG2 LYS 13 10.555 -8.230 5.342
84 2HG LYS 13 HG1 LYS 13 9.466 -9.095 6.429
85 1HD LYS 13 HD2 LYS 13 10.525 -11.053 6.122
86 2HD LYS 13 HD1 LYS 13 10.721 -10.784 4.389
87 1HE LYS 13 HE2 LYS 13 12.867 -10.908 5.642
88 2HE LYS 13 HE1 LYS 13 12.640 -9.401 4.755
89 1HZ LYS 13 HZ1 LYS 13 11.895 -8.377 6.851
90 2HZ LYS 13 HZ2 LYS 13 13.492 -8.926 6.928
91 3HZ LYS 13 HZ3 LYS 13 12.257 -9.812 7.670
92 H ASN 14 HN ASN 14 7.369 -8.298 1.814
93 HA ASN 14 HA ASN 14 9.132 -6.425 0.447
94 1HB ASN 14 HB2 ASN 14 8.518 -9.285 -0.247
95 2HB ASN 14 HB1 ASN 14 9.009 -8.141 -1.492
96 1HD2 ASN 14 1HD2 ASN 14 9.985 -9.905 1.331
97 2HD2 ASN 14 2HD2 ASN 14 11.683 -9.633 1.164
98 H ALA 15 HN ALA 15 6.485 -6.066 1.418
99 HA ALA 15 HA ALA 15 5.083 -5.665 -1.133
100 1HB ALA 15 HB1 ALA 15 3.327 -5.956 1.180
101 2HB ALA 15 HB2 ALA 15 4.248 -7.411 0.798
102 3HB ALA 15 HB3 ALA 15 3.216 -6.674 -0.428
103 H LYS 16 HN LYS 16 5.302 -3.525 -1.463
104 HA LYS 16 HA LYS 16 4.739 -1.726 0.791
105 1HB LYS 16 HB2 LYS 16 6.915 -1.292 -0.016
106 2HB LYS 16 HB1 LYS 16 6.396 -1.351 -1.693
107 1HG LYS 16 HG2 LYS 16 6.718 0.909 -1.296
108 2HG LYS 16 HG1 LYS 16 4.976 0.715 -1.098
109 1HD LYS 16 HD2 LYS 16 5.333 1.837 0.826
110 2HD LYS 16 HD1 LYS 16 5.812 0.249 1.428
111 1HE LYS 16 HE2 LYS 16 8.142 0.746 0.941
112 2HE LYS 16 HE1 LYS 16 7.684 2.311 0.270
113 1HZ LYS 16 HZ1 LYS 16 8.174 2.987 2.347
114 2HZ LYS 16 HZ2 LYS 16 7.896 1.472 3.045
115 3HZ LYS 16 HZ3 LYS 16 6.592 2.486 2.680
116 HA PRO 17 HA PRO 17 0.914 -0.676 -1.202
117 1HB PRO 17 HB2 PRO 17 1.049 1.840 0.317
118 2HB PRO 17 HB1 PRO 17 -0.147 0.545 0.398
119 1HG PRO 17 HG2 PRO 17 1.628 0.968 2.375
120 2HG PRO 17 HG1 PRO 17 1.060 -0.657 1.949
121 1HD PRO 17 HD2 PRO 17 3.647 0.687 1.270
122 2HD PRO 17 HD1 PRO 17 3.337 -1.000 1.729
123 H THR 18 HN THR 18 0.531 0.253 -3.111
124 HA THR 18 HA THR 18 2.166 2.567 -3.899
125 HB THR 18 HB THR 18 1.114 1.431 -6.194
126 HG1 THR 18 HG1 THR 18 1.539 -0.702 -6.068
127 1HG2 THR 18 1HG2 THR 18 3.379 0.877 -6.769
128 2HG2 THR 18 2HG2 THR 18 3.869 1.045 -5.083
129 3HG2 THR 18 3HG2 THR 18 3.319 2.457 -5.986
130 H CYS 19 HN CYS 19 1.201 4.299 -4.907
131 HA CYS 19 HA CYS 19 -1.729 4.351 -4.721
132 1HB CYS 19 HB2 CYS 19 0.334 6.542 -4.548
133 2HB CYS 19 HB1 CYS 19 -1.383 6.876 -4.746
134 H ASP 20 HN ASP 20 -2.762 4.169 -6.589
135 HA ASP 20 HA ASP 20 -1.626 5.432 -8.962
136 1HB ASP 20 HB2 ASP 20 -1.518 2.818 -8.753
137 2HB ASP 20 HB1 ASP 20 -3.216 2.918 -9.198
138 H ASP 21 HN ASP 21 -2.945 7.144 -9.233
139 HA ASP 21 HA ASP 21 -4.835 8.392 -9.483
140 1HB ASP 21 HB2 ASP 21 -5.425 5.797 -10.820
141 2HB ASP 21 HB1 ASP 21 -6.766 6.914 -10.589
142 H GLY 22 HN GLY 22 -4.594 7.737 -6.929
143 1HA GLY 22 HA2 GLY 22 -5.784 7.717 -4.985
144 2HA GLY 22 HA1 GLY 22 -7.228 7.826 -5.968
145 H VAL 23 HN VAL 23 -5.233 5.190 -6.763
146 HA VAL 23 HA VAL 23 -7.014 3.381 -5.269
147 HB VAL 23 HB VAL 23 -5.487 2.753 -7.798
148 1HG1 VAL 23 1HG1 VAL 23 -7.169 0.842 -7.842
149 2HG1 VAL 23 2HG1 VAL 23 -7.499 1.241 -6.156
150 3HG1 VAL 23 3HG1 VAL 23 -5.879 0.742 -6.644
151 1HG2 VAL 23 1HG2 VAL 23 -8.313 3.675 -7.371
152 2HG2 VAL 23 2HG2 VAL 23 -7.832 2.765 -8.803
153 3HG2 VAL 23 3HG2 VAL 23 -7.093 4.330 -8.464
154 H CYS 24 HN CYS 24 -5.909 2.907 -3.444
155 HA CYS 24 HA CYS 24 -3.061 2.472 -3.464
156 1HB CYS 24 HB2 CYS 24 -4.975 3.147 -1.524
157 2HB CYS 24 HB1 CYS 24 -4.366 1.566 -1.047
158 H ASN 25 HN ASN 25 -1.994 0.578 -3.523
159 HA ASN 25 HA ASN 25 -3.255 -1.916 -2.896
160 1HB ASN 25 HB2 ASN 25 -3.257 -0.990 -5.612
161 2HB ASN 25 HB1 ASN 25 -2.286 -2.450 -5.477
162 1HD2 ASN 25 1HD2 ASN 25 -3.620 -3.784 -3.484
163 2HD2 ASN 25 2HD2 ASN 25 -5.197 -4.221 -4.039
164 H CYS 26 HN CYS 26 -1.763 -3.142 -1.979
165 HA CYS 26 HA CYS 26 1.022 -2.427 -2.149
166 1HB CYS 26 HB2 CYS 26 1.325 -4.335 -0.549
167 2HB CYS 26 HB1 CYS 26 0.198 -3.101 0.003
168 H ASN 27 HN ASN 27 2.564 -3.358 -3.350
169 HA ASN 27 HA ASN 27 1.874 -5.820 -4.806
170 1HB ASN 27 HB2 ASN 27 3.309 -3.358 -5.771
171 2HB ASN 27 HB1 ASN 27 3.437 -4.902 -6.609
172 1HD2 ASN 27 1HD2 ASN 27 2.221 -2.254 -7.313
173 2HD2 ASN 27 2HD2 ASN 27 0.616 -2.636 -7.823
174 H VAL 28 HN VAL 28 4.937 -4.143 -4.919
175 HA VAL 28 HA VAL 28 6.175 -6.428 -3.531
176 HB VAL 28 HB VAL 28 7.473 -4.697 -5.640
177 1HG1 VAL 28 1HG1 VAL 28 8.348 -7.103 -4.081
178 2HG1 VAL 28 2HG1 VAL 28 9.187 -5.572 -4.328
179 3HG1 VAL 28 3HG1 VAL 28 9.055 -6.728 -5.653
180 1HG2 VAL 28 1HG2 VAL 28 6.936 -7.514 -6.261
181 2HG2 VAL 28 2HG2 VAL 28 6.772 -6.076 -7.269
182 3HG2 VAL 28 3HG2 VAL 28 5.497 -6.504 -6.129
Start of MODEL 12
1 1H VAL 1 HT1 VAL 1 -11.057 2.980 2.717
2 2H VAL 1 HT2 VAL 1 -10.670 2.971 1.044
3 3H VAL 1 HT3 VAL 1 -11.020 4.452 1.839
4 HA VAL 1 HA VAL 1 -9.094 4.130 3.240
5 HB VAL 1 HB VAL 1 -7.401 2.477 2.494
6 1HG1 VAL 1 1HG1 VAL 1 -9.985 1.130 3.252
7 2HG1 VAL 1 2HG1 VAL 1 -9.005 2.068 4.380
8 3HG1 VAL 1 3HG1 VAL 1 -8.343 0.613 3.635
9 1HG2 VAL 1 1HG2 VAL 1 -7.700 1.017 0.791
10 2HG2 VAL 1 2HG2 VAL 1 -8.803 2.268 0.217
11 3HG2 VAL 1 3HG2 VAL 1 -9.433 0.866 1.080
12 H GLY 2 HN GLY 2 -6.890 4.759 2.459
13 1HA GLY 2 HA2 GLY 2 -6.807 5.633 -0.330
14 2HA GLY 2 HA1 GLY 2 -6.737 6.882 0.904
15 H CYS 3 HN CYS 3 -4.660 7.194 -0.398
16 HA CYS 3 HA CYS 3 -2.516 5.365 0.005
17 1HB CYS 3 HB2 CYS 3 -2.786 8.135 -1.074
18 2HB CYS 3 HB1 CYS 3 -1.182 7.566 -0.626
19 H GLU 4 HN GLU 4 -3.911 7.866 1.919
20 HA GLU 4 HA GLU 4 -1.565 8.245 3.561
21 1HB GLU 4 HB2 GLU 4 -4.383 9.279 3.734
22 2HB GLU 4 HB1 GLU 4 -3.164 9.638 4.948
23 1HG GLU 4 HG2 GLU 4 -1.767 10.482 2.938
24 2HG GLU 4 HG1 GLU 4 -3.321 10.537 2.106
25 H GLU 5 HN GLU 5 -3.602 5.791 3.312
26 HA GLU 5 HA GLU 5 -3.374 5.102 6.153
27 1HB GLU 5 HB2 GLU 5 -5.760 4.876 4.356
28 2HB GLU 5 HB1 GLU 5 -5.552 3.735 5.678
29 1HG GLU 5 HG2 GLU 5 -5.814 5.358 7.297
30 2HG GLU 5 HG1 GLU 5 -5.386 6.669 6.199
31 H CYS 6 HN CYS 6 -1.684 4.465 3.840
32 HA CYS 6 HA CYS 6 -2.168 1.738 3.160
33 1HB CYS 6 HB2 CYS 6 -0.625 3.770 2.095
34 2HB CYS 6 HB1 CYS 6 0.562 2.638 2.735
35 HA PRO 7 HA PRO 7 1.839 1.296 6.103
36 1HB PRO 7 HB2 PRO 7 0.796 3.381 7.974
37 2HB PRO 7 HB1 PRO 7 2.467 2.934 7.607
38 1HG PRO 7 HG2 PRO 7 1.373 5.137 6.567
39 2HG PRO 7 HG1 PRO 7 2.496 4.136 5.629
40 1HD PRO 7 HD2 PRO 7 -0.455 4.401 5.380
41 2HD PRO 7 HD1 PRO 7 0.750 4.020 4.141
42 H MET 8 HN MET 8 -1.485 2.019 6.976
43 HA MET 8 HA MET 8 -1.468 0.275 9.275
44 1HB MET 8 HB2 MET 8 -2.985 2.408 8.632
45 2HB MET 8 HB1 MET 8 -4.045 1.119 8.081
46 1HG MET 8 HG2 MET 8 -2.920 1.437 10.854
47 2HG MET 8 HG1 MET 8 -4.577 1.765 10.351
48 1HE MET 8 HE1 MET 8 -6.165 -0.276 9.281
49 2HE MET 8 HE2 MET 8 -6.337 0.249 10.956
50 3HE MET 8 HE3 MET 8 -6.351 -1.470 10.565
51 H HIS 9 HN HIS 9 -2.551 0.147 5.930
52 HA HIS 9 HA HIS 9 -3.538 -2.583 6.324
53 1HB HIS 9 HB2 HIS 9 -3.916 -0.517 4.180
54 2HB HIS 9 HB1 HIS 9 -4.218 -2.215 3.830
55 HD1 HIS 9 HD1 HIS 9 -5.595 -3.023 6.473
56 HD2 HIS 9 HD2 HIS 9 -6.468 0.427 4.329
57 HE1 HIS 9 HE1 HIS 9 -7.929 -2.382 7.153
58 HE2 HIS 9 HE2 HIS 9 -8.468 -0.341 5.777
59 H CYS 10 HN CYS 10 -3.094 -4.036 4.315
60 HA CYS 10 HA CYS 10 -1.570 -5.317 3.211
61 1HB CYS 10 HB2 CYS 10 -1.336 -2.733 2.229
62 2HB CYS 10 HB1 CYS 10 0.327 -3.197 2.569
63 H LYS 11 HN LYS 11 1.088 -5.398 2.927
64 HA LYS 11 HA LYS 11 2.033 -5.616 5.699
65 1HB LYS 11 HB2 LYS 11 3.132 -6.933 3.209
66 2HB LYS 11 HB1 LYS 11 3.643 -7.243 4.863
67 1HG LYS 11 HG2 LYS 11 0.904 -7.682 4.899
68 2HG LYS 11 HG1 LYS 11 1.443 -8.366 3.365
69 1HD LYS 11 HD2 LYS 11 3.119 -8.982 5.715
70 2HD LYS 11 HD1 LYS 11 1.506 -9.700 5.707
71 1HE LYS 11 HE2 LYS 11 2.001 -10.532 3.389
72 2HE LYS 11 HE1 LYS 11 3.664 -9.997 3.627
73 1HZ LYS 11 HZ1 LYS 11 3.861 -12.126 4.328
74 2HZ LYS 11 HZ2 LYS 11 2.248 -12.252 4.821
75 3HZ LYS 11 HZ3 LYS 11 3.370 -11.448 5.799
76 H GLY 12 HN GLY 12 4.356 -5.186 6.083
77 1HA GLY 12 HA2 GLY 12 5.443 -3.145 4.255
78 2HA GLY 12 HA1 GLY 12 5.323 -2.820 5.977
79 H LYS 13 HN LYS 13 6.460 -5.584 4.030
80 HA LYS 13 HA LYS 13 9.149 -5.229 4.899
81 1HB LYS 13 HB2 LYS 13 7.398 -6.870 6.466
82 2HB LYS 13 HB1 LYS 13 8.649 -7.874 5.748
83 1HG LYS 13 HG2 LYS 13 10.314 -6.181 6.648
84 2HG LYS 13 HG1 LYS 13 8.974 -5.533 7.596
85 1HD LYS 13 HD2 LYS 13 8.649 -7.704 8.650
86 2HD LYS 13 HD1 LYS 13 9.946 -8.390 7.668
87 1HE LYS 13 HE2 LYS 13 10.333 -6.083 9.565
88 2HE LYS 13 HE1 LYS 13 10.583 -7.768 10.021
89 1HZ LYS 13 HZ1 LYS 13 12.378 -7.968 8.570
90 2HZ LYS 13 HZ2 LYS 13 12.597 -6.442 9.264
91 3HZ LYS 13 HZ3 LYS 13 11.970 -6.576 7.699
92 H ASN 14 HN ASN 14 6.748 -7.213 3.313
93 HA ASN 14 HA ASN 14 8.744 -7.930 1.335
94 1HB ASN 14 HB2 ASN 14 7.894 -9.800 3.102
95 2HB ASN 14 HB1 ASN 14 6.659 -9.966 1.858
96 1HD2 ASN 14 1HD2 ASN 14 10.154 -9.887 2.349
97 2HD2 ASN 14 2HD2 ASN 14 10.539 -10.971 1.059
98 H ALA 15 HN ALA 15 6.745 -5.883 1.534
99 HA ALA 15 HA ALA 15 5.492 -6.293 -1.013
100 1HB ALA 15 HB1 ALA 15 3.326 -6.570 -0.450
101 2HB ALA 15 HB2 ALA 15 3.466 -5.571 0.997
102 3HB ALA 15 HB3 ALA 15 4.021 -7.245 1.024
103 H LYS 16 HN LYS 16 5.705 -4.418 -2.043
104 HA LYS 16 HA LYS 16 5.915 -1.961 -0.467
105 1HB LYS 16 HB2 LYS 16 7.771 -2.203 -1.901
106 2HB LYS 16 HB1 LYS 16 6.768 -2.692 -3.258
107 1HG LYS 16 HG2 LYS 16 6.184 -0.543 -3.778
108 2HG LYS 16 HG1 LYS 16 6.380 0.027 -2.119
109 1HD LYS 16 HD2 LYS 16 8.837 -0.947 -3.411
110 2HD LYS 16 HD1 LYS 16 8.141 0.510 -4.122
111 1HE LYS 16 HE2 LYS 16 8.141 1.586 -1.931
112 2HE LYS 16 HE1 LYS 16 8.812 0.125 -1.206
113 1HZ LYS 16 HZ1 LYS 16 10.112 2.005 -3.081
114 2HZ LYS 16 HZ2 LYS 16 10.710 0.441 -2.841
115 3HZ LYS 16 HZ3 LYS 16 10.630 1.523 -1.544
116 HA PRO 17 HA PRO 17 1.842 -0.854 -1.899
117 1HB PRO 17 HB2 PRO 17 1.638 1.519 -0.682
118 2HB PRO 17 HB1 PRO 17 1.641 0.011 0.241
119 1HG PRO 17 HG2 PRO 17 3.867 1.958 -0.214
120 2HG PRO 17 HG1 PRO 17 3.408 1.112 1.274
121 1HD PRO 17 HD2 PRO 17 5.452 0.318 -0.392
122 2HD PRO 17 HD1 PRO 17 4.576 -0.768 0.703
123 H THR 18 HN THR 18 0.886 0.465 -3.439
124 HA THR 18 HA THR 18 2.589 2.477 -4.722
125 HB THR 18 HB THR 18 2.425 0.173 -5.915
126 HG1 THR 18 HG1 THR 18 2.026 2.687 -7.138
127 1HG2 THR 18 1HG2 THR 18 0.152 1.213 -7.406
128 2HG2 THR 18 2HG2 THR 18 -0.243 0.615 -5.797
129 3HG2 THR 18 3HG2 THR 18 0.561 -0.443 -6.956
130 H CYS 19 HN CYS 19 1.566 4.290 -5.497
131 HA CYS 19 HA CYS 19 -1.215 4.594 -4.629
132 1HB CYS 19 HB2 CYS 19 1.052 6.490 -5.072
133 2HB CYS 19 HB1 CYS 19 -0.598 7.091 -5.197
134 H ASP 20 HN ASP 20 -2.749 4.380 -6.105
135 HA ASP 20 HA ASP 20 -2.239 5.313 -8.825
136 1HB ASP 20 HB2 ASP 20 -2.354 2.731 -8.369
137 2HB ASP 20 HB1 ASP 20 -4.088 3.024 -8.318
138 H ASP 21 HN ASP 21 -3.382 7.174 -8.874
139 HA ASP 21 HA ASP 21 -5.119 8.640 -8.703
140 1HB ASP 21 HB2 ASP 21 -6.406 6.052 -9.475
141 2HB ASP 21 HB1 ASP 21 -7.436 7.424 -9.075
142 H GLY 22 HN GLY 22 -4.183 8.128 -6.281
143 1HA GLY 22 HA2 GLY 22 -4.707 8.362 -4.076
144 2HA GLY 22 HA1 GLY 22 -6.356 8.640 -4.591
145 H VAL 23 HN VAL 23 -4.999 5.697 -5.669
146 HA VAL 23 HA VAL 23 -6.416 4.244 -3.531
147 HB VAL 23 HB VAL 23 -6.039 3.338 -6.385
148 1HG1 VAL 23 1HG1 VAL 23 -7.877 1.716 -5.660
149 2HG1 VAL 23 2HG1 VAL 23 -7.458 2.173 -4.009
150 3HG1 VAL 23 3HG1 VAL 23 -6.248 1.422 -5.050
151 1HG2 VAL 23 1HG2 VAL 23 -7.628 4.893 -6.783
152 2HG2 VAL 23 2HG2 VAL 23 -8.134 4.963 -5.095
153 3HG2 VAL 23 3HG2 VAL 23 -8.700 3.654 -6.132
154 H CYS 24 HN CYS 24 -4.913 3.427 -2.202
155 HA CYS 24 HA CYS 24 -2.263 2.788 -3.025
156 1HB CYS 24 HB2 CYS 24 -3.596 3.155 -0.585
157 2HB CYS 24 HB1 CYS 24 -3.044 1.483 -0.557
158 H ASN 25 HN ASN 25 -1.316 0.818 -3.434
159 HA ASN 25 HA ASN 25 -2.743 -1.644 -3.115
160 1HB ASN 25 HB2 ASN 25 -2.989 -0.230 -5.581
161 2HB ASN 25 HB1 ASN 25 -2.077 -1.709 -5.859
162 1HD2 ASN 25 1HD2 ASN 25 -3.176 -3.474 -4.172
163 2HD2 ASN 25 2HD2 ASN 25 -4.844 -3.726 -4.545
164 H CYS 26 HN CYS 26 -1.309 -3.151 -2.647
165 HA CYS 26 HA CYS 26 1.497 -2.646 -2.890
166 1HB CYS 26 HB2 CYS 26 -0.101 -5.003 -1.897
167 2HB CYS 26 HB1 CYS 26 1.657 -5.029 -1.975
168 H ASN 27 HN ASN 27 3.031 -3.994 -3.990
169 HA ASN 27 HA ASN 27 1.930 -5.202 -6.433
170 1HB ASN 27 HB2 ASN 27 3.679 -3.114 -6.278
171 2HB ASN 27 HB1 ASN 27 4.778 -4.479 -6.444
172 1HD2 ASN 27 1HD2 ASN 27 2.468 -2.474 -7.986
173 2HD2 ASN 27 2HD2 ASN 27 2.592 -3.164 -9.565
174 H VAL 28 HN VAL 28 5.001 -5.386 -4.715
175 HA VAL 28 HA VAL 28 4.668 -8.254 -4.333
176 HB VAL 28 HB VAL 28 5.739 -8.080 -6.535
177 1HG1 VAL 28 1HG1 VAL 28 8.283 -7.063 -5.465
178 2HG1 VAL 28 2HG1 VAL 28 6.985 -5.875 -5.590
179 3HG1 VAL 28 3HG1 VAL 28 7.503 -6.769 -7.019
180 1HG2 VAL 28 1HG2 VAL 28 7.095 -9.842 -6.150
181 2HG2 VAL 28 2HG2 VAL 28 6.440 -9.725 -4.517
182 3HG2 VAL 28 3HG2 VAL 28 8.005 -9.004 -4.894
Start of MODEL 13
1 1H VAL 1 HT1 VAL 1 -10.055 6.923 -1.106
2 2H VAL 1 HT2 VAL 1 -10.803 5.445 -0.658
3 3H VAL 1 HT3 VAL 1 -9.617 5.467 -1.898
4 HA VAL 1 HA VAL 1 -9.319 5.715 0.990
5 HB VAL 1 HB VAL 1 -7.497 4.332 -0.957
6 1HG1 VAL 1 1HG1 VAL 1 -6.467 4.199 1.062
7 2HG1 VAL 1 2HG1 VAL 1 -7.520 2.793 1.215
8 3HG1 VAL 1 3HG1 VAL 1 -7.977 4.322 1.966
9 1HG2 VAL 1 1HG2 VAL 1 -8.925 2.255 -0.236
10 2HG2 VAL 1 2HG2 VAL 1 -9.422 3.250 -1.604
11 3HG2 VAL 1 3HG2 VAL 1 -10.197 3.459 -0.034
12 H GLY 2 HN GLY 2 -7.086 6.231 1.721
13 1HA GLY 2 HA2 GLY 2 -5.923 8.371 0.045
14 2HA GLY 2 HA1 GLY 2 -6.043 8.480 1.794
15 H CYS 3 HN CYS 3 -3.649 8.793 0.332
16 HA CYS 3 HA CYS 3 -2.108 6.406 0.339
17 1HB CYS 3 HB2 CYS 3 -1.770 8.953 -0.657
18 2HB CYS 3 HB1 CYS 3 -0.592 8.893 0.649
19 H GLU 4 HN GLU 4 -3.216 8.370 2.854
20 HA GLU 4 HA GLU 4 -0.977 7.904 4.618
21 1HB GLU 4 HB2 GLU 4 -2.608 9.942 4.565
22 2HB GLU 4 HB1 GLU 4 -3.640 8.900 5.534
23 1HG GLU 4 HG2 GLU 4 -0.819 9.223 6.384
24 2HG GLU 4 HG1 GLU 4 -1.915 10.584 6.619
25 H GLU 5 HN GLU 5 -3.251 5.944 3.511
26 HA GLU 5 HA GLU 5 -3.410 4.417 6.014
27 1HB GLU 5 HB2 GLU 5 -5.494 4.816 3.883
28 2HB GLU 5 HB1 GLU 5 -5.559 3.453 4.993
29 1HG GLU 5 HG2 GLU 5 -6.268 4.714 6.698
30 2HG GLU 5 HG1 GLU 5 -5.190 6.049 6.292
31 H CYS 6 HN CYS 6 -1.588 4.411 3.544
32 HA CYS 6 HA CYS 6 -2.082 1.860 2.345
33 1HB CYS 6 HB2 CYS 6 -0.086 4.017 2.000
34 2HB CYS 6 HB1 CYS 6 0.390 2.398 1.500
35 HA PRO 7 HA PRO 7 1.691 0.599 4.994
36 1HB PRO 7 HB2 PRO 7 2.566 2.298 6.898
37 2HB PRO 7 HB1 PRO 7 3.097 2.407 5.217
38 1HG PRO 7 HG2 PRO 7 1.124 4.073 6.694
39 2HG PRO 7 HG1 PRO 7 2.260 4.539 5.418
40 1HD PRO 7 HD2 PRO 7 -0.460 4.034 5.068
41 2HD PRO 7 HD1 PRO 7 0.747 4.065 3.776
42 H MET 8 HN MET 8 -0.733 -0.182 5.539
43 HA MET 8 HA MET 8 -0.688 -1.012 8.216
44 1HB MET 8 HB2 MET 8 -1.373 1.395 8.538
45 2HB MET 8 HB1 MET 8 -2.851 1.023 7.662
46 1HG MET 8 HG2 MET 8 -3.795 0.083 9.441
47 2HG MET 8 HG1 MET 8 -2.345 -0.840 9.829
48 1HE MET 8 HE1 MET 8 -0.199 0.926 11.828
49 2HE MET 8 HE2 MET 8 -0.309 2.372 10.823
50 3HE MET 8 HE3 MET 8 -0.249 0.778 10.071
51 H HIS 9 HN HIS 9 -2.715 -0.285 5.422
52 HA HIS 9 HA HIS 9 -4.650 -2.303 5.931
53 1HB HIS 9 HB2 HIS 9 -4.160 -0.277 3.938
54 2HB HIS 9 HB1 HIS 9 -4.597 -1.792 3.160
55 HD1 HIS 9 HD1 HIS 9 -6.740 -2.876 4.974
56 HD2 HIS 9 HD2 HIS 9 -6.445 1.146 3.983
57 HE1 HIS 9 HE1 HIS 9 -9.042 -1.927 5.329
58 HE2 HIS 9 HE2 HIS 9 -8.861 0.489 4.635
59 H CYS 10 HN CYS 10 -1.655 -2.180 4.086
60 HA CYS 10 HA CYS 10 -1.950 -5.054 3.503
61 1HB CYS 10 HB2 CYS 10 -0.872 -2.789 1.936
62 2HB CYS 10 HB1 CYS 10 0.058 -4.281 1.853
63 H LYS 11 HN LYS 11 0.222 -6.196 3.315
64 HA LYS 11 HA LYS 11 1.589 -5.930 5.798
65 1HB LYS 11 HB2 LYS 11 2.246 -7.597 3.362
66 2HB LYS 11 HB1 LYS 11 3.035 -7.750 4.926
67 1HG LYS 11 HG2 LYS 11 0.426 -7.995 5.630
68 2HG LYS 11 HG1 LYS 11 0.424 -8.726 4.024
69 1HD LYS 11 HD2 LYS 11 1.645 -10.502 4.693
70 2HD LYS 11 HD1 LYS 11 2.653 -9.531 5.768
71 1HE LYS 11 HE2 LYS 11 0.783 -9.445 7.381
72 2HE LYS 11 HE1 LYS 11 -0.150 -10.498 6.319
73 1HZ LYS 11 HZ1 LYS 11 2.508 -11.397 7.149
74 2HZ LYS 11 HZ2 LYS 11 1.110 -12.299 6.844
75 3HZ LYS 11 HZ3 LYS 11 1.266 -11.448 8.298
76 H GLY 12 HN GLY 12 3.870 -5.557 6.097
77 1HA GLY 12 HA2 GLY 12 5.095 -3.921 3.969
78 2HA GLY 12 HA1 GLY 12 5.057 -3.353 5.630
79 H LYS 13 HN LYS 13 5.946 -6.373 3.955
80 HA LYS 13 HA LYS 13 8.629 -6.174 4.956
81 1HB LYS 13 HB2 LYS 13 7.370 -7.219 6.828
82 2HB LYS 13 HB1 LYS 13 6.929 -8.536 5.750
83 1HG LYS 13 HG2 LYS 13 9.570 -8.641 5.445
84 2HG LYS 13 HG1 LYS 13 9.512 -7.937 7.062
85 1HD LYS 13 HD2 LYS 13 7.830 -10.323 6.419
86 2HD LYS 13 HD1 LYS 13 9.548 -10.530 6.765
87 1HE LYS 13 HE2 LYS 13 9.145 -9.200 8.879
88 2HE LYS 13 HE1 LYS 13 7.421 -9.371 8.550
89 1HZ LYS 13 HZ1 LYS 13 7.983 -11.110 10.000
90 2HZ LYS 13 HZ2 LYS 13 9.382 -11.510 9.137
91 3HZ LYS 13 HZ3 LYS 13 7.860 -11.837 8.477
92 H ASN 14 HN ASN 14 6.261 -7.662 2.938
93 HA ASN 14 HA ASN 14 8.376 -8.593 1.200
94 1HB ASN 14 HB2 ASN 14 6.293 -10.283 2.472
95 2HB ASN 14 HB1 ASN 14 6.607 -10.577 0.764
96 1HD2 ASN 14 1HD2 ASN 14 7.404 -12.638 1.293
97 2HD2 ASN 14 2HD2 ASN 14 8.983 -12.845 1.962
98 H ALA 15 HN ALA 15 6.622 -6.323 1.299
99 HA ALA 15 HA ALA 15 5.845 -6.209 -1.391
100 1HB ALA 15 HB1 ALA 15 3.584 -6.536 -1.436
101 2HB ALA 15 HB2 ALA 15 3.383 -6.127 0.268
102 3HB ALA 15 HB3 ALA 15 4.034 -7.701 -0.190
103 H LYS 16 HN LYS 16 5.880 -4.125 -1.963
104 HA LYS 16 HA LYS 16 5.743 -2.122 0.165
105 1HB LYS 16 HB2 LYS 16 7.748 -1.977 -1.115
106 2HB LYS 16 HB1 LYS 16 6.863 -2.037 -2.631
107 1HG LYS 16 HG2 LYS 16 6.723 0.171 -2.675
108 2HG LYS 16 HG1 LYS 16 5.936 0.186 -1.097
109 1HD LYS 16 HD2 LYS 16 7.777 1.348 -0.494
110 2HD LYS 16 HD1 LYS 16 8.488 -0.261 -0.352
111 1HE LYS 16 HE2 LYS 16 8.577 1.346 -2.893
112 2HE LYS 16 HE1 LYS 16 9.825 1.453 -1.653
113 1HZ LYS 16 HZ1 LYS 16 9.937 -0.252 -3.673
114 2HZ LYS 16 HZ2 LYS 16 9.123 -1.223 -2.553
115 3HZ LYS 16 HZ3 LYS 16 10.635 -0.573 -2.165
116 HA PRO 17 HA PRO 17 1.720 -0.917 -1.306
117 1HB PRO 17 HB2 PRO 17 1.417 1.313 0.182
118 2HB PRO 17 HB1 PRO 17 1.318 -0.308 0.881
119 1HG PRO 17 HG2 PRO 17 3.609 1.621 0.886
120 2HG PRO 17 HG1 PRO 17 2.996 0.610 2.207
121 1HD PRO 17 HD2 PRO 17 5.177 -0.053 0.718
122 2HD PRO 17 HD1 PRO 17 4.105 -1.259 1.456
123 H THR 18 HN THR 18 0.872 0.444 -2.823
124 HA THR 18 HA THR 18 2.484 2.740 -3.672
125 HB THR 18 HB THR 18 2.897 0.774 -5.153
126 HG1 THR 18 HG1 THR 18 1.530 2.900 -6.435
127 1HG2 THR 18 1HG2 THR 18 0.580 0.954 -6.748
128 2HG2 THR 18 2HG2 THR 18 0.086 0.593 -5.095
129 3HG2 THR 18 3HG2 THR 18 1.243 -0.453 -5.917
130 H CYS 19 HN CYS 19 1.323 4.400 -4.781
131 HA CYS 19 HA CYS 19 -1.568 4.338 -4.217
132 1HB CYS 19 HB2 CYS 19 0.493 6.413 -3.783
133 2HB CYS 19 HB1 CYS 19 -1.063 6.978 -4.380
134 H ASP 20 HN ASP 20 -2.800 4.275 -5.961
135 HA ASP 20 HA ASP 20 -1.919 5.656 -8.376
136 1HB ASP 20 HB2 ASP 20 -1.790 3.034 -8.303
137 2HB ASP 20 HB1 ASP 20 -3.526 3.148 -8.565
138 H ASP 21 HN ASP 21 -3.264 7.365 -8.450
139 HA ASP 21 HA ASP 21 -5.171 8.612 -8.444
140 1HB ASP 21 HB2 ASP 21 -5.950 6.042 -9.750
141 2HB ASP 21 HB1 ASP 21 -7.220 7.202 -9.372
142 H GLY 22 HN GLY 22 -4.619 7.865 -5.960
143 1HA GLY 22 HA2 GLY 22 -5.548 7.746 -3.883
144 2HA GLY 22 HA1 GLY 22 -7.098 7.956 -4.667
145 H VAL 23 HN VAL 23 -5.266 5.306 -5.798
146 HA VAL 23 HA VAL 23 -6.905 3.470 -4.176
147 HB VAL 23 HB VAL 23 -5.839 2.973 -6.958
148 1HG1 VAL 23 1HG1 VAL 23 -7.823 1.196 -6.629
149 2HG1 VAL 23 2HG1 VAL 23 -7.265 1.330 -4.962
150 3HG1 VAL 23 3HG1 VAL 23 -6.140 0.852 -6.233
151 1HG2 VAL 23 1HG2 VAL 23 -7.747 3.750 -7.870
152 2HG2 VAL 23 2HG2 VAL 23 -7.849 4.690 -6.382
153 3HG2 VAL 23 3HG2 VAL 23 -8.743 3.177 -6.532
154 H CYS 24 HN CYS 24 -5.584 2.745 -2.607
155 HA CYS 24 HA CYS 24 -2.780 2.397 -2.942
156 1HB CYS 24 HB2 CYS 24 -4.025 2.857 -0.764
157 2HB CYS 24 HB1 CYS 24 -4.458 1.150 -0.768
158 H ASN 25 HN ASN 25 -1.574 0.488 -3.042
159 HA ASN 25 HA ASN 25 -2.848 -2.067 -3.266
160 1HB ASN 25 HB2 ASN 25 -2.442 -0.514 -5.634
161 2HB ASN 25 HB1 ASN 25 -1.417 -1.943 -5.690
162 1HD2 ASN 25 1HD2 ASN 25 -2.782 -2.544 -7.490
163 2HD2 ASN 25 2HD2 ASN 25 -4.289 -3.332 -7.183
164 H CYS 26 HN CYS 26 -1.506 -3.501 -2.439
165 HA CYS 26 HA CYS 26 1.340 -2.836 -2.248
166 1HB CYS 26 HB2 CYS 26 1.404 -4.633 -0.524
167 2HB CYS 26 HB1 CYS 26 0.288 -3.331 -0.129
168 H ASN 27 HN ASN 27 2.873 -3.960 -3.290
169 HA ASN 27 HA ASN 27 2.201 -6.565 -4.438
170 1HB ASN 27 HB2 ASN 27 3.192 -4.163 -5.946
171 2HB ASN 27 HB1 ASN 27 3.480 -5.797 -6.537
172 1HD2 ASN 27 1HD2 ASN 27 1.190 -3.279 -6.106
173 2HD2 ASN 27 2HD2 ASN 27 -0.133 -4.043 -6.913
174 H VAL 28 HN VAL 28 4.988 -4.513 -5.016
175 HA VAL 28 HA VAL 28 6.643 -6.160 -3.266
176 HB VAL 28 HB VAL 28 7.414 -5.722 -6.151
177 1HG1 VAL 28 1HG1 VAL 28 8.652 -7.840 -4.523
178 2HG1 VAL 28 2HG1 VAL 28 9.033 -6.186 -4.044
179 3HG1 VAL 28 3HG1 VAL 28 9.375 -6.730 -5.687
180 1HG2 VAL 28 1HG2 VAL 28 7.085 -8.313 -6.153
181 2HG2 VAL 28 2HG2 VAL 28 5.704 -7.246 -6.405
182 3HG2 VAL 28 3HG2 VAL 28 5.976 -7.977 -4.824
Start of MODEL 14
1 1H VAL 1 HT1 VAL 1 -7.761 7.638 5.211
2 2H VAL 1 HT2 VAL 1 -8.843 6.308 5.292
3 3H VAL 1 HT3 VAL 1 -9.193 7.641 4.269
4 HA VAL 1 HA VAL 1 -7.237 5.503 3.963
5 HB VAL 1 HB VAL 1 -8.881 6.841 1.834
6 1HG1 VAL 1 1HG1 VAL 1 -7.394 4.282 2.155
7 2HG1 VAL 1 2HG1 VAL 1 -7.426 5.407 0.798
8 3HG1 VAL 1 3HG1 VAL 1 -8.791 4.326 1.080
9 1HG2 VAL 1 1HG2 VAL 1 -9.805 4.962 3.949
10 2HG2 VAL 1 2HG2 VAL 1 -10.433 4.763 2.313
11 3HG2 VAL 1 3HG2 VAL 1 -10.660 6.290 3.166
12 H GLY 2 HN GLY 2 -5.761 5.771 2.079
13 1HA GLY 2 HA2 GLY 2 -5.002 7.909 0.693
14 2HA GLY 2 HA1 GLY 2 -4.423 8.347 2.293
15 H CYS 3 HN CYS 3 -2.610 8.184 0.309
16 HA CYS 3 HA CYS 3 -1.433 5.674 -0.123
17 1HB CYS 3 HB2 CYS 3 -0.872 8.383 -0.787
18 2HB CYS 3 HB1 CYS 3 0.593 7.692 -0.098
19 H GLU 4 HN GLU 4 -1.241 7.893 2.552
20 HA GLU 4 HA GLU 4 1.024 6.535 3.740
21 1HB GLU 4 HB2 GLU 4 -0.696 8.836 4.624
22 2HB GLU 4 HB1 GLU 4 0.563 8.152 5.643
23 1HG GLU 4 HG2 GLU 4 2.053 8.581 3.519
24 2HG GLU 4 HG1 GLU 4 0.796 9.764 3.158
25 H GLU 5 HN GLU 5 -2.043 5.702 3.436
26 HA GLU 5 HA GLU 5 -2.405 4.713 6.162
27 1HB GLU 5 HB2 GLU 5 -4.269 5.050 3.831
28 2HB GLU 5 HB1 GLU 5 -4.699 4.027 5.195
29 1HG GLU 5 HG2 GLU 5 -3.764 6.561 6.144
30 2HG GLU 5 HG1 GLU 5 -5.031 6.799 4.940
31 H CYS 6 HN CYS 6 -1.736 3.663 2.921
32 HA CYS 6 HA CYS 6 -2.401 0.948 3.244
33 1HB CYS 6 HB2 CYS 6 -0.376 2.118 1.353
34 2HB CYS 6 HB1 CYS 6 -1.193 0.568 1.186
35 HA PRO 7 HA PRO 7 2.494 0.678 4.104
36 1HB PRO 7 HB2 PRO 7 2.398 3.017 5.953
37 2HB PRO 7 HB1 PRO 7 3.711 2.462 4.909
38 1HG PRO 7 HG2 PRO 7 2.231 4.586 4.249
39 2HG PRO 7 HG1 PRO 7 2.803 3.443 3.019
40 1HD PRO 7 HD2 PRO 7 0.074 3.776 4.169
41 2HD PRO 7 HD1 PRO 7 0.557 3.275 2.541
42 H MET 8 HN MET 8 -0.177 1.627 6.145
43 HA MET 8 HA MET 8 0.808 -0.107 8.299
44 1HB MET 8 HB2 MET 8 0.204 2.249 8.864
45 2HB MET 8 HB1 MET 8 -1.452 1.896 8.391
46 1HG MET 8 HG2 MET 8 -1.512 0.129 10.132
47 2HG MET 8 HG1 MET 8 0.088 0.652 10.655
48 1HE MET 8 HE1 MET 8 -3.316 2.563 9.637
49 2HE MET 8 HE2 MET 8 -3.900 2.820 11.281
50 3HE MET 8 HE3 MET 8 -3.654 1.181 10.679
51 H HIS 9 HN HIS 9 -1.933 0.445 6.139
52 HA HIS 9 HA HIS 9 -3.320 -1.856 7.254
53 1HB HIS 9 HB2 HIS 9 -5.237 -1.142 6.112
54 2HB HIS 9 HB1 HIS 9 -4.458 0.344 6.614
55 HD1 HIS 9 HD1 HIS 9 -4.175 -1.808 3.458
56 HD2 HIS 9 HD2 HIS 9 -4.768 2.120 4.657
57 HE1 HIS 9 HE1 HIS 9 -4.388 -0.485 1.333
58 HE2 HIS 9 HE2 HIS 9 -4.842 1.877 2.083
59 H CYS 10 HN CYS 10 -0.781 -1.913 5.519
60 HA CYS 10 HA CYS 10 -1.786 -3.960 3.658
61 1HB CYS 10 HB2 CYS 10 -1.121 -1.995 2.366
62 2HB CYS 10 HB1 CYS 10 0.455 -1.991 3.150
63 H LYS 11 HN LYS 11 -1.273 -5.733 4.872
64 HA LYS 11 HA LYS 11 1.067 -6.055 6.392
65 1HB LYS 11 HB2 LYS 11 -1.126 -7.434 6.395
66 2HB LYS 11 HB1 LYS 11 -0.364 -8.362 5.111
67 1HG LYS 11 HG2 LYS 11 0.391 -9.620 6.802
68 2HG LYS 11 HG1 LYS 11 1.610 -8.354 6.956
69 1HD LYS 11 HD2 LYS 11 -0.381 -7.288 8.433
70 2HD LYS 11 HD1 LYS 11 -0.681 -9.007 8.696
71 1HE LYS 11 HE2 LYS 11 0.846 -8.798 10.328
72 2HE LYS 11 HE1 LYS 11 2.014 -8.886 9.010
73 1HZ LYS 11 HZ1 LYS 11 2.015 -6.927 10.759
74 2HZ LYS 11 HZ2 LYS 11 0.922 -6.257 9.657
75 3HZ LYS 11 HZ3 LYS 11 2.477 -6.687 9.149
76 H GLY 12 HN GLY 12 2.969 -7.284 5.967
77 1HA GLY 12 HA2 GLY 12 4.104 -8.691 4.221
78 2HA GLY 12 HA1 GLY 12 3.603 -7.445 3.088
79 H LYS 13 HN LYS 13 5.999 -8.482 5.221
80 HA LYS 13 HA LYS 13 7.244 -6.119 6.010
81 1HB LYS 13 HB2 LYS 13 7.815 -8.439 6.783
82 2HB LYS 13 HB1 LYS 13 8.641 -8.686 5.250
83 1HG LYS 13 HG2 LYS 13 10.389 -7.344 5.814
84 2HG LYS 13 HG1 LYS 13 9.409 -6.320 6.865
85 1HD LYS 13 HD2 LYS 13 10.554 -7.430 8.480
86 2HD LYS 13 HD1 LYS 13 9.262 -8.609 8.242
87 1HE LYS 13 HE2 LYS 13 11.633 -8.843 6.486
88 2HE LYS 13 HE1 LYS 13 11.859 -9.254 8.185
89 1HZ LYS 13 HZ1 LYS 13 10.529 -11.061 8.020
90 2HZ LYS 13 HZ2 LYS 13 11.032 -11.006 6.407
91 3HZ LYS 13 HZ3 LYS 13 9.524 -10.377 6.843
92 H ASN 14 HN ASN 14 7.026 -7.593 2.919
93 HA ASN 14 HA ASN 14 8.825 -5.569 1.834
94 1HB ASN 14 HB2 ASN 14 9.796 -7.920 1.819
95 2HB ASN 14 HB1 ASN 14 8.538 -8.328 0.657
96 1HD2 ASN 14 1HD2 ASN 14 10.803 -5.635 1.140
97 2HD2 ASN 14 2HD2 ASN 14 11.388 -5.615 -0.485
98 H ALA 15 HN ALA 15 6.040 -5.336 2.166
99 HA ALA 15 HA ALA 15 5.090 -5.489 -0.612
100 1HB ALA 15 HB1 ALA 15 3.877 -6.811 1.232
101 2HB ALA 15 HB2 ALA 15 2.909 -5.838 0.124
102 3HB ALA 15 HB3 ALA 15 3.259 -5.241 1.746
103 H LYS 16 HN LYS 16 5.667 -3.512 -1.396
104 HA LYS 16 HA LYS 16 5.152 -1.122 0.164
105 1HB LYS 16 HB2 LYS 16 7.192 -1.049 -1.017
106 2HB LYS 16 HB1 LYS 16 6.451 -1.619 -2.504
107 1HG LYS 16 HG2 LYS 16 5.751 0.443 -3.102
108 2HG LYS 16 HG1 LYS 16 5.431 0.936 -1.438
109 1HD LYS 16 HD2 LYS 16 8.264 0.492 -2.157
110 2HD LYS 16 HD1 LYS 16 7.477 1.889 -2.895
111 1HE LYS 16 HE2 LYS 16 6.995 1.528 -0.012
112 2HE LYS 16 HE1 LYS 16 8.655 1.917 -0.462
113 1HZ LYS 16 HZ1 LYS 16 6.206 3.501 -0.957
114 2HZ LYS 16 HZ2 LYS 16 7.639 3.787 -1.810
115 3HZ LYS 16 HZ3 LYS 16 7.607 3.963 -0.128
116 HA PRO 17 HA PRO 17 1.190 -0.554 -1.794
117 1HB PRO 17 HB2 PRO 17 0.452 1.670 -0.514
118 2HB PRO 17 HB1 PRO 17 0.584 0.127 0.340
119 1HG PRO 17 HG2 PRO 17 2.497 2.427 0.276
120 2HG PRO 17 HG1 PRO 17 2.003 1.419 1.648
121 1HD PRO 17 HD2 PRO 17 4.341 1.080 0.213
122 2HD PRO 17 HD1 PRO 17 3.549 -0.191 1.164
123 H THR 18 HN THR 18 0.220 0.759 -3.351
124 HA THR 18 HA THR 18 1.731 3.084 -4.283
125 HB THR 18 HB THR 18 2.319 1.032 -5.620
126 HG1 THR 18 HG1 THR 18 2.426 3.225 -6.438
127 1HG2 THR 18 1HG2 THR 18 -0.463 0.741 -5.737
128 2HG2 THR 18 2HG2 THR 18 0.773 -0.247 -6.514
129 3HG2 THR 18 3HG2 THR 18 0.084 1.136 -7.364
130 H CYS 19 HN CYS 19 0.506 4.637 -5.445
131 HA CYS 19 HA CYS 19 -2.389 4.389 -4.975
132 1HB CYS 19 HB2 CYS 19 -0.526 6.743 -4.934
133 2HB CYS 19 HB1 CYS 19 -2.247 6.976 -5.219
134 H ASP 20 HN ASP 20 -3.575 4.070 -6.725
135 HA ASP 20 HA ASP 20 -2.742 5.289 -9.246
136 1HB ASP 20 HB2 ASP 20 -2.496 2.691 -8.943
137 2HB ASP 20 HB1 ASP 20 -4.233 2.702 -9.221
138 H ASP 21 HN ASP 21 -4.158 6.939 -9.434
139 HA ASP 21 HA ASP 21 -6.121 8.093 -9.535
140 1HB ASP 21 HB2 ASP 21 -6.752 5.412 -10.686
141 2HB ASP 21 HB1 ASP 21 -8.087 6.521 -10.389
142 H GLY 22 HN GLY 22 -5.572 7.545 -7.003
143 1HA GLY 22 HA2 GLY 22 -6.520 7.513 -4.933
144 2HA GLY 22 HA1 GLY 22 -8.070 7.586 -5.743
145 H VAL 23 HN VAL 23 -6.068 4.972 -6.669
146 HA VAL 23 HA VAL 23 -7.626 3.158 -4.944
147 HB VAL 23 HB VAL 23 -6.527 2.544 -7.687
148 1HG1 VAL 23 1HG1 VAL 23 -6.770 0.625 -6.123
149 2HG1 VAL 23 2HG1 VAL 23 -7.795 0.509 -7.553
150 3HG1 VAL 23 3HG1 VAL 23 -8.491 0.992 -6.006
151 1HG2 VAL 23 1HG2 VAL 23 -8.232 3.907 -8.309
152 2HG2 VAL 23 2HG2 VAL 23 -9.113 3.678 -6.799
153 3HG2 VAL 23 3HG2 VAL 23 -9.169 2.436 -8.049
154 H CYS 24 HN CYS 24 -6.262 2.613 -3.332
155 HA CYS 24 HA CYS 24 -3.457 2.433 -3.575
156 1HB CYS 24 HB2 CYS 24 -4.555 2.796 -1.417
157 2HB CYS 24 HB1 CYS 24 -5.296 1.202 -1.509
158 H ASN 25 HN ASN 25 -2.088 0.640 -3.695
159 HA ASN 25 HA ASN 25 -3.128 -2.011 -3.998
160 1HB ASN 25 HB2 ASN 25 -2.816 -0.384 -6.326
161 2HB ASN 25 HB1 ASN 25 -1.656 -1.705 -6.383
162 1HD2 ASN 25 1HD2 ASN 25 -4.888 -0.775 -6.784
163 2HD2 ASN 25 2HD2 ASN 25 -5.553 -2.340 -7.086
164 H CYS 26 HN CYS 26 -1.687 -3.339 -3.162
165 HA CYS 26 HA CYS 26 1.070 -2.426 -2.836
166 1HB CYS 26 HB2 CYS 26 -0.394 -4.763 -1.591
167 2HB CYS 26 HB1 CYS 26 1.263 -4.296 -1.225
168 H ASN 27 HN ASN 27 2.843 -3.961 -3.184
169 HA ASN 27 HA ASN 27 2.283 -6.112 -5.069
170 1HB ASN 27 HB2 ASN 27 3.717 -3.603 -5.711
171 2HB ASN 27 HB1 ASN 27 4.438 -5.093 -6.311
172 1HD2 ASN 27 1HD2 ASN 27 3.205 -2.885 -7.763
173 2HD2 ASN 27 2HD2 ASN 27 1.929 -3.581 -8.696
174 H VAL 28 HN VAL 28 5.333 -4.536 -4.355
175 HA VAL 28 HA VAL 28 6.126 -6.566 -2.462
176 HB VAL 28 HB VAL 28 6.523 -7.699 -4.615
177 1HG1 VAL 28 1HG1 VAL 28 8.344 -5.358 -5.150
178 2HG1 VAL 28 2HG1 VAL 28 6.911 -5.828 -6.065
179 3HG1 VAL 28 3HG1 VAL 28 8.345 -6.855 -6.082
180 1HG2 VAL 28 1HG2 VAL 28 8.075 -7.789 -2.497
181 2HG2 VAL 28 2HG2 VAL 28 9.244 -7.047 -3.590
182 3HG2 VAL 28 3HG2 VAL 28 8.533 -8.611 -3.990
Start of MODEL 15
1 1H VAL 1 HT1 VAL 1 -8.424 7.607 6.224
2 2H VAL 1 HT2 VAL 1 -8.725 8.155 4.626
3 3H VAL 1 HT3 VAL 1 -7.537 8.930 5.592
4 HA VAL 1 HA VAL 1 -6.055 7.279 5.383
5 HB VAL 1 HB VAL 1 -6.725 4.995 4.517
6 1HG1 VAL 1 1HG1 VAL 1 -7.927 4.461 6.798
7 2HG1 VAL 1 2HG1 VAL 1 -7.471 6.124 7.168
8 3HG1 VAL 1 3HG1 VAL 1 -6.231 4.941 6.752
9 1HG2 VAL 1 1HG2 VAL 1 -9.487 5.437 5.448
10 2HG2 VAL 1 2HG2 VAL 1 -8.876 4.411 4.151
11 3HG2 VAL 1 3HG2 VAL 1 -9.079 6.142 3.884
12 H GLY 2 HN GLY 2 -4.765 7.136 3.618
13 1HA GLY 2 HA2 GLY 2 -5.979 7.172 0.956
14 2HA GLY 2 HA1 GLY 2 -4.943 8.523 1.390
15 H CYS 3 HN CYS 3 -2.793 8.327 1.142
16 HA CYS 3 HA CYS 3 -1.784 5.684 0.325
17 1HB CYS 3 HB2 CYS 3 -1.697 8.052 -1.072
18 2HB CYS 3 HB1 CYS 3 -0.107 8.004 -0.319
19 H GLU 4 HN GLU 4 -0.943 8.618 2.130
20 HA GLU 4 HA GLU 4 1.501 7.799 3.137
21 1HB GLU 4 HB2 GLU 4 0.787 9.318 5.150
22 2HB GLU 4 HB1 GLU 4 1.128 10.022 3.577
23 1HG GLU 4 HG2 GLU 4 -1.139 10.348 3.109
24 2HG GLU 4 HG1 GLU 4 -1.650 9.238 4.380
25 H GLU 5 HN GLU 5 -1.613 6.870 3.993
26 HA GLU 5 HA GLU 5 -0.633 5.365 6.311
27 1HB GLU 5 HB2 GLU 5 -3.424 6.279 5.623
28 2HB GLU 5 HB1 GLU 5 -3.045 5.218 6.972
29 1HG GLU 5 HG2 GLU 5 -2.860 7.064 8.188
30 2HG GLU 5 HG1 GLU 5 -1.334 7.336 7.349
31 H CYS 6 HN CYS 6 -0.519 4.639 3.401
32 HA CYS 6 HA CYS 6 -2.363 2.468 3.110
33 1HB CYS 6 HB2 CYS 6 -1.257 3.961 1.264
34 2HB CYS 6 HB1 CYS 6 0.034 2.769 1.365
35 HA PRO 7 HA PRO 7 2.016 0.127 3.609
36 1HB PRO 7 HB2 PRO 7 2.822 1.925 5.852
37 2HB PRO 7 HB1 PRO 7 3.827 1.094 4.659
38 1HG PRO 7 HG2 PRO 7 3.329 3.708 4.452
39 2HG PRO 7 HG1 PRO 7 3.416 2.673 3.015
40 1HD PRO 7 HD2 PRO 7 1.032 3.858 4.350
41 2HD PRO 7 HD1 PRO 7 1.297 3.487 2.639
42 H MET 8 HN MET 8 -0.039 1.626 6.018
43 HA MET 8 HA MET 8 0.323 -0.502 7.938
44 1HB MET 8 HB2 MET 8 -0.292 2.056 8.294
45 2HB MET 8 HB1 MET 8 -1.932 1.439 8.139
46 1HG MET 8 HG2 MET 8 -1.722 1.217 10.369
47 2HG MET 8 HG1 MET 8 -1.000 -0.322 9.905
48 1HE MET 8 HE1 MET 8 2.007 0.680 8.826
49 2HE MET 8 HE2 MET 8 1.445 -0.767 9.663
50 3HE MET 8 HE3 MET 8 2.755 0.195 10.348
51 H HIS 9 HN HIS 9 -1.888 0.315 5.381
52 HA HIS 9 HA HIS 9 -4.006 -1.406 6.198
53 1HB HIS 9 HB2 HIS 9 -3.327 0.108 3.714
54 2HB HIS 9 HB1 HIS 9 -4.552 -1.152 3.624
55 HD1 HIS 9 HD1 HIS 9 -6.111 -0.731 6.168
56 HD2 HIS 9 HD2 HIS 9 -4.741 2.404 3.814
57 HE1 HIS 9 HE1 HIS 9 -7.594 1.224 6.723
58 HE2 HIS 9 HE2 HIS 9 -6.695 3.132 5.344
59 H CYS 10 HN CYS 10 -2.243 -1.749 3.138
60 HA CYS 10 HA CYS 10 -2.632 -4.566 3.103
61 1HB CYS 10 HB2 CYS 10 -1.059 -4.471 1.121
62 2HB CYS 10 HB1 CYS 10 -2.506 -3.477 0.993
63 H LYS 11 HN LYS 11 -1.571 -5.990 4.285
64 HA LYS 11 HA LYS 11 0.853 -5.392 5.651
65 1HB LYS 11 HB2 LYS 11 -0.940 -7.018 6.400
66 2HB LYS 11 HB1 LYS 11 -0.324 -8.133 5.188
67 1HG LYS 11 HG2 LYS 11 1.780 -8.291 6.291
68 2HG LYS 11 HG1 LYS 11 1.362 -6.978 7.394
69 1HD LYS 11 HD2 LYS 11 -0.334 -8.322 8.439
70 2HD LYS 11 HD1 LYS 11 -0.117 -9.602 7.243
71 1HE LYS 11 HE2 LYS 11 1.911 -10.270 8.135
72 2HE LYS 11 HE1 LYS 11 2.200 -8.712 8.907
73 1HZ LYS 11 HZ1 LYS 11 0.570 -10.967 9.823
74 2HZ LYS 11 HZ2 LYS 11 0.082 -9.406 10.255
75 3HZ LYS 11 HZ3 LYS 11 1.615 -9.966 10.699
76 H GLY 12 HN GLY 12 2.819 -6.791 5.472
77 1HA GLY 12 HA2 GLY 12 3.801 -8.411 3.706
78 2HA GLY 12 HA1 GLY 12 3.520 -7.047 2.636
79 H LYS 13 HN LYS 13 5.625 -8.482 4.875
80 HA LYS 13 HA LYS 13 7.105 -6.307 5.808
81 1HB LYS 13 HB2 LYS 13 8.047 -9.104 5.153
82 2HB LYS 13 HB1 LYS 13 8.951 -7.934 6.105
83 1HG LYS 13 HG2 LYS 13 6.224 -8.957 6.857
84 2HG LYS 13 HG1 LYS 13 7.738 -9.651 7.440
85 1HD LYS 13 HD2 LYS 13 8.163 -7.901 8.824
86 2HD LYS 13 HD1 LYS 13 7.412 -6.725 7.743
87 1HE LYS 13 HE2 LYS 13 5.780 -6.709 9.290
88 2HE LYS 13 HE1 LYS 13 5.255 -8.182 8.476
89 1HZ LYS 13 HZ1 LYS 13 6.222 -9.513 10.112
90 2HZ LYS 13 HZ2 LYS 13 5.497 -8.260 10.986
91 3HZ LYS 13 HZ3 LYS 13 7.168 -8.254 10.729
92 H ASN 14 HN ASN 14 6.921 -7.719 2.687
93 HA ASN 14 HA ASN 14 8.992 -5.900 1.750
94 1HB ASN 14 HB2 ASN 14 9.448 -8.561 1.827
95 2HB ASN 14 HB1 ASN 14 8.682 -8.430 0.247
96 1HD2 ASN 14 1HD2 ASN 14 10.881 -9.221 -0.344
97 2HD2 ASN 14 2HD2 ASN 14 12.094 -8.032 -0.660
98 H ALA 15 HN ALA 15 6.186 -5.539 1.878
99 HA ALA 15 HA ALA 15 5.544 -5.427 -0.988
100 1HB ALA 15 HB1 ALA 15 4.184 -6.964 0.761
101 2HB ALA 15 HB2 ALA 15 3.465 -6.244 -0.680
102 3HB ALA 15 HB3 ALA 15 3.275 -5.458 0.888
103 H LYS 16 HN LYS 16 5.955 -3.343 -1.479
104 HA LYS 16 HA LYS 16 5.293 -1.222 0.367
105 1HB LYS 16 HB2 LYS 16 7.339 -0.982 -0.852
106 2HB LYS 16 HB1 LYS 16 6.520 -1.222 -2.388
107 1HG LYS 16 HG2 LYS 16 5.281 0.970 -1.107
108 2HG LYS 16 HG1 LYS 16 7.025 1.198 -0.981
109 1HD LYS 16 HD2 LYS 16 5.945 0.337 -3.607
110 2HD LYS 16 HD1 LYS 16 5.630 1.999 -3.103
111 1HE LYS 16 HE2 LYS 16 7.651 1.982 -4.381
112 2HE LYS 16 HE1 LYS 16 8.074 2.264 -2.693
113 1HZ LYS 16 HZ1 LYS 16 9.587 0.681 -3.583
114 2HZ LYS 16 HZ2 LYS 16 8.338 -0.275 -4.205
115 3HZ LYS 16 HZ3 LYS 16 8.556 -0.154 -2.532
116 HA PRO 17 HA PRO 17 1.209 -0.634 -1.284
117 1HB PRO 17 HB2 PRO 17 0.726 1.814 -0.199
118 2HB PRO 17 HB1 PRO 17 0.640 0.309 0.720
119 1HG PRO 17 HG2 PRO 17 2.851 2.319 0.578
120 2HG PRO 17 HG1 PRO 17 2.211 1.455 1.989
121 1HD PRO 17 HD2 PRO 17 4.499 0.715 0.745
122 2HD PRO 17 HD1 PRO 17 3.413 -0.456 1.521
123 H THR 18 HN THR 18 0.385 0.230 -3.094
124 HA THR 18 HA THR 18 1.779 2.509 -4.314
125 HB THR 18 HB THR 18 0.624 1.033 -6.360
126 HG1 THR 18 HG1 THR 18 2.150 -0.630 -4.657
127 1HG2 THR 18 1HG2 THR 18 3.518 0.844 -5.683
128 2HG2 THR 18 2HG2 THR 18 2.803 2.346 -6.274
129 3HG2 THR 18 3HG2 THR 18 2.746 0.890 -7.269
130 H CYS 19 HN CYS 19 0.540 4.053 -5.312
131 HA CYS 19 HA CYS 19 -2.350 3.816 -4.847
132 1HB CYS 19 HB2 CYS 19 -0.440 6.086 -4.737
133 2HB CYS 19 HB1 CYS 19 -2.067 6.433 -5.309
134 H ASP 20 HN ASP 20 -3.588 3.494 -6.561
135 HA ASP 20 HA ASP 20 -2.762 4.587 -9.138
136 1HB ASP 20 HB2 ASP 20 -2.521 2.004 -8.725
137 2HB ASP 20 HB1 ASP 20 -4.259 2.009 -8.994
138 H ASP 21 HN ASP 21 -4.178 6.207 -9.444
139 HA ASP 21 HA ASP 21 -6.136 7.363 -9.593
140 1HB ASP 21 HB2 ASP 21 -6.769 4.623 -10.577
141 2HB ASP 21 HB1 ASP 21 -8.119 5.721 -10.304
142 H GLY 22 HN GLY 22 -5.561 6.970 -7.034
143 1HA GLY 22 HA2 GLY 22 -6.501 7.106 -4.962
144 2HA GLY 22 HA1 GLY 22 -8.056 7.104 -5.764
145 H VAL 23 HN VAL 23 -6.058 4.442 -6.519
146 HA VAL 23 HA VAL 23 -7.629 2.746 -4.692
147 HB VAL 23 HB VAL 23 -6.343 1.908 -7.293
148 1HG1 VAL 23 1HG1 VAL 23 -8.564 0.374 -6.117
149 2HG1 VAL 23 2HG1 VAL 23 -7.047 0.330 -5.219
150 3HG1 VAL 23 3HG1 VAL 23 -7.089 -0.184 -6.906
151 1HG2 VAL 23 1HG2 VAL 23 -9.207 2.649 -6.707
152 2HG2 VAL 23 2HG2 VAL 23 -8.653 1.868 -8.188
153 3HG2 VAL 23 3HG2 VAL 23 -8.093 3.491 -7.784
154 H CYS 24 HN CYS 24 -6.341 2.442 -2.956
155 HA CYS 24 HA CYS 24 -3.500 2.167 -3.155
156 1HB CYS 24 HB2 CYS 24 -5.402 2.592 -1.085
157 2HB CYS 24 HB1 CYS 24 -4.474 1.158 -0.659
158 H ASN 25 HN ASN 25 -2.300 0.379 -3.361
159 HA ASN 25 HA ASN 25 -3.256 -2.215 -2.620
160 1HB ASN 25 HB2 ASN 25 -3.675 -1.319 -5.297
161 2HB ASN 25 HB1 ASN 25 -2.489 -2.618 -5.311
162 1HD2 ASN 25 1HD2 ASN 25 -5.686 -1.950 -5.492
163 2HD2 ASN 25 2HD2 ASN 25 -6.334 -3.470 -4.987
164 H CYS 26 HN CYS 26 -1.575 -3.330 -1.905
165 HA CYS 26 HA CYS 26 1.086 -2.324 -2.207
166 1HB CYS 26 HB2 CYS 26 -0.240 -4.460 -0.658
167 2HB CYS 26 HB1 CYS 26 1.448 -4.755 -1.057
168 H ASN 27 HN ASN 27 2.914 -3.735 -2.864
169 HA ASN 27 HA ASN 27 2.293 -5.784 -4.821
170 1HB ASN 27 HB2 ASN 27 3.274 -3.081 -5.523
171 2HB ASN 27 HB1 ASN 27 4.065 -4.432 -6.330
172 1HD2 ASN 27 1HD2 ASN 27 2.942 -3.008 -8.071
173 2HD2 ASN 27 2HD2 ASN 27 1.389 -3.574 -8.574
174 H VAL 28 HN VAL 28 5.207 -3.855 -4.516
175 HA VAL 28 HA VAL 28 6.554 -5.898 -2.962
176 HB VAL 28 HB VAL 28 7.637 -5.179 -5.687
177 1HG1 VAL 28 1HG1 VAL 28 9.463 -6.410 -5.194
178 2HG1 VAL 28 2HG1 VAL 28 8.553 -7.572 -4.229
179 3HG1 VAL 28 3HG1 VAL 28 9.017 -6.019 -3.533
180 1HG2 VAL 28 1HG2 VAL 28 6.170 -7.656 -4.791
181 2HG2 VAL 28 2HG2 VAL 28 7.068 -7.519 -6.302
182 3HG2 VAL 28 3HG2 VAL 28 5.656 -6.501 -6.019
Start of MODEL 16
1 1H VAL 1 HT1 VAL 1 -10.546 6.306 0.017
2 2H VAL 1 HT2 VAL 1 -10.613 7.097 1.539
3 3H VAL 1 HT3 VAL 1 -10.927 5.414 1.430
4 HA VAL 1 HA VAL 1 -8.676 6.256 2.246
5 HB VAL 1 HB VAL 1 -7.576 4.287 1.121
6 1HG1 VAL 1 1HG1 VAL 1 -8.422 3.568 3.087
7 2HG1 VAL 1 2HG1 VAL 1 -9.544 2.701 2.038
8 3HG1 VAL 1 3HG1 VAL 1 -10.023 4.234 2.766
9 1HG2 VAL 1 1HG2 VAL 1 -10.192 3.429 0.042
10 2HG2 VAL 1 2HG2 VAL 1 -8.560 3.098 -0.539
11 3HG2 VAL 1 3HG2 VAL 1 -9.319 4.654 -0.879
12 H GLY 2 HN GLY 2 -6.457 6.408 1.371
13 1HA GLY 2 HA2 GLY 2 -6.262 7.406 -1.367
14 2HA GLY 2 HA1 GLY 2 -5.856 8.532 -0.081
15 H CYS 3 HN CYS 3 -3.743 8.719 0.177
16 HA CYS 3 HA CYS 3 -2.041 6.385 -0.364
17 1HB CYS 3 HB2 CYS 3 -1.830 8.839 -1.449
18 2HB CYS 3 HB1 CYS 3 -0.820 9.067 -0.026
19 H GLU 4 HN GLU 4 -3.169 8.438 2.134
20 HA GLU 4 HA GLU 4 -0.954 7.956 3.912
21 1HB GLU 4 HB2 GLU 4 -2.567 10.007 3.829
22 2HB GLU 4 HB1 GLU 4 -3.607 8.991 4.817
23 1HG GLU 4 HG2 GLU 4 -1.230 8.758 6.116
24 2HG GLU 4 HG1 GLU 4 -1.146 10.412 5.511
25 H GLU 5 HN GLU 5 -3.282 6.018 2.845
26 HA GLU 5 HA GLU 5 -3.580 4.595 5.396
27 1HB GLU 5 HB2 GLU 5 -5.371 4.797 2.996
28 2HB GLU 5 HB1 GLU 5 -5.500 3.428 4.091
29 1HG GLU 5 HG2 GLU 5 -5.479 6.039 5.414
30 2HG GLU 5 HG1 GLU 5 -6.854 5.766 4.344
31 H CYS 6 HN CYS 6 -2.480 4.406 2.119
32 HA CYS 6 HA CYS 6 -2.346 1.704 1.663
33 1HB CYS 6 HB2 CYS 6 -0.976 4.074 0.658
34 2HB CYS 6 HB1 CYS 6 -0.008 2.608 0.541
35 HA PRO 7 HA PRO 7 1.881 1.500 3.900
36 1HB PRO 7 HB2 PRO 7 2.669 3.649 5.349
37 2HB PRO 7 HB1 PRO 7 3.018 3.473 3.627
38 1HG PRO 7 HG2 PRO 7 0.969 5.146 4.984
39 2HG PRO 7 HG1 PRO 7 1.893 5.473 3.509
40 1HD PRO 7 HD2 PRO 7 -0.740 4.588 3.595
41 2HD PRO 7 HD1 PRO 7 0.326 4.458 2.190
42 H MET 8 HN MET 8 -0.346 0.551 4.901
43 HA MET 8 HA MET 8 0.141 0.141 7.611
44 1HB MET 8 HB2 MET 8 -0.621 2.448 7.922
45 2HB MET 8 HB1 MET 8 -2.120 2.080 7.080
46 1HG MET 8 HG2 MET 8 -2.587 0.386 8.875
47 2HG MET 8 HG1 MET 8 -1.207 1.048 9.749
48 1HE MET 8 HE1 MET 8 -1.113 3.838 10.273
49 2HE MET 8 HE2 MET 8 -2.497 4.869 9.909
50 3HE MET 8 HE3 MET 8 -1.610 4.090 8.600
51 H HIS 9 HN HIS 9 -2.282 0.309 5.066
52 HA HIS 9 HA HIS 9 -3.805 -1.891 6.180
53 1HB HIS 9 HB2 HIS 9 -4.175 0.111 4.057
54 2HB HIS 9 HB1 HIS 9 -4.833 -1.475 3.674
55 HD1 HIS 9 HD1 HIS 9 -5.989 -2.332 6.337
56 HD2 HIS 9 HD2 HIS 9 -6.340 1.528 4.840
57 HE1 HIS 9 HE1 HIS 9 -7.998 -1.346 7.486
58 HE2 HIS 9 HE2 HIS 9 -8.243 0.959 6.498
59 H CYS 10 HN CYS 10 -1.447 -2.958 5.913
60 HA CYS 10 HA CYS 10 -1.800 -5.043 4.032
61 1HB CYS 10 HB2 CYS 10 -0.268 -2.732 3.153
62 2HB CYS 10 HB1 CYS 10 0.694 -4.205 3.111
63 H LYS 11 HN LYS 11 1.327 -3.654 4.924
64 HA LYS 11 HA LYS 11 3.025 -4.425 6.219
65 1HB LYS 11 HB2 LYS 11 0.730 -5.536 7.838
66 2HB LYS 11 HB1 LYS 11 2.401 -5.485 8.381
67 1HG LYS 11 HG2 LYS 11 2.250 -2.958 7.957
68 2HG LYS 11 HG1 LYS 11 0.504 -3.215 7.925
69 1HD LYS 11 HD2 LYS 11 0.388 -3.554 10.149
70 2HD LYS 11 HD1 LYS 11 1.898 -4.466 10.189
71 1HE LYS 11 HE2 LYS 11 2.832 -1.994 9.634
72 2HE LYS 11 HE1 LYS 11 1.405 -1.588 10.588
73 1HZ LYS 11 HZ1 LYS 11 2.360 -3.382 12.182
74 2HZ LYS 11 HZ2 LYS 11 2.998 -1.816 12.200
75 3HZ LYS 11 HZ3 LYS 11 3.821 -3.054 11.394
76 H GLY 12 HN GLY 12 4.345 -5.921 5.448
77 1HA GLY 12 HA2 GLY 12 3.608 -8.728 5.650
78 2HA GLY 12 HA1 GLY 12 3.953 -8.121 4.038
79 H LYS 13 HN LYS 13 6.029 -7.906 3.391
80 HA LYS 13 HA LYS 13 8.206 -7.737 5.213
81 1HB LYS 13 HB2 LYS 13 7.738 -10.123 5.410
82 2HB LYS 13 HB1 LYS 13 7.808 -10.293 3.662
83 1HG LYS 13 HG2 LYS 13 9.927 -10.903 3.995
84 2HG LYS 13 HG1 LYS 13 10.239 -9.181 4.218
85 1HD LYS 13 HD2 LYS 13 9.289 -10.673 6.589
86 2HD LYS 13 HD1 LYS 13 10.918 -11.046 6.023
87 1HE LYS 13 HE2 LYS 13 10.103 -8.194 6.314
88 2HE LYS 13 HE1 LYS 13 10.492 -9.120 7.762
89 1HZ LYS 13 HZ1 LYS 13 12.561 -8.421 7.279
90 2HZ LYS 13 HZ2 LYS 13 12.236 -8.185 5.636
91 3HZ LYS 13 HZ3 LYS 13 12.562 -9.739 6.218
92 H ASN 14 HN ASN 14 7.514 -8.922 1.935
93 HA ASN 14 HA ASN 14 9.443 -6.986 0.927
94 1HB ASN 14 HB2 ASN 14 10.041 -8.511 -0.832
95 2HB ASN 14 HB1 ASN 14 10.132 -9.397 0.687
96 1HD2 ASN 14 1HD2 ASN 14 9.173 -9.627 -2.407
97 2HD2 ASN 14 2HD2 ASN 14 7.937 -10.824 -2.256
98 H ALA 15 HN ALA 15 6.673 -6.613 1.493
99 HA ALA 15 HA ALA 15 5.664 -6.154 -1.228
100 1HB ALA 15 HB1 ALA 15 4.362 -7.366 1.108
101 2HB ALA 15 HB2 ALA 15 4.048 -7.591 -0.613
102 3HB ALA 15 HB3 ALA 15 3.388 -6.188 0.227
103 H LYS 16 HN LYS 16 6.108 -4.033 -1.542
104 HA LYS 16 HA LYS 16 5.583 -2.129 0.598
105 1HB LYS 16 HB2 LYS 16 7.665 -1.802 -0.528
106 2HB LYS 16 HB1 LYS 16 6.888 -1.834 -2.103
107 1HG LYS 16 HG2 LYS 16 5.755 0.267 -1.589
108 2HG LYS 16 HG1 LYS 16 6.526 0.293 -0.001
109 1HD LYS 16 HD2 LYS 16 8.087 1.538 -1.036
110 2HD LYS 16 HD1 LYS 16 8.680 -0.016 -1.625
111 1HE LYS 16 HE2 LYS 16 6.517 1.209 -3.206
112 2HE LYS 16 HE1 LYS 16 8.053 2.073 -3.221
113 1HZ LYS 16 HZ1 LYS 16 9.127 0.329 -4.229
114 2HZ LYS 16 HZ2 LYS 16 7.602 0.222 -4.951
115 3HZ LYS 16 HZ3 LYS 16 8.016 -0.830 -3.694
116 HA PRO 17 HA PRO 17 1.640 -1.120 -1.190
117 1HB PRO 17 HB2 PRO 17 0.980 0.905 0.442
118 2HB PRO 17 HB1 PRO 17 1.015 -0.770 1.004
119 1HG PRO 17 HG2 PRO 17 3.045 1.397 1.374
120 2HG PRO 17 HG1 PRO 17 2.471 0.190 2.539
121 1HD PRO 17 HD2 PRO 17 4.822 -0.029 1.134
122 2HD PRO 17 HD1 PRO 17 3.910 -1.413 1.767
123 H THR 18 HN THR 18 0.807 0.313 -2.649
124 HA THR 18 HA THR 18 2.118 2.881 -3.044
125 HB THR 18 HB THR 18 3.057 0.887 -4.513
126 HG1 THR 18 HG1 THR 18 2.533 3.539 -5.334
127 1HG2 THR 18 1HG2 THR 18 0.909 0.315 -5.525
128 2HG2 THR 18 2HG2 THR 18 2.088 0.857 -6.720
129 3HG2 THR 18 3HG2 THR 18 0.805 1.944 -6.187
130 H CYS 19 HN CYS 19 0.677 4.441 -3.409
131 HA CYS 19 HA CYS 19 -2.086 3.678 -3.867
132 1HB CYS 19 HB2 CYS 19 -2.657 5.915 -3.211
133 2HB CYS 19 HB1 CYS 19 -1.455 5.302 -2.080
134 H ASP 20 HN ASP 20 -3.348 4.395 -5.570
135 HA ASP 20 HA ASP 20 -1.982 5.726 -7.772
136 1HB ASP 20 HB2 ASP 20 -2.303 3.124 -7.898
137 2HB ASP 20 HB1 ASP 20 -3.953 3.557 -8.324
138 H ASP 21 HN ASP 21 -3.026 7.671 -7.524
139 HA ASP 21 HA ASP 21 -4.706 9.212 -7.526
140 1HB ASP 21 HB2 ASP 21 -5.642 7.154 -9.507
141 2HB ASP 21 HB1 ASP 21 -6.601 8.594 -9.179
142 H GLY 22 HN GLY 22 -4.925 8.066 -5.209
143 1HA GLY 22 HA2 GLY 22 -6.495 8.026 -3.520
144 2HA GLY 22 HA1 GLY 22 -7.740 7.970 -4.744
145 H VAL 23 HN VAL 23 -5.862 5.629 -5.808
146 HA VAL 23 HA VAL 23 -7.358 3.565 -4.375
147 HB VAL 23 HB VAL 23 -5.582 3.209 -6.790
148 1HG1 VAL 23 1HG1 VAL 23 -7.683 1.502 -5.475
149 2HG1 VAL 23 2HG1 VAL 23 -5.977 1.130 -5.724
150 3HG1 VAL 23 3HG1 VAL 23 -7.075 1.200 -7.103
151 1HG2 VAL 23 1HG2 VAL 23 -7.623 3.291 -8.139
152 2HG2 VAL 23 2HG2 VAL 23 -7.335 4.822 -7.311
153 3HG2 VAL 23 3HG2 VAL 23 -8.557 3.705 -6.702
154 H CYS 24 HN CYS 24 -6.266 1.599 -3.708
155 HA CYS 24 HA CYS 24 -3.447 2.044 -2.982
156 1HB CYS 24 HB2 CYS 24 -5.751 1.506 -1.254
157 2HB CYS 24 HB1 CYS 24 -4.396 0.417 -0.973
158 H ASN 25 HN ASN 25 -2.072 0.355 -3.228
159 HA ASN 25 HA ASN 25 -2.995 -2.336 -3.540
160 1HB ASN 25 HB2 ASN 25 -2.751 -0.695 -5.862
161 2HB ASN 25 HB1 ASN 25 -1.516 -1.946 -5.916
162 1HD2 ASN 25 1HD2 ASN 25 -4.706 -1.201 -6.543
163 2HD2 ASN 25 2HD2 ASN 25 -5.312 -2.803 -6.774
164 H CYS 26 HN CYS 26 -1.498 -3.623 -2.735
165 HA CYS 26 HA CYS 26 1.229 -2.602 -2.417
166 1HB CYS 26 HB2 CYS 26 -0.088 -4.985 -1.097
167 2HB CYS 26 HB1 CYS 26 1.497 -4.327 -0.708
168 H ASN 27 HN ASN 27 3.051 -3.895 -2.948
169 HA ASN 27 HA ASN 27 2.625 -6.328 -4.461
170 1HB ASN 27 HB2 ASN 27 3.701 -3.809 -5.707
171 2HB ASN 27 HB1 ASN 27 4.037 -5.403 -6.375
172 1HD2 ASN 27 1HD2 ASN 27 1.601 -3.001 -5.769
173 2HD2 ASN 27 2HD2 ASN 27 0.400 -3.662 -6.819
174 H VAL 28 HN VAL 28 5.391 -4.200 -4.725
175 HA VAL 28 HA VAL 28 6.902 -5.797 -2.810
176 HB VAL 28 HB VAL 28 7.932 -5.395 -5.618
177 1HG1 VAL 28 1HG1 VAL 28 8.937 -7.106 -3.346
178 2HG1 VAL 28 2HG1 VAL 28 9.641 -5.576 -3.870
179 3HG1 VAL 28 3HG1 VAL 28 9.661 -6.972 -4.948
180 1HG2 VAL 28 1HG2 VAL 28 6.193 -6.926 -5.923
181 2HG2 VAL 28 2HG2 VAL 28 6.490 -7.714 -4.374
182 3HG2 VAL 28 3HG2 VAL 28 7.619 -7.942 -5.710
Start of MODEL 17
1 1H VAL 1 HT1 VAL 1 -8.715 5.460 6.529
2 2H VAL 1 HT2 VAL 1 -9.529 5.818 5.062
3 3H VAL 1 HT3 VAL 1 -8.259 6.834 5.611
4 HA VAL 1 HA VAL 1 -6.664 5.193 5.261
5 HB VAL 1 HB VAL 1 -7.371 3.002 4.212
6 1HG1 VAL 1 1HG1 VAL 1 -6.598 3.116 6.505
7 2HG1 VAL 1 2HG1 VAL 1 -7.925 1.961 6.373
8 3HG1 VAL 1 3HG1 VAL 1 -8.214 3.562 7.053
9 1HG2 VAL 1 1HG2 VAL 1 -9.815 4.122 4.000
10 2HG2 VAL 1 2HG2 VAL 1 -10.015 3.206 5.493
11 3HG2 VAL 1 3HG2 VAL 1 -9.530 2.382 4.011
12 H GLY 2 HN GLY 2 -5.603 5.600 3.429
13 1HA GLY 2 HA2 GLY 2 -7.061 5.671 0.894
14 2HA GLY 2 HA1 GLY 2 -6.248 7.146 1.397
15 H CYS 3 HN CYS 3 -4.149 7.395 0.916
16 HA CYS 3 HA CYS 3 -2.753 5.073 -0.237
17 1HB CYS 3 HB2 CYS 3 -3.082 7.807 -1.133
18 2HB CYS 3 HB1 CYS 3 -1.377 7.397 -0.992
19 H GLU 4 HN GLU 4 -2.541 7.709 2.048
20 HA GLU 4 HA GLU 4 0.209 7.082 2.727
21 1HB GLU 4 HB2 GLU 4 -1.745 9.137 3.722
22 2HB GLU 4 HB1 GLU 4 -0.163 8.912 4.454
23 1HG GLU 4 HG2 GLU 4 -0.258 9.303 1.521
24 2HG GLU 4 HG1 GLU 4 -0.619 10.695 2.541
25 H GLU 5 HN GLU 5 -2.561 5.637 3.394
26 HA GLU 5 HA GLU 5 -1.837 4.990 6.164
27 1HB GLU 5 HB2 GLU 5 -4.526 4.695 4.829
28 2HB GLU 5 HB1 GLU 5 -4.164 4.334 6.510
29 1HG GLU 5 HG2 GLU 5 -3.318 6.928 6.258
30 2HG GLU 5 HG1 GLU 5 -4.744 6.878 5.222
31 H CYS 6 HN CYS 6 -1.518 3.802 3.129
32 HA CYS 6 HA CYS 6 -2.328 1.119 3.459
33 1HB CYS 6 HB2 CYS 6 -0.246 2.168 1.560
34 2HB CYS 6 HB1 CYS 6 -1.182 0.686 1.389
35 HA PRO 7 HA PRO 7 2.532 0.630 4.337
36 1HB PRO 7 HB2 PRO 7 2.613 3.012 6.121
37 2HB PRO 7 HB1 PRO 7 3.859 2.370 5.045
38 1HG PRO 7 HG2 PRO 7 2.466 4.565 4.407
39 2HG PRO 7 HG1 PRO 7 2.960 3.388 3.176
40 1HD PRO 7 HD2 PRO 7 0.271 3.853 4.378
41 2HD PRO 7 HD1 PRO 7 0.700 3.324 2.744
42 H MET 8 HN MET 8 -0.071 1.795 6.351
43 HA MET 8 HA MET 8 0.834 0.100 8.570
44 1HB MET 8 HB2 MET 8 -1.021 2.460 8.421
45 2HB MET 8 HB1 MET 8 -1.053 1.367 9.798
46 1HG MET 8 HG2 MET 8 0.345 3.091 10.474
47 2HG MET 8 HG1 MET 8 1.453 1.812 9.983
48 1HE MET 8 HE1 MET 8 -0.051 5.311 9.170
49 2HE MET 8 HE2 MET 8 -0.659 4.359 7.815
50 3HE MET 8 HE3 MET 8 0.547 5.616 7.539
51 H HIS 9 HN HIS 9 -1.871 0.673 6.373
52 HA HIS 9 HA HIS 9 -3.384 -1.477 7.612
53 1HB HIS 9 HB2 HIS 9 -5.249 -0.750 6.399
54 2HB HIS 9 HB1 HIS 9 -4.402 0.728 6.806
55 HD1 HIS 9 HD1 HIS 9 -4.134 -1.643 3.809
56 HD2 HIS 9 HD2 HIS 9 -4.680 2.370 4.719
57 HE1 HIS 9 HE1 HIS 9 -4.285 -0.469 1.594
58 HE2 HIS 9 HE2 HIS 9 -4.719 1.945 2.169
59 H CYS 10 HN CYS 10 -0.830 -1.785 5.928
60 HA CYS 10 HA CYS 10 -1.784 -4.130 4.510
61 1HB CYS 10 HB2 CYS 10 -1.568 -1.871 3.034
62 2HB CYS 10 HB1 CYS 10 0.070 -2.499 2.885
63 H LYS 11 HN LYS 11 -0.601 -5.291 6.057
64 HA LYS 11 HA LYS 11 2.113 -4.841 6.668
65 1HB LYS 11 HB2 LYS 11 0.339 -7.264 6.895
66 2HB LYS 11 HB1 LYS 11 2.028 -7.302 7.381
67 1HG LYS 11 HG2 LYS 11 1.058 -6.814 9.378
68 2HG LYS 11 HG1 LYS 11 1.325 -5.179 8.771
69 1HD LYS 11 HD2 LYS 11 -0.927 -4.913 8.174
70 2HD LYS 11 HD1 LYS 11 -1.243 -6.647 8.258
71 1HE LYS 11 HE2 LYS 11 -1.348 -6.652 10.561
72 2HE LYS 11 HE1 LYS 11 -0.362 -5.198 10.713
73 1HZ LYS 11 HZ1 LYS 11 -2.451 -4.424 11.214
74 2HZ LYS 11 HZ2 LYS 11 -3.229 -5.438 10.106
75 3HZ LYS 11 HZ3 LYS 11 -2.376 -4.085 9.557
76 H GLY 12 HN GLY 12 3.907 -6.370 6.139
77 1HA GLY 12 HA2 GLY 12 4.356 -8.197 4.371
78 2HA GLY 12 HA1 GLY 12 3.832 -6.941 3.260
79 H LYS 13 HN LYS 13 6.419 -8.252 4.995
80 HA LYS 13 HA LYS 13 8.153 -6.084 5.280
81 1HB LYS 13 HB2 LYS 13 8.713 -9.003 4.756
82 2HB LYS 13 HB1 LYS 13 9.970 -7.830 5.125
83 1HG LYS 13 HG2 LYS 13 8.458 -7.346 7.216
84 2HG LYS 13 HG1 LYS 13 7.866 -8.975 6.885
85 1HD LYS 13 HD2 LYS 13 9.628 -9.318 8.376
86 2HD LYS 13 HD1 LYS 13 10.348 -9.638 6.797
87 1HE LYS 13 HE2 LYS 13 11.950 -8.226 7.496
88 2HE LYS 13 HE1 LYS 13 10.794 -6.975 7.040
89 1HZ LYS 13 HZ1 LYS 13 11.022 -8.137 9.763
90 2HZ LYS 13 HZ2 LYS 13 10.040 -6.841 9.297
91 3HZ LYS 13 HZ3 LYS 13 11.723 -6.673 9.284
92 H ASN 14 HN ASN 14 7.098 -7.751 2.471
93 HA ASN 14 HA ASN 14 8.929 -6.162 0.853
94 1HB ASN 14 HB2 ASN 14 8.990 -8.950 1.041
95 2HB ASN 14 HB1 ASN 14 8.162 -8.621 -0.478
96 1HD2 ASN 14 1HD2 ASN 14 11.095 -9.114 0.907
97 2HD2 ASN 14 2HD2 ASN 14 12.106 -8.370 -0.280
98 H ALA 15 HN ALA 15 6.302 -5.523 1.664
99 HA ALA 15 HA ALA 15 4.884 -5.648 -0.907
100 1HB ALA 15 HB1 ALA 15 3.932 -6.782 1.306
101 2HB ALA 15 HB2 ALA 15 2.885 -6.026 0.105
102 3HB ALA 15 HB3 ALA 15 3.334 -5.142 1.564
103 H LYS 16 HN LYS 16 5.391 -3.712 -1.812
104 HA LYS 16 HA LYS 16 5.320 -1.323 -0.151
105 1HB LYS 16 HB2 LYS 16 7.223 -1.410 -1.542
106 2HB LYS 16 HB1 LYS 16 6.272 -1.828 -2.959
107 1HG LYS 16 HG2 LYS 16 5.189 0.490 -2.639
108 2HG LYS 16 HG1 LYS 16 6.575 0.820 -1.598
109 1HD LYS 16 HD2 LYS 16 7.331 1.578 -3.643
110 2HD LYS 16 HD1 LYS 16 7.954 -0.073 -3.622
111 1HE LYS 16 HE2 LYS 16 6.350 -0.828 -5.128
112 2HE LYS 16 HE1 LYS 16 5.274 0.531 -4.811
113 1HZ LYS 16 HZ1 LYS 16 7.377 1.814 -5.782
114 2HZ LYS 16 HZ2 LYS 16 6.123 1.239 -6.759
115 3HZ LYS 16 HZ3 LYS 16 7.552 0.348 -6.608
116 HA PRO 17 HA PRO 17 1.215 -0.384 -1.577
117 1HB PRO 17 HB2 PRO 17 1.461 2.223 -0.357
118 2HB PRO 17 HB1 PRO 17 0.534 0.830 0.201
119 1HG PRO 17 HG2 PRO 17 2.748 1.814 1.484
120 2HG PRO 17 HG1 PRO 17 2.189 0.138 1.609
121 1HD PRO 17 HD2 PRO 17 4.404 1.281 -0.045
122 2HD PRO 17 HD1 PRO 17 4.324 -0.265 0.826
123 H THR 18 HN THR 18 0.679 0.290 -3.547
124 HA THR 18 HA THR 18 2.148 2.538 -4.731
125 HB THR 18 HB THR 18 0.764 1.275 -6.754
126 HG1 THR 18 HG1 THR 18 0.438 -0.649 -5.958
127 1HG2 THR 18 1HG2 THR 18 2.835 0.746 -7.672
128 2HG2 THR 18 2HG2 THR 18 3.599 0.628 -6.086
129 3HG2 THR 18 3HG2 THR 18 3.112 2.202 -6.718
130 H CYS 19 HN CYS 19 1.029 4.131 -5.887
131 HA CYS 19 HA CYS 19 -1.822 4.304 -5.189
132 1HB CYS 19 HB2 CYS 19 0.251 6.458 -5.600
133 2HB CYS 19 HB1 CYS 19 -1.473 6.794 -5.468
134 H ASP 20 HN ASP 20 -3.200 4.132 -6.825
135 HA ASP 20 HA ASP 20 -2.370 5.020 -9.479
136 1HB ASP 20 HB2 ASP 20 -2.496 2.443 -8.986
137 2HB ASP 20 HB1 ASP 20 -4.227 2.705 -9.167
138 H ASP 21 HN ASP 21 -3.519 6.885 -9.618
139 HA ASP 21 HA ASP 21 -5.291 8.318 -9.678
140 1HB ASP 21 HB2 ASP 21 -6.355 5.736 -10.731
141 2HB ASP 21 HB1 ASP 21 -7.497 7.041 -10.425
142 H GLY 22 HN GLY 22 -4.762 7.816 -7.147
143 1HA GLY 22 HA2 GLY 22 -5.654 7.998 -5.059
144 2HA GLY 22 HA1 GLY 22 -7.208 8.200 -5.839
145 H VAL 23 HN VAL 23 -5.614 5.342 -6.745
146 HA VAL 23 HA VAL 23 -7.274 3.797 -4.862
147 HB VAL 23 HB VAL 23 -6.344 2.919 -7.597
148 1HG1 VAL 23 1HG1 VAL 23 -6.725 0.985 -6.357
149 2HG1 VAL 23 2HG1 VAL 23 -8.259 1.246 -7.187
150 3HG1 VAL 23 3HG1 VAL 23 -8.088 1.693 -5.490
151 1HG2 VAL 23 1HG2 VAL 23 -8.018 4.864 -7.484
152 2HG2 VAL 23 2HG2 VAL 23 -9.164 3.660 -6.896
153 3HG2 VAL 23 3HG2 VAL 23 -8.428 3.474 -8.488
154 H CYS 24 HN CYS 24 -5.916 3.199 -3.266
155 HA CYS 24 HA CYS 24 -3.160 2.669 -3.610
156 1HB CYS 24 HB2 CYS 24 -4.107 3.335 -1.446
157 2HB CYS 24 HB1 CYS 24 -5.017 1.831 -1.369
158 H ASN 25 HN ASN 25 -2.029 0.704 -3.541
159 HA ASN 25 HA ASN 25 -3.402 -1.808 -3.631
160 1HB ASN 25 HB2 ASN 25 -2.871 -0.433 -6.086
161 2HB ASN 25 HB1 ASN 25 -1.918 -1.910 -6.019
162 1HD2 ASN 25 1HD2 ASN 25 -5.193 -0.667 -5.574
163 2HD2 ASN 25 2HD2 ASN 25 -5.999 -2.094 -6.120
164 H CYS 26 HN CYS 26 -2.128 -3.214 -2.649
165 HA CYS 26 HA CYS 26 0.710 -2.599 -2.366
166 1HB CYS 26 HB2 CYS 26 -0.711 -4.877 -1.011
167 2HB CYS 26 HB1 CYS 26 0.724 -4.006 -0.482
168 H ASN 27 HN ASN 27 2.325 -3.782 -3.216
169 HA ASN 27 HA ASN 27 1.719 -6.369 -4.429
170 1HB ASN 27 HB2 ASN 27 2.891 -4.003 -5.876
171 2HB ASN 27 HB1 ASN 27 3.093 -5.655 -6.452
172 1HD2 ASN 27 1HD2 ASN 27 1.502 -3.074 -7.200
173 2HD2 ASN 27 2HD2 ASN 27 -0.037 -3.710 -7.657
174 H VAL 28 HN VAL 28 4.549 -4.334 -4.826
175 HA VAL 28 HA VAL 28 6.070 -5.858 -2.884
176 HB VAL 28 HB VAL 28 6.985 -5.822 -5.759
177 1HG1 VAL 28 1HG1 VAL 28 8.491 -6.060 -3.532
178 2HG1 VAL 28 2HG1 VAL 28 8.886 -6.820 -5.074
179 3HG1 VAL 28 3HG1 VAL 28 8.071 -7.749 -3.816
180 1HG2 VAL 28 1HG2 VAL 28 5.677 -8.040 -4.190
181 2HG2 VAL 28 2HG2 VAL 28 6.483 -8.252 -5.744
182 3HG2 VAL 28 3HG2 VAL 28 5.043 -7.240 -5.628
Start of MODEL 18
1 1H VAL 1 HT1 VAL 1 -11.039 4.222 0.409
2 2H VAL 1 HT2 VAL 1 -10.301 5.466 -0.516
3 3H VAL 1 HT3 VAL 1 -11.225 5.861 0.876
4 HA VAL 1 HA VAL 1 -9.660 5.177 2.309
5 HB VAL 1 HB VAL 1 -7.733 3.724 1.604
6 1HG1 VAL 1 1HG1 VAL 1 -8.929 1.704 1.870
7 2HG1 VAL 1 2HG1 VAL 1 -10.388 2.385 1.151
8 3HG1 VAL 1 3HG1 VAL 1 -9.851 2.930 2.740
9 1HG2 VAL 1 1HG2 VAL 1 -7.512 3.796 -0.671
10 2HG2 VAL 1 2HG2 VAL 1 -9.253 3.818 -0.951
11 3HG2 VAL 1 3HG2 VAL 1 -8.450 2.312 -0.509
12 H GLY 2 HN GLY 2 -7.286 5.736 2.547
13 1HA GLY 2 HA2 GLY 2 -6.638 7.919 0.663
14 2HA GLY 2 HA1 GLY 2 -6.267 7.961 2.380
15 H CYS 3 HN CYS 3 -4.320 8.462 0.496
16 HA CYS 3 HA CYS 3 -2.809 6.136 -0.147
17 1HB CYS 3 HB2 CYS 3 -2.304 9.088 -0.234
18 2HB CYS 3 HB1 CYS 3 -0.964 7.970 -0.451
19 H GLU 4 HN GLU 4 -3.131 8.059 2.684
20 HA GLU 4 HA GLU 4 -0.575 7.283 3.790
21 1HB GLU 4 HB2 GLU 4 -2.895 8.877 4.833
22 2HB GLU 4 HB1 GLU 4 -1.543 8.430 5.864
23 1HG GLU 4 HG2 GLU 4 -0.755 9.670 3.337
24 2HG GLU 4 HG1 GLU 4 -1.715 10.711 4.387
25 H GLU 5 HN GLU 5 -3.273 5.631 3.302
26 HA GLU 5 HA GLU 5 -3.017 4.084 5.785
27 1HB GLU 5 HB2 GLU 5 -5.443 4.496 4.041
28 2HB GLU 5 HB1 GLU 5 -5.368 3.329 5.353
29 1HG GLU 5 HG2 GLU 5 -4.581 5.582 6.628
30 2HG GLU 5 HG1 GLU 5 -5.690 6.242 5.428
31 H CYS 6 HN CYS 6 -1.774 3.955 2.944
32 HA CYS 6 HA CYS 6 -2.659 1.410 1.977
33 1HB CYS 6 HB2 CYS 6 -0.627 3.406 1.118
34 2HB CYS 6 HB1 CYS 6 -0.506 1.761 0.505
35 HA PRO 7 HA PRO 7 1.568 0.022 3.726
36 1HB PRO 7 HB2 PRO 7 2.860 1.673 5.430
37 2HB PRO 7 HB1 PRO 7 3.047 1.779 3.677
38 1HG PRO 7 HG2 PRO 7 1.482 3.502 5.523
39 2HG PRO 7 HG1 PRO 7 2.330 3.931 4.028
40 1HD PRO 7 HD2 PRO 7 -0.420 3.505 4.287
41 2HD PRO 7 HD1 PRO 7 0.476 3.528 2.762
42 H MET 8 HN MET 8 -0.577 1.864 5.792
43 HA MET 8 HA MET 8 0.005 0.405 8.183
44 1HB MET 8 HB2 MET 8 -1.214 2.763 7.724
45 2HB MET 8 HB1 MET 8 -2.630 1.734 7.883
46 1HG MET 8 HG2 MET 8 -1.663 0.936 10.065
47 2HG MET 8 HG1 MET 8 -0.469 2.223 9.909
48 1HE MET 8 HE1 MET 8 -3.052 5.301 9.617
49 2HE MET 8 HE2 MET 8 -2.387 4.284 8.338
50 3HE MET 8 HE3 MET 8 -1.331 4.915 9.602
51 H HIS 9 HN HIS 9 -2.146 0.018 5.482
52 HA HIS 9 HA HIS 9 -3.729 -2.033 6.783
53 1HB HIS 9 HB2 HIS 9 -3.871 -0.476 4.290
54 2HB HIS 9 HB1 HIS 9 -4.411 -2.143 4.132
55 HD1 HIS 9 HD1 HIS 9 -5.897 -2.563 6.738
56 HD2 HIS 9 HD2 HIS 9 -6.175 0.923 4.496
57 HE1 HIS 9 HE1 HIS 9 -8.081 -1.508 7.404
58 HE2 HIS 9 HE2 HIS 9 -8.187 0.643 6.097
59 H CYS 10 HN CYS 10 -1.541 -1.847 3.976
60 HA CYS 10 HA CYS 10 -1.431 -4.693 3.669
61 1HB CYS 10 HB2 CYS 10 -0.465 -2.355 2.245
62 2HB CYS 10 HB1 CYS 10 0.763 -3.614 2.320
63 H LYS 11 HN LYS 11 1.018 -5.536 3.372
64 HA LYS 11 HA LYS 11 2.138 -5.384 6.052
65 1HB LYS 11 HB2 LYS 11 3.551 -7.279 5.310
66 2HB LYS 11 HB1 LYS 11 1.832 -7.595 5.119
67 1HG LYS 11 HG2 LYS 11 2.642 -6.483 2.693
68 2HG LYS 11 HG1 LYS 11 3.928 -7.601 3.150
69 1HD LYS 11 HD2 LYS 11 2.525 -9.035 2.045
70 2HD LYS 11 HD1 LYS 11 1.892 -9.189 3.685
71 1HE LYS 11 HE2 LYS 11 -0.030 -8.082 3.195
72 2HE LYS 11 HE1 LYS 11 0.748 -7.036 2.007
73 1HZ LYS 11 HZ1 LYS 11 0.517 -9.876 1.359
74 2HZ LYS 11 HZ2 LYS 11 0.423 -8.525 0.346
75 3HZ LYS 11 HZ3 LYS 11 -0.900 -8.951 1.310
76 H GLY 12 HN GLY 12 4.519 -5.252 6.318
77 1HA GLY 12 HA2 GLY 12 5.782 -3.588 4.237
78 2HA GLY 12 HA1 GLY 12 5.805 -3.083 5.920
79 H LYS 13 HN LYS 13 6.497 -6.086 4.120
80 HA LYS 13 HA LYS 13 9.226 -6.059 4.936
81 1HB LYS 13 HB2 LYS 13 7.304 -7.386 6.597
82 2HB LYS 13 HB1 LYS 13 8.394 -8.578 5.903
83 1HG LYS 13 HG2 LYS 13 10.310 -7.305 6.758
84 2HG LYS 13 HG1 LYS 13 9.197 -6.144 7.484
85 1HD LYS 13 HD2 LYS 13 9.725 -7.573 9.250
86 2HD LYS 13 HD1 LYS 13 8.175 -8.186 8.672
87 1HE LYS 13 HE2 LYS 13 9.891 -9.608 7.134
88 2HE LYS 13 HE1 LYS 13 10.848 -9.415 8.602
89 1HZ LYS 13 HZ1 LYS 13 9.510 -11.430 8.657
90 2HZ LYS 13 HZ2 LYS 13 8.095 -10.522 8.479
91 3HZ LYS 13 HZ3 LYS 13 9.033 -10.358 9.876
92 H ASN 14 HN ASN 14 6.559 -7.662 3.386
93 HA ASN 14 HA ASN 14 8.412 -8.762 1.453
94 1HB ASN 14 HB2 ASN 14 7.308 -10.428 3.287
95 2HB ASN 14 HB1 ASN 14 6.060 -10.458 2.045
96 1HD2 ASN 14 1HD2 ASN 14 7.245 -10.492 -0.264
97 2HD2 ASN 14 2HD2 ASN 14 8.353 -11.807 -0.426
98 H ALA 15 HN ALA 15 6.723 -6.444 1.599
99 HA ALA 15 HA ALA 15 5.595 -6.533 -0.965
100 1HB ALA 15 HB1 ALA 15 3.405 -6.968 -0.705
101 2HB ALA 15 HB2 ALA 15 3.322 -6.135 0.847
102 3HB ALA 15 HB3 ALA 15 3.934 -7.787 0.765
103 H LYS 16 HN LYS 16 5.575 -4.512 -1.724
104 HA LYS 16 HA LYS 16 5.671 -2.323 0.228
105 1HB LYS 16 HB2 LYS 16 7.628 -2.280 -1.078
106 2HB LYS 16 HB1 LYS 16 6.749 -2.601 -2.566
107 1HG LYS 16 HG2 LYS 16 6.203 -0.428 -2.870
108 2HG LYS 16 HG1 LYS 16 6.062 -0.107 -1.140
109 1HD LYS 16 HD2 LYS 16 8.229 0.493 -0.947
110 2HD LYS 16 HD1 LYS 16 8.777 -0.738 -2.086
111 1HE LYS 16 HE2 LYS 16 7.604 0.789 -3.851
112 2HE LYS 16 HE1 LYS 16 7.784 2.030 -2.611
113 1HZ LYS 16 HZ1 LYS 16 9.739 2.281 -3.714
114 2HZ LYS 16 HZ2 LYS 16 9.837 0.658 -4.180
115 3HZ LYS 16 HZ3 LYS 16 10.229 1.108 -2.598
116 HA PRO 17 HA PRO 17 1.687 -1.119 -1.359
117 1HB PRO 17 HB2 PRO 17 1.244 0.948 0.269
118 2HB PRO 17 HB1 PRO 17 1.266 -0.710 0.880
119 1HG PRO 17 HG2 PRO 17 3.373 1.402 1.046
120 2HG PRO 17 HG1 PRO 17 2.880 0.214 2.264
121 1HD PRO 17 HD2 PRO 17 5.085 -0.031 0.592
122 2HD PRO 17 HD1 PRO 17 4.289 -1.373 1.436
123 H THR 18 HN THR 18 0.837 0.368 -2.761
124 HA THR 18 HA THR 18 2.129 2.901 -3.222
125 HB THR 18 HB THR 18 3.256 0.934 -4.594
126 HG1 THR 18 HG1 THR 18 3.660 3.266 -4.653
127 1HG2 THR 18 1HG2 THR 18 2.433 0.833 -6.860
128 2HG2 THR 18 2HG2 THR 18 1.064 1.855 -6.421
129 3HG2 THR 18 3HG2 THR 18 1.213 0.240 -5.733
130 H CYS 19 HN CYS 19 0.628 4.379 -3.708
131 HA CYS 19 HA CYS 19 -1.990 3.395 -4.607
132 1HB CYS 19 HB2 CYS 19 -2.958 5.376 -3.613
133 2HB CYS 19 HB1 CYS 19 -1.954 4.553 -2.424
134 H ASP 20 HN ASP 20 -3.171 4.596 -6.150
135 HA ASP 20 HA ASP 20 -1.640 6.450 -7.790
136 1HB ASP 20 HB2 ASP 20 -1.797 3.947 -8.579
137 2HB ASP 20 HB1 ASP 20 -3.407 4.432 -9.090
138 H ASP 21 HN ASP 21 -2.770 8.299 -7.613
139 HA ASP 21 HA ASP 21 -4.523 9.756 -7.453
140 1HB ASP 21 HB2 ASP 21 -5.169 7.921 -9.709
141 2HB ASP 21 HB1 ASP 21 -6.430 9.027 -9.173
142 H GLY 22 HN GLY 22 -4.642 8.235 -5.306
143 1HA GLY 22 HA2 GLY 22 -6.098 7.763 -3.606
144 2HA GLY 22 HA1 GLY 22 -7.405 8.143 -4.704
145 H VAL 23 HN VAL 23 -5.236 5.853 -5.955
146 HA VAL 23 HA VAL 23 -7.115 3.687 -5.284
147 HB VAL 23 HB VAL 23 -5.242 3.811 -7.650
148 1HG1 VAL 23 1HG1 VAL 23 -5.645 1.589 -7.526
149 2HG1 VAL 23 2HG1 VAL 23 -7.145 2.046 -8.333
150 3HG1 VAL 23 3HG1 VAL 23 -7.123 1.798 -6.587
151 1HG2 VAL 23 1HG2 VAL 23 -8.225 4.219 -7.683
152 2HG2 VAL 23 2HG2 VAL 23 -7.089 4.419 -9.017
153 3HG2 VAL 23 3HG2 VAL 23 -7.063 5.546 -7.660
154 H CYS 24 HN CYS 24 -6.217 2.779 -3.493
155 HA CYS 24 HA CYS 24 -3.424 2.424 -3.121
156 1HB CYS 24 HB2 CYS 24 -5.290 2.522 -1.344
157 2HB CYS 24 HB1 CYS 24 -5.540 0.818 -1.708
158 H ASN 25 HN ASN 25 -2.111 0.720 -3.531
159 HA ASN 25 HA ASN 25 -3.125 -1.866 -4.219
160 1HB ASN 25 HB2 ASN 25 -1.952 -1.845 -6.490
161 2HB ASN 25 HB1 ASN 25 -3.488 -0.992 -6.382
162 1HD2 ASN 25 1HD2 ASN 25 -0.351 -0.805 -7.416
163 2HD2 ASN 25 2HD2 ASN 25 -0.225 0.907 -7.607
164 H CYS 26 HN CYS 26 -1.734 -3.310 -3.508
165 HA CYS 26 HA CYS 26 1.034 -2.477 -2.990
166 1HB CYS 26 HB2 CYS 26 -0.308 -4.936 -1.874
167 2HB CYS 26 HB1 CYS 26 1.125 -4.111 -1.272
168 H ASN 27 HN ASN 27 2.775 -3.918 -3.498
169 HA ASN 27 HA ASN 27 2.105 -5.920 -5.547
170 1HB ASN 27 HB2 ASN 27 4.112 -3.712 -5.624
171 2HB ASN 27 HB1 ASN 27 4.470 -5.215 -6.469
172 1HD2 ASN 27 1HD2 ASN 27 4.446 -3.869 -8.375
173 2HD2 ASN 27 2HD2 ASN 27 2.939 -3.505 -9.139
174 H VAL 28 HN VAL 28 5.358 -5.172 -4.558
175 HA VAL 28 HA VAL 28 5.480 -7.408 -2.715
176 HB VAL 28 HB VAL 28 5.800 -8.498 -4.887
177 1HG1 VAL 28 1HG1 VAL 28 6.719 -7.206 -6.473
178 2HG1 VAL 28 2HG1 VAL 28 8.252 -7.791 -5.826
179 3HG1 VAL 28 3HG1 VAL 28 7.613 -6.232 -5.305
180 1HG2 VAL 28 1HG2 VAL 28 7.075 -9.149 -2.769
181 2HG2 VAL 28 2HG2 VAL 28 8.478 -8.400 -3.532
182 3HG2 VAL 28 3HG2 VAL 28 7.680 -9.770 -4.305
Start of MODEL 19
1 1H VAL 1 HT1 VAL 1 -9.317 2.569 4.716
2 2H VAL 1 HT2 VAL 1 -9.516 2.783 3.024
3 3H VAL 1 HT3 VAL 1 -9.770 4.101 4.094
4 HA VAL 1 HA VAL 1 -7.589 4.391 4.510
5 HB VAL 1 HB VAL 1 -5.859 2.700 3.903
6 1HG1 VAL 1 1HG1 VAL 1 -7.659 1.208 5.700
7 2HG1 VAL 1 2HG1 VAL 1 -7.329 2.882 6.148
8 3HG1 VAL 1 3HG1 VAL 1 -5.997 1.745 5.944
9 1HG2 VAL 1 1HG2 VAL 1 -6.731 1.327 2.273
10 2HG2 VAL 1 2HG2 VAL 1 -8.294 1.185 3.077
11 3HG2 VAL 1 3HG2 VAL 1 -6.898 0.310 3.704
12 H GLY 2 HN GLY 2 -6.706 5.801 3.148
13 1HA GLY 2 HA2 GLY 2 -7.220 5.490 0.286
14 2HA GLY 2 HA1 GLY 2 -6.690 6.959 1.091
15 H CYS 3 HN CYS 3 -4.825 7.513 0.159
16 HA CYS 3 HA CYS 3 -2.888 5.454 -0.554
17 1HB CYS 3 HB2 CYS 3 -3.489 8.162 -1.450
18 2HB CYS 3 HB1 CYS 3 -1.766 7.915 -1.187
19 H GLU 4 HN GLU 4 -3.394 7.964 1.799
20 HA GLU 4 HA GLU 4 -0.657 7.782 2.769
21 1HB GLU 4 HB2 GLU 4 -2.135 9.931 2.582
22 2HB GLU 4 HB1 GLU 4 -2.798 9.372 4.112
23 1HG GLU 4 HG2 GLU 4 -0.325 9.238 4.857
24 2HG GLU 4 HG1 GLU 4 -0.029 10.297 3.479
25 H GLU 5 HN GLU 5 -3.238 5.929 3.108
26 HA GLU 5 HA GLU 5 -2.720 5.330 5.936
27 1HB GLU 5 HB2 GLU 5 -5.221 5.117 4.291
28 2HB GLU 5 HB1 GLU 5 -5.019 4.150 5.746
29 1HG GLU 5 HG2 GLU 5 -4.807 7.149 5.669
30 2HG GLU 5 HG1 GLU 5 -6.276 6.265 6.079
31 H CYS 6 HN CYS 6 -1.487 4.341 3.289
32 HA CYS 6 HA CYS 6 -2.156 1.555 3.259
33 1HB CYS 6 HB2 CYS 6 -0.607 3.374 1.606
34 2HB CYS 6 HB1 CYS 6 0.196 1.823 1.820
35 HA PRO 7 HA PRO 7 2.498 1.519 5.051
36 1HB PRO 7 HB2 PRO 7 1.875 3.839 6.833
37 2HB PRO 7 HB1 PRO 7 3.419 3.350 6.126
38 1HG PRO 7 HG2 PRO 7 2.040 5.391 5.104
39 2HG PRO 7 HG1 PRO 7 2.912 4.260 4.053
40 1HD PRO 7 HD2 PRO 7 -0.013 4.498 4.559
41 2HD PRO 7 HD1 PRO 7 0.834 3.972 3.096
42 H MET 8 HN MET 8 -0.560 2.321 6.521
43 HA MET 8 HA MET 8 -0.005 0.813 8.943
44 1HB MET 8 HB2 MET 8 -2.477 2.275 7.992
45 2HB MET 8 HB1 MET 8 -2.317 1.496 9.562
46 1HG MET 8 HG2 MET 8 -1.653 3.487 10.293
47 2HG MET 8 HG1 MET 8 -0.121 3.119 9.503
48 1HE MET 8 HE1 MET 8 0.948 4.610 8.653
49 2HE MET 8 HE2 MET 8 0.362 6.271 8.566
50 3HE MET 8 HE3 MET 8 0.574 5.332 7.089
51 H HIS 9 HN HIS 9 -1.834 0.564 5.966
52 HA HIS 9 HA HIS 9 -2.933 -2.016 6.798
53 1HB HIS 9 HB2 HIS 9 -4.718 -1.543 5.499
54 2HB HIS 9 HB1 HIS 9 -4.118 0.095 5.554
55 HD1 HIS 9 HD1 HIS 9 -3.492 -2.944 3.329
56 HD2 HIS 9 HD2 HIS 9 -4.108 1.149 3.139
57 HE1 HIS 9 HE1 HIS 9 -3.474 -2.384 0.875
58 HE2 HIS 9 HE2 HIS 9 -3.997 0.081 0.779
59 H CYS 10 HN CYS 10 -2.213 -3.888 6.031
60 HA CYS 10 HA CYS 10 -1.243 -5.434 4.637
61 1HB CYS 10 HB2 CYS 10 -1.765 -3.509 2.813
62 2HB CYS 10 HB1 CYS 10 -0.007 -3.475 2.787
63 H LYS 11 HN LYS 11 0.188 -5.903 6.301
64 HA LYS 11 HA LYS 11 2.840 -4.636 6.078
65 1HB LYS 11 HB2 LYS 11 1.445 -5.804 8.488
66 2HB LYS 11 HB1 LYS 11 3.151 -5.377 8.470
67 1HG LYS 11 HG2 LYS 11 1.470 -3.204 7.540
68 2HG LYS 11 HG1 LYS 11 1.050 -3.732 9.170
69 1HD LYS 11 HD2 LYS 11 3.910 -3.261 8.420
70 2HD LYS 11 HD1 LYS 11 2.866 -1.905 8.851
71 1HE LYS 11 HE2 LYS 11 4.062 -2.658 10.808
72 2HE LYS 11 HE1 LYS 11 2.346 -3.022 10.987
73 1HZ LYS 11 HZ1 LYS 11 4.341 -5.000 10.038
74 2HZ LYS 11 HZ2 LYS 11 2.740 -5.293 10.498
75 3HZ LYS 11 HZ3 LYS 11 3.884 -4.844 11.660
76 H GLY 12 HN GLY 12 4.308 -5.918 5.186
77 1HA GLY 12 HA2 GLY 12 4.298 -8.771 5.882
78 2HA GLY 12 HA1 GLY 12 4.338 -8.302 4.190
79 H LYS 13 HN LYS 13 6.249 -7.789 3.269
80 HA LYS 13 HA LYS 13 8.517 -6.979 4.799
81 1HB LYS 13 HB2 LYS 13 8.578 -9.378 5.237
82 2HB LYS 13 HB1 LYS 13 8.506 -9.708 3.512
83 1HG LYS 13 HG2 LYS 13 10.685 -8.454 3.302
84 2HG LYS 13 HG1 LYS 13 10.764 -8.476 5.065
85 1HD LYS 13 HD2 LYS 13 10.552 -10.916 3.301
86 2HD LYS 13 HD1 LYS 13 12.041 -10.319 4.036
87 1HE LYS 13 HE2 LYS 13 10.723 -10.498 6.259
88 2HE LYS 13 HE1 LYS 13 9.646 -11.552 5.343
89 1HZ LYS 13 HZ1 LYS 13 11.367 -13.077 4.961
90 2HZ LYS 13 HZ2 LYS 13 11.518 -12.659 6.593
91 3HZ LYS 13 HZ3 LYS 13 12.571 -11.993 5.449
92 H ASN 14 HN ASN 14 7.344 -8.261 1.725
93 HA ASN 14 HA ASN 14 9.040 -6.318 0.362
94 1HB ASN 14 HB2 ASN 14 8.445 -9.174 -0.328
95 2HB ASN 14 HB1 ASN 14 8.812 -8.024 -1.609
96 1HD2 ASN 14 1HD2 ASN 14 10.750 -6.496 -0.656
97 2HD2 ASN 14 2HD2 ASN 14 12.147 -7.425 -0.242
98 H ALA 15 HN ALA 15 6.425 -5.923 1.377
99 HA ALA 15 HA ALA 15 4.879 -5.691 -1.113
100 1HB ALA 15 HB1 ALA 15 3.373 -5.412 1.376
101 2HB ALA 15 HB2 ALA 15 4.118 -6.996 1.159
102 3HB ALA 15 HB3 ALA 15 3.018 -6.364 -0.066
103 H LYS 16 HN LYS 16 5.414 -3.673 -1.805
104 HA LYS 16 HA LYS 16 5.213 -1.463 0.109
105 1HB LYS 16 HB2 LYS 16 7.293 -1.527 -1.121
106 2HB LYS 16 HB1 LYS 16 6.429 -1.576 -2.650
107 1HG LYS 16 HG2 LYS 16 7.031 0.628 -2.554
108 2HG LYS 16 HG1 LYS 16 5.430 0.693 -1.815
109 1HD LYS 16 HD2 LYS 16 6.488 1.803 -0.169
110 2HD LYS 16 HD1 LYS 16 6.986 0.192 0.352
111 1HE LYS 16 HE2 LYS 16 8.641 1.587 -1.687
112 2HE LYS 16 HE1 LYS 16 8.735 2.144 -0.017
113 1HZ LYS 16 HZ1 LYS 16 9.498 -0.465 -1.146
114 2HZ LYS 16 HZ2 LYS 16 9.068 -0.352 0.486
115 3HZ LYS 16 HZ3 LYS 16 10.371 0.548 -0.108
116 HA PRO 17 HA PRO 17 1.286 -0.373 -1.650
117 1HB PRO 17 HB2 PRO 17 1.026 2.080 -0.542
118 2HB PRO 17 HB1 PRO 17 0.837 0.591 0.390
119 1HG PRO 17 HG2 PRO 17 3.207 2.410 0.187
120 2HG PRO 17 HG1 PRO 17 2.510 1.638 1.624
121 1HD PRO 17 HD2 PRO 17 4.707 0.669 0.353
122 2HD PRO 17 HD1 PRO 17 3.546 -0.375 1.198
123 H THR 18 HN THR 18 0.530 0.711 -3.402
124 HA THR 18 HA THR 18 2.238 2.789 -4.577
125 HB THR 18 HB THR 18 2.425 0.498 -5.685
126 HG1 THR 18 HG1 THR 18 2.985 1.599 -7.373
127 1HG2 THR 18 1HG2 THR 18 0.692 -0.494 -6.626
128 2HG2 THR 18 2HG2 THR 18 0.147 1.007 -7.374
129 3HG2 THR 18 3HG2 THR 18 -0.317 0.629 -5.717
130 H CYS 19 HN CYS 19 1.191 4.440 -5.704
131 HA CYS 19 HA CYS 19 -1.678 4.635 -5.115
132 1HB CYS 19 HB2 CYS 19 0.467 6.697 -5.558
133 2HB CYS 19 HB1 CYS 19 -1.239 7.117 -5.676
134 H ASP 20 HN ASP 20 -3.020 4.235 -6.731
135 HA ASP 20 HA ASP 20 -2.262 5.031 -9.436
136 1HB ASP 20 HB2 ASP 20 -2.257 2.479 -8.817
137 2HB ASP 20 HB1 ASP 20 -4.001 2.648 -8.981
138 H ASP 21 HN ASP 21 -3.518 6.779 -9.771
139 HA ASP 21 HA ASP 21 -5.355 8.122 -9.902
140 1HB ASP 21 HB2 ASP 21 -6.709 5.449 -10.333
141 2HB ASP 21 HB1 ASP 21 -7.431 7.016 -10.688
142 H GLY 22 HN GLY 22 -4.657 7.853 -7.359
143 1HA GLY 22 HA2 GLY 22 -5.433 8.211 -5.247
144 2HA GLY 22 HA1 GLY 22 -7.026 8.353 -5.956
145 H VAL 23 HN VAL 23 -5.398 5.425 -6.631
146 HA VAL 23 HA VAL 23 -6.992 4.052 -4.566
147 HB VAL 23 HB VAL 23 -6.185 2.948 -7.258
148 1HG1 VAL 23 1HG1 VAL 23 -6.521 1.053 -6.045
149 2HG1 VAL 23 2HG1 VAL 23 -8.196 1.386 -6.485
150 3HG1 VAL 23 3HG1 VAL 23 -7.594 1.847 -4.893
151 1HG2 VAL 23 1HG2 VAL 23 -7.773 4.722 -7.604
152 2HG2 VAL 23 2HG2 VAL 23 -8.821 4.085 -6.336
153 3HG2 VAL 23 3HG2 VAL 23 -8.589 3.175 -7.829
154 H CYS 24 HN CYS 24 -5.570 3.577 -2.982
155 HA CYS 24 HA CYS 24 -2.834 2.910 -3.507
156 1HB CYS 24 HB2 CYS 24 -3.975 3.984 -1.374
157 2HB CYS 24 HB1 CYS 24 -4.119 2.300 -0.881
158 H ASN 25 HN ASN 25 -1.808 0.918 -3.263
159 HA ASN 25 HA ASN 25 -3.280 -1.451 -2.614
160 1HB ASN 25 HB2 ASN 25 -3.154 -0.616 -5.344
161 2HB ASN 25 HB1 ASN 25 -2.239 -2.106 -5.153
162 1HD2 ASN 25 1HD2 ASN 25 -3.332 -3.928 -5.245
163 2HD2 ASN 25 2HD2 ASN 25 -5.038 -4.101 -5.029
164 H CYS 26 HN CYS 26 -1.935 -2.774 -1.624
165 HA CYS 26 HA CYS 26 0.915 -2.300 -1.732
166 1HB CYS 26 HB2 CYS 26 1.003 -4.096 0.011
167 2HB CYS 26 HB1 CYS 26 -0.029 -2.736 0.438
168 H ASN 27 HN ASN 27 2.332 -3.378 -2.945
169 HA ASN 27 HA ASN 27 1.638 -6.048 -3.921
170 1HB ASN 27 HB2 ASN 27 2.451 -3.699 -5.617
171 2HB ASN 27 HB1 ASN 27 2.627 -5.361 -6.171
172 1HD2 ASN 27 1HD2 ASN 27 1.016 -3.339 -7.354
173 2HD2 ASN 27 2HD2 ASN 27 -0.626 -3.872 -7.275
174 H VAL 28 HN VAL 28 4.306 -4.063 -5.005
175 HA VAL 28 HA VAL 28 6.156 -5.709 -3.419
176 HB VAL 28 HB VAL 28 6.670 -4.876 -6.273
177 1HG1 VAL 28 1HG1 VAL 28 8.538 -5.377 -4.498
178 2HG1 VAL 28 2HG1 VAL 28 8.668 -5.996 -6.144
179 3HG1 VAL 28 3HG1 VAL 28 8.116 -7.054 -4.845
180 1HG2 VAL 28 1HG2 VAL 28 4.858 -6.468 -6.276
181 2HG2 VAL 28 2HG2 VAL 28 5.748 -7.535 -5.190
182 3HG2 VAL 28 3HG2 VAL 28 6.330 -7.263 -6.833
Start of MODEL 20
1 1H VAL 1 HT1 VAL 1 -9.247 4.901 0.292
2 2H VAL 1 HT2 VAL 1 -9.522 6.594 0.337
3 3H VAL 1 HT3 VAL 1 -10.430 5.548 1.350
4 HA VAL 1 HA VAL 1 -8.927 6.379 2.783
5 HB VAL 1 HB VAL 1 -7.276 4.092 1.750
6 1HG1 VAL 1 1HG1 VAL 1 -7.508 3.714 4.391
7 2HG1 VAL 1 2HG1 VAL 1 -7.724 5.464 4.328
8 3HG1 VAL 1 3HG1 VAL 1 -6.262 4.732 3.668
9 1HG2 VAL 1 1HG2 VAL 1 -8.891 2.662 3.167
10 2HG2 VAL 1 2HG2 VAL 1 -9.379 3.117 1.534
11 3HG2 VAL 1 3HG2 VAL 1 -10.032 3.985 2.924
12 H GLY 2 HN GLY 2 -6.648 6.933 3.322
13 1HA GLY 2 HA2 GLY 2 -5.553 8.583 1.241
14 2HA GLY 2 HA1 GLY 2 -4.928 8.412 2.874
15 H CYS 3 HN CYS 3 -2.876 8.528 1.567
16 HA CYS 3 HA CYS 3 -2.169 5.922 0.410
17 1HB CYS 3 HB2 CYS 3 -1.791 8.330 -0.695
18 2HB CYS 3 HB1 CYS 3 -0.300 8.229 0.235
19 H GLU 4 HN GLU 4 -1.414 8.158 2.977
20 HA GLU 4 HA GLU 4 0.931 6.674 3.804
21 1HB GLU 4 HB2 GLU 4 0.552 9.232 3.972
22 2HB GLU 4 HB1 GLU 4 -0.382 8.835 5.408
23 1HG GLU 4 HG2 GLU 4 1.654 7.629 6.262
24 2HG GLU 4 HG1 GLU 4 2.541 8.344 4.916
25 H GLU 5 HN GLU 5 -2.195 6.048 4.034
26 HA GLU 5 HA GLU 5 -2.052 4.964 6.756
27 1HB GLU 5 HB2 GLU 5 -4.342 5.887 5.060
28 2HB GLU 5 HB1 GLU 5 -4.620 4.715 6.341
29 1HG GLU 5 HG2 GLU 5 -4.385 6.239 7.966
30 2HG GLU 5 HG1 GLU 5 -3.067 7.070 7.141
31 H CYS 6 HN CYS 6 -2.408 4.171 3.403
32 HA CYS 6 HA CYS 6 -3.514 1.629 3.602
33 1HB CYS 6 HB2 CYS 6 -1.821 3.003 1.575
34 2HB CYS 6 HB1 CYS 6 -2.080 1.269 1.418
35 HA PRO 7 HA PRO 7 1.274 0.210 3.723
36 1HB PRO 7 HB2 PRO 7 1.856 2.300 5.783
37 2HB PRO 7 HB1 PRO 7 2.932 1.583 4.576
38 1HG PRO 7 HG2 PRO 7 1.920 4.025 4.218
39 2HG PRO 7 HG1 PRO 7 2.103 2.903 2.858
40 1HD PRO 7 HD2 PRO 7 -0.363 3.733 4.305
41 2HD PRO 7 HD1 PRO 7 -0.162 3.263 2.610
42 H MET 8 HN MET 8 -0.836 1.508 6.178
43 HA MET 8 HA MET 8 -0.043 -0.212 8.306
44 1HB MET 8 HB2 MET 8 -1.241 1.972 8.577
45 2HB MET 8 HB1 MET 8 -2.677 1.217 7.892
46 1HG MET 8 HG2 MET 8 -2.903 -0.241 9.741
47 2HG MET 8 HG1 MET 8 -1.303 0.175 10.354
48 1HE MET 8 HE1 MET 8 -4.632 1.308 9.316
49 2HE MET 8 HE2 MET 8 -4.428 3.053 9.472
50 3HE MET 8 HE3 MET 8 -5.266 2.147 10.732
51 H HIS 9 HN HIS 9 -2.669 -0.212 5.944
52 HA HIS 9 HA HIS 9 -3.898 -2.588 6.867
53 1HB HIS 9 HB2 HIS 9 -5.418 -2.254 5.161
54 2HB HIS 9 HB1 HIS 9 -4.779 -0.639 5.340
55 HD1 HIS 9 HD1 HIS 9 -3.805 -3.671 3.218
56 HD2 HIS 9 HD2 HIS 9 -4.382 0.423 2.961
57 HE1 HIS 9 HE1 HIS 9 -3.346 -3.085 0.816
58 HE2 HIS 9 HE2 HIS 9 -3.801 -0.611 0.660
59 H CYS 10 HN CYS 10 -1.195 -1.972 4.799
60 HA CYS 10 HA CYS 10 -1.033 -4.855 4.210
61 1HB CYS 10 HB2 CYS 10 -1.313 -2.903 2.317
62 2HB CYS 10 HB1 CYS 10 0.437 -3.061 2.396
63 H LYS 11 HN LYS 11 0.223 -5.225 6.067
64 HA LYS 11 HA LYS 11 2.943 -4.096 5.946
65 1HB LYS 11 HB2 LYS 11 1.549 -5.120 8.422
66 2HB LYS 11 HB1 LYS 11 3.096 -4.288 8.340
67 1HG LYS 11 HG2 LYS 11 0.827 -2.808 7.207
68 2HG LYS 11 HG1 LYS 11 0.749 -3.099 8.946
69 1HD LYS 11 HD2 LYS 11 3.192 -1.974 7.596
70 2HD LYS 11 HD1 LYS 11 1.887 -0.954 8.206
71 1HE LYS 11 HE2 LYS 11 2.228 -1.746 10.440
72 2HE LYS 11 HE1 LYS 11 3.377 -2.963 9.886
73 1HZ LYS 11 HZ1 LYS 11 5.014 -1.422 9.596
74 2HZ LYS 11 HZ2 LYS 11 4.188 -0.704 10.885
75 3HZ LYS 11 HZ3 LYS 11 3.941 -0.145 9.308
76 H GLY 12 HN GLY 12 4.370 -5.541 5.264
77 1HA GLY 12 HA2 GLY 12 4.220 -8.274 6.312
78 2HA GLY 12 HA1 GLY 12 4.284 -8.046 4.572
79 H LYS 13 HN LYS 13 6.214 -7.720 3.603
80 HA LYS 13 HA LYS 13 8.508 -6.793 5.011
81 1HB LYS 13 HB2 LYS 13 7.977 -9.610 4.957
82 2HB LYS 13 HB1 LYS 13 9.435 -9.277 4.035
83 1HG LYS 13 HG2 LYS 13 10.613 -8.634 5.859
84 2HG LYS 13 HG1 LYS 13 9.198 -7.970 6.676
85 1HD LYS 13 HD2 LYS 13 8.968 -9.836 7.863
86 2HD LYS 13 HD1 LYS 13 8.868 -10.795 6.385
87 1HE LYS 13 HE2 LYS 13 10.687 -11.563 7.823
88 2HE LYS 13 HE1 LYS 13 11.300 -10.931 6.296
89 1HZ LYS 13 HZ1 LYS 13 12.695 -9.985 7.852
90 2HZ LYS 13 HZ2 LYS 13 11.465 -9.743 8.987
91 3HZ LYS 13 HZ3 LYS 13 11.557 -8.755 7.617
92 H ASN 14 HN ASN 14 7.163 -8.312 2.146
93 HA ASN 14 HA ASN 14 9.020 -6.751 0.535
94 1HB ASN 14 HB2 ASN 14 8.198 -9.623 0.201
95 2HB ASN 14 HB1 ASN 14 8.732 -8.672 -1.182
96 1HD2 ASN 14 1HD2 ASN 14 10.823 -7.388 -0.644
97 2HD2 ASN 14 2HD2 ASN 14 12.081 -8.325 0.080
98 H ALA 15 HN ALA 15 6.448 -6.052 1.483
99 HA ALA 15 HA ALA 15 5.023 -5.858 -1.074
100 1HB ALA 15 HB1 ALA 15 2.993 -5.722 0.746
101 2HB ALA 15 HB2 ALA 15 4.057 -6.929 1.467
102 3HB ALA 15 HB3 ALA 15 3.442 -7.161 -0.170
103 H LYS 16 HN LYS 16 5.305 -3.778 -1.637
104 HA LYS 16 HA LYS 16 5.011 -1.726 0.442
105 1HB LYS 16 HB2 LYS 16 7.122 -1.610 -0.728
106 2HB LYS 16 HB1 LYS 16 6.302 -1.580 -2.282
107 1HG LYS 16 HG2 LYS 16 6.654 0.633 -2.098
108 2HG LYS 16 HG1 LYS 16 5.177 0.570 -1.136
109 1HD LYS 16 HD2 LYS 16 6.312 1.424 0.574
110 2HD LYS 16 HD1 LYS 16 7.278 -0.052 0.622
111 1HE LYS 16 HE2 LYS 16 7.874 2.532 -0.790
112 2HE LYS 16 HE1 LYS 16 8.827 1.714 0.447
113 1HZ LYS 16 HZ1 LYS 16 8.607 1.133 -2.416
114 2HZ LYS 16 HZ2 LYS 16 8.885 -0.159 -1.360
115 3HZ LYS 16 HZ3 LYS 16 9.973 1.135 -1.417
116 HA PRO 17 HA PRO 17 1.120 -0.630 -1.402
117 1HB PRO 17 HB2 PRO 17 0.640 1.618 -0.009
118 2HB PRO 17 HB1 PRO 17 0.565 0.020 0.745
119 1HG PRO 17 HG2 PRO 17 2.767 2.048 0.818
120 2HG PRO 17 HG1 PRO 17 2.116 1.056 2.136
121 1HD PRO 17 HD2 PRO 17 4.412 0.446 0.783
122 2HD PRO 17 HD1 PRO 17 3.370 -0.773 1.543
123 H THR 18 HN THR 18 0.329 0.728 -2.982
124 HA THR 18 HA THR 18 1.925 3.054 -3.739
125 HB THR 18 HB THR 18 2.668 1.093 -5.090
126 HG1 THR 18 HG1 THR 18 2.974 3.046 -6.043
127 1HG2 THR 18 1HG2 THR 18 -0.147 0.802 -5.483
128 2HG2 THR 18 2HG2 THR 18 1.168 -0.287 -5.920
129 3HG2 THR 18 3HG2 THR 18 0.679 0.998 -7.026
130 H CYS 19 HN CYS 19 0.816 4.604 -5.036
131 HA CYS 19 HA CYS 19 -2.116 4.342 -4.891
132 1HB CYS 19 HB2 CYS 19 -0.297 6.656 -4.344
133 2HB CYS 19 HB1 CYS 19 -1.935 6.958 -4.913
134 H ASP 20 HN ASP 20 -3.094 4.262 -6.800
135 HA ASP 20 HA ASP 20 -1.885 5.644 -9.070
136 1HB ASP 20 HB2 ASP 20 -1.734 3.027 -8.954
137 2HB ASP 20 HB1 ASP 20 -3.414 3.111 -9.468
138 H ASP 21 HN ASP 21 -3.221 7.342 -9.346
139 HA ASP 21 HA ASP 21 -5.125 8.568 -9.613
140 1HB ASP 21 HB2 ASP 21 -5.616 6.025 -11.100
141 2HB ASP 21 HB1 ASP 21 -6.955 7.154 -10.918
142 H GLY 22 HN GLY 22 -5.012 7.786 -7.089
143 1HA GLY 22 HA2 GLY 22 -6.308 7.640 -5.220
144 2HA GLY 22 HA1 GLY 22 -7.698 7.749 -6.278
145 H VAL 23 HN VAL 23 -5.518 5.227 -7.018
146 HA VAL 23 HA VAL 23 -7.343 3.284 -5.763
147 HB VAL 23 HB VAL 23 -5.585 2.828 -8.175
148 1HG1 VAL 23 1HG1 VAL 23 -6.599 0.969 -6.497
149 2HG1 VAL 23 2HG1 VAL 23 -6.307 0.695 -8.215
150 3HG1 VAL 23 3HG1 VAL 23 -7.923 1.121 -7.652
151 1HG2 VAL 23 1HG2 VAL 23 -8.499 2.857 -8.531
152 2HG2 VAL 23 2HG2 VAL 23 -7.221 3.505 -9.560
153 3HG2 VAL 23 3HG2 VAL 23 -7.781 4.426 -8.165
154 H CYS 24 HN CYS 24 -6.360 2.816 -3.861
155 HA CYS 24 HA CYS 24 -3.533 2.562 -3.574
156 1HB CYS 24 HB2 CYS 24 -5.731 2.790 -1.851
157 2HB CYS 24 HB1 CYS 24 -5.035 1.214 -1.493
158 H ASN 25 HN ASN 25 -2.254 0.788 -3.628
159 HA ASN 25 HA ASN 25 -3.315 -1.870 -3.545
160 1HB ASN 25 HB2 ASN 25 -3.018 -0.590 -6.081
161 2HB ASN 25 HB1 ASN 25 -1.862 -1.910 -5.963
162 1HD2 ASN 25 1HD2 ASN 25 -3.154 -2.834 -7.688
163 2HD2 ASN 25 2HD2 ASN 25 -4.578 -3.727 -7.287
164 H CYS 26 HN CYS 26 -1.872 -3.089 -2.556
165 HA CYS 26 HA CYS 26 0.932 -2.212 -2.533
166 1HB CYS 26 HB2 CYS 26 1.092 -3.718 -0.498
167 2HB CYS 26 HB1 CYS 26 0.085 -2.286 -0.314
168 H ASN 27 HN ASN 27 2.474 -3.428 -3.423
169 HA ASN 27 HA ASN 27 1.855 -6.222 -4.084
170 1HB ASN 27 HB2 ASN 27 2.790 -4.035 -5.873
171 2HB ASN 27 HB1 ASN 27 3.414 -5.658 -6.154
172 1HD2 ASN 27 1HD2 ASN 27 0.942 -3.526 -6.800
173 2HD2 ASN 27 2HD2 ASN 27 -0.215 -4.641 -7.433
174 H VAL 28 HN VAL 28 4.689 -4.258 -4.743
175 HA VAL 28 HA VAL 28 6.218 -5.729 -2.733
176 HB VAL 28 HB VAL 28 6.519 -6.995 -4.808
177 1HG1 VAL 28 1HG1 VAL 28 6.176 -4.833 -6.214
178 2HG1 VAL 28 2HG1 VAL 28 7.235 -6.109 -6.814
179 3HG1 VAL 28 3HG1 VAL 28 7.926 -4.674 -6.056
180 1HG2 VAL 28 1HG2 VAL 28 8.847 -7.199 -4.696
181 2HG2 VAL 28 2HG2 VAL 28 8.391 -6.576 -3.111
182 3HG2 VAL 28 3HG2 VAL 28 9.070 -5.490 -4.322
Start of MODEL 21
1 1H VAL 1 HT1 VAL 1 -9.910 3.337 2.416
2 2H VAL 1 HT2 VAL 1 -9.379 1.723 2.652
3 3H VAL 1 HT3 VAL 1 -8.986 2.555 1.203
4 HA VAL 1 HA VAL 1 -8.170 3.650 3.773
5 HB VAL 1 HB VAL 1 -6.025 2.413 3.557
6 1HG1 VAL 1 1HG1 VAL 1 -6.754 0.498 4.707
7 2HG1 VAL 1 2HG1 VAL 1 -8.295 0.466 3.849
8 3HG1 VAL 1 3HG1 VAL 1 -7.977 1.724 5.044
9 1HG2 VAL 1 1HG2 VAL 1 -5.833 1.652 1.394
10 2HG2 VAL 1 2HG2 VAL 1 -7.514 1.127 1.314
11 3HG2 VAL 1 3HG2 VAL 1 -6.337 0.181 2.225
12 H GLY 2 HN GLY 2 -7.008 5.443 3.441
13 1HA GLY 2 HA2 GLY 2 -6.757 6.585 0.886
14 2HA GLY 2 HA1 GLY 2 -5.948 7.154 2.339
15 H CYS 3 HN CYS 3 -4.107 7.671 1.063
16 HA CYS 3 HA CYS 3 -2.591 5.335 0.110
17 1HB CYS 3 HB2 CYS 3 -3.204 7.441 -1.380
18 2HB CYS 3 HB1 CYS 3 -1.782 8.119 -0.596
19 H GLU 4 HN GLU 4 -2.602 7.997 2.330
20 HA GLU 4 HA GLU 4 0.200 7.646 3.011
21 1HB GLU 4 HB2 GLU 4 -1.936 9.533 3.961
22 2HB GLU 4 HB1 GLU 4 -0.349 9.459 4.712
23 1HG GLU 4 HG2 GLU 4 0.476 9.788 2.240
24 2HG GLU 4 HG1 GLU 4 -1.136 10.471 2.031
25 H GLU 5 HN GLU 5 -2.424 5.960 3.694
26 HA GLU 5 HA GLU 5 -1.411 5.157 6.318
27 1HB GLU 5 HB2 GLU 5 -4.251 5.841 5.613
28 2HB GLU 5 HB1 GLU 5 -3.876 4.763 6.950
29 1HG GLU 5 HG2 GLU 5 -3.245 6.438 8.280
30 2HG GLU 5 HG1 GLU 5 -2.358 7.254 6.993
31 H CYS 6 HN CYS 6 -1.231 4.062 3.552
32 HA CYS 6 HA CYS 6 -2.849 1.696 3.585
33 1HB CYS 6 HB2 CYS 6 -1.018 2.988 1.696
34 2HB CYS 6 HB1 CYS 6 -0.990 1.228 1.643
35 HA PRO 7 HA PRO 7 1.755 -0.098 4.314
36 1HB PRO 7 HB2 PRO 7 2.286 2.045 6.334
37 2HB PRO 7 HB1 PRO 7 3.422 1.177 5.293
38 1HG PRO 7 HG2 PRO 7 2.677 3.668 4.707
39 2HG PRO 7 HG1 PRO 7 2.902 2.459 3.430
40 1HD PRO 7 HD2 PRO 7 0.379 3.571 4.557
41 2HD PRO 7 HD1 PRO 7 0.718 2.998 2.916
42 H MET 8 HN MET 8 -0.486 1.493 6.463
43 HA MET 8 HA MET 8 -0.081 -0.189 8.729
44 1HB MET 8 HB2 MET 8 -2.273 1.700 7.879
45 2HB MET 8 HB1 MET 8 -2.368 0.773 9.372
46 1HG MET 8 HG2 MET 8 -1.501 2.745 10.136
47 2HG MET 8 HG1 MET 8 -0.027 1.824 9.841
48 1HE MET 8 HE1 MET 8 -1.040 5.214 9.829
49 2HE MET 8 HE2 MET 8 -2.338 4.715 8.744
50 3HE MET 8 HE3 MET 8 -1.092 5.827 8.176
51 H HIS 9 HN HIS 9 -2.412 -0.065 6.084
52 HA HIS 9 HA HIS 9 -3.922 -2.311 6.967
53 1HB HIS 9 HB2 HIS 9 -5.311 -1.840 5.197
54 2HB HIS 9 HB1 HIS 9 -4.508 -0.297 5.351
55 HD1 HIS 9 HD1 HIS 9 -3.784 -3.500 3.388
56 HD2 HIS 9 HD2 HIS 9 -3.882 0.619 2.963
57 HE1 HIS 9 HE1 HIS 9 -3.157 -3.065 0.991
58 HE2 HIS 9 HE2 HIS 9 -3.321 -0.563 0.727
59 H CYS 10 HN CYS 10 -1.048 -1.919 5.086
60 HA CYS 10 HA CYS 10 -1.041 -4.817 4.558
61 1HB CYS 10 HB2 CYS 10 -1.168 -2.954 2.586
62 2HB CYS 10 HB1 CYS 10 0.575 -3.119 2.758
63 H LYS 11 HN LYS 11 0.240 -5.474 6.215
64 HA LYS 11 HA LYS 11 2.910 -4.238 6.405
65 1HB LYS 11 HB2 LYS 11 1.558 -5.775 8.616
66 2HB LYS 11 HB1 LYS 11 2.971 -4.735 8.726
67 1HG LYS 11 HG2 LYS 11 1.456 -2.822 8.074
68 2HG LYS 11 HG1 LYS 11 0.106 -3.929 8.333
69 1HD LYS 11 HD2 LYS 11 0.223 -3.002 10.414
70 2HD LYS 11 HD1 LYS 11 1.367 -4.328 10.633
71 1HE LYS 11 HE2 LYS 11 2.465 -2.449 11.499
72 2HE LYS 11 HE1 LYS 11 3.163 -2.674 9.896
73 1HZ LYS 11 HZ1 LYS 11 1.966 -0.877 9.048
74 2HZ LYS 11 HZ2 LYS 11 2.498 -0.333 10.558
75 3HZ LYS 11 HZ3 LYS 11 0.895 -0.834 10.357
76 H GLY 12 HN GLY 12 4.429 -5.476 5.546
77 1HA GLY 12 HA2 GLY 12 4.448 -8.333 6.157
78 2HA GLY 12 HA1 GLY 12 4.459 -7.861 4.465
79 H LYS 13 HN LYS 13 6.341 -7.266 3.527
80 HA LYS 13 HA LYS 13 8.597 -6.378 5.016
81 1HB LYS 13 HB2 LYS 13 8.259 -9.195 4.597
82 2HB LYS 13 HB1 LYS 13 9.669 -8.640 3.707
83 1HG LYS 13 HG2 LYS 13 10.822 -8.087 5.598
84 2HG LYS 13 HG1 LYS 13 9.357 -7.770 6.530
85 1HD LYS 13 HD2 LYS 13 9.959 -9.748 7.485
86 2HD LYS 13 HD1 LYS 13 9.012 -10.377 6.135
87 1HE LYS 13 HE2 LYS 13 11.024 -11.622 6.174
88 2HE LYS 13 HE1 LYS 13 11.168 -10.488 4.831
89 1HZ LYS 13 HZ1 LYS 13 12.204 -9.669 7.444
90 2HZ LYS 13 HZ2 LYS 13 12.762 -9.285 5.894
91 3HZ LYS 13 HZ3 LYS 13 13.094 -10.804 6.560
92 H ASN 14 HN ASN 14 7.427 -7.763 1.990
93 HA ASN 14 HA ASN 14 9.053 -5.809 0.560
94 1HB ASN 14 HB2 ASN 14 8.556 -8.702 -0.039
95 2HB ASN 14 HB1 ASN 14 8.854 -7.580 -1.363
96 1HD2 ASN 14 1HD2 ASN 14 10.181 -8.617 1.748
97 2HD2 ASN 14 2HD2 ASN 14 11.840 -8.444 1.296
98 H ALA 15 HN ALA 15 6.438 -5.467 1.587
99 HA ALA 15 HA ALA 15 4.863 -5.354 -0.895
100 1HB ALA 15 HB1 ALA 15 2.994 -5.054 1.042
101 2HB ALA 15 HB2 ALA 15 4.147 -6.119 1.848
102 3HB ALA 15 HB3 ALA 15 3.430 -6.598 0.309
103 H LYS 16 HN LYS 16 5.303 -3.336 -1.642
104 HA LYS 16 HA LYS 16 5.022 -1.088 0.223
105 1HB LYS 16 HB2 LYS 16 7.118 -1.103 -0.983
106 2HB LYS 16 HB1 LYS 16 6.275 -1.224 -2.519
107 1HG LYS 16 HG2 LYS 16 6.494 0.988 -2.623
108 2HG LYS 16 HG1 LYS 16 5.197 1.048 -1.428
109 1HD LYS 16 HD2 LYS 16 6.837 2.363 -0.452
110 2HD LYS 16 HD1 LYS 16 7.115 0.791 0.299
111 1HE LYS 16 HE2 LYS 16 9.093 0.483 -0.761
112 2HE LYS 16 HE1 LYS 16 8.559 1.310 -2.224
113 1HZ LYS 16 HZ1 LYS 16 10.043 2.817 -1.427
114 2HZ LYS 16 HZ2 LYS 16 9.782 2.413 0.195
115 3HZ LYS 16 HZ3 LYS 16 8.660 3.375 -0.627
116 HA PRO 17 HA PRO 17 1.063 -0.187 -1.566
117 1HB PRO 17 HB2 PRO 17 0.782 2.348 -0.629
118 2HB PRO 17 HB1 PRO 17 0.563 0.913 0.378
119 1HG PRO 17 HG2 PRO 17 2.937 2.720 0.143
120 2HG PRO 17 HG1 PRO 17 2.215 2.004 1.596
121 1HD PRO 17 HD2 PRO 17 4.442 0.997 0.422
122 2HD PRO 17 HD1 PRO 17 3.262 -0.023 1.271
123 H THR 18 HN THR 18 0.341 0.661 -3.432
124 HA THR 18 HA THR 18 2.025 2.660 -4.781
125 HB THR 18 HB THR 18 0.583 1.296 -6.720
126 HG1 THR 18 HG1 THR 18 1.289 -0.860 -6.346
127 1HG2 THR 18 1HG2 THR 18 2.706 0.549 -7.542
128 2HG2 THR 18 2HG2 THR 18 3.460 0.900 -5.986
129 3HG2 THR 18 3HG2 THR 18 2.833 2.216 -6.980
130 H CYS 19 HN CYS 19 1.057 4.410 -5.651
131 HA CYS 19 HA CYS 19 -1.841 4.619 -5.255
132 1HB CYS 19 HB2 CYS 19 0.268 6.334 -4.551
133 2HB CYS 19 HB1 CYS 19 -0.597 7.137 -5.854
134 H ASP 20 HN ASP 20 -3.015 4.341 -7.026
135 HA ASP 20 HA ASP 20 -2.052 5.460 -9.543
136 1HB ASP 20 HB2 ASP 20 -1.971 2.858 -9.209
137 2HB ASP 20 HB1 ASP 20 -3.698 2.971 -9.524
138 H ASP 21 HN ASP 21 -3.362 7.167 -9.839
139 HA ASP 21 HA ASP 21 -5.244 8.442 -10.004
140 1HB ASP 21 HB2 ASP 21 -6.338 5.761 -10.877
141 2HB ASP 21 HB1 ASP 21 -7.211 7.281 -11.050
142 H GLY 22 HN GLY 22 -4.784 7.936 -7.441
143 1HA GLY 22 HA2 GLY 22 -5.796 8.077 -5.404
144 2HA GLY 22 HA1 GLY 22 -7.320 8.157 -6.260
145 H VAL 23 HN VAL 23 -5.424 5.433 -7.027
146 HA VAL 23 HA VAL 23 -7.125 3.761 -5.299
147 HB VAL 23 HB VAL 23 -5.755 2.929 -7.859
148 1HG1 VAL 23 1HG1 VAL 23 -6.228 1.138 -6.207
149 2HG1 VAL 23 2HG1 VAL 23 -7.110 0.947 -7.722
150 3HG1 VAL 23 3HG1 VAL 23 -7.938 1.563 -6.292
151 1HG2 VAL 23 1HG2 VAL 23 -8.379 2.860 -8.458
152 2HG2 VAL 23 2HG2 VAL 23 -7.334 4.238 -8.805
153 3HG2 VAL 23 3HG2 VAL 23 -8.348 4.242 -7.363
154 H CYS 24 HN CYS 24 -5.901 3.441 -3.508
155 HA CYS 24 HA CYS 24 -3.071 2.887 -3.713
156 1HB CYS 24 HB2 CYS 24 -4.133 4.232 -1.850
157 2HB CYS 24 HB1 CYS 24 -4.793 2.718 -1.240
158 H ASN 25 HN ASN 25 -2.094 0.945 -3.588
159 HA ASN 25 HA ASN 25 -3.410 -1.372 -2.542
160 1HB ASN 25 HB2 ASN 25 -3.655 -0.804 -5.328
161 2HB ASN 25 HB1 ASN 25 -2.661 -2.241 -5.125
162 1HD2 ASN 25 1HD2 ASN 25 -5.757 -1.101 -5.382
163 2HD2 ASN 25 2HD2 ASN 25 -6.608 -2.465 -4.750
164 H CYS 26 HN CYS 26 -1.918 -2.587 -1.619
165 HA CYS 26 HA CYS 26 0.879 -2.051 -2.068
166 1HB CYS 26 HB2 CYS 26 1.212 -3.772 -0.272
167 2HB CYS 26 HB1 CYS 26 0.198 -2.414 0.205
168 H ASN 27 HN ASN 27 2.313 -3.257 -3.177
169 HA ASN 27 HA ASN 27 1.385 -5.825 -4.268
170 1HB ASN 27 HB2 ASN 27 2.792 -3.575 -5.685
171 2HB ASN 27 HB1 ASN 27 2.794 -5.220 -6.314
172 1HD2 ASN 27 1HD2 ASN 27 1.721 -3.032 -7.673
173 2HD2 ASN 27 2HD2 ASN 27 0.014 -3.259 -7.816
174 H VAL 28 HN VAL 28 4.472 -4.333 -4.919
175 HA VAL 28 HA VAL 28 5.773 -6.381 -3.250
176 HB VAL 28 HB VAL 28 6.870 -5.308 -5.848
177 1HG1 VAL 28 1HG1 VAL 28 7.836 -7.162 -3.766
178 2HG1 VAL 28 2HG1 VAL 28 8.736 -6.115 -4.863
179 3HG1 VAL 28 3HG1 VAL 28 8.106 -7.659 -5.436
180 1HG2 VAL 28 1HG2 VAL 28 5.363 -7.861 -5.298
181 2HG2 VAL 28 2HG2 VAL 28 6.294 -7.555 -6.765
182 3HG2 VAL 28 3HG2 VAL 28 4.893 -6.553 -6.384
Start of MODEL 22
1 1H VAL 1 HT1 VAL 1 -6.424 1.587 3.151
2 2H VAL 1 HT2 VAL 1 -8.040 1.037 3.330
3 3H VAL 1 HT3 VAL 1 -7.348 2.075 4.509
4 HA VAL 1 HA VAL 1 -7.977 2.718 1.709
5 HB VAL 1 HB VAL 1 -9.501 4.379 2.745
6 1HG1 VAL 1 1HG1 VAL 1 -11.229 2.744 3.456
7 2HG1 VAL 1 2HG1 VAL 1 -9.993 1.486 3.434
8 3HG1 VAL 1 3HG1 VAL 1 -10.434 2.316 1.941
9 1HG2 VAL 1 1HG2 VAL 1 -8.131 4.073 5.010
10 2HG2 VAL 1 2HG2 VAL 1 -9.437 2.933 5.331
11 3HG2 VAL 1 3HG2 VAL 1 -9.807 4.622 4.985
12 H GLY 2 HN GLY 2 -7.673 5.011 1.212
13 1HA GLY 2 HA2 GLY 2 -6.627 7.100 1.527
14 2HA GLY 2 HA1 GLY 2 -5.757 6.432 2.901
15 H CYS 3 HN CYS 3 -3.953 7.597 1.827
16 HA CYS 3 HA CYS 3 -2.716 5.888 -0.231
17 1HB CYS 3 HB2 CYS 3 -3.403 8.146 -1.070
18 2HB CYS 3 HB1 CYS 3 -2.293 8.864 0.092
19 H GLU 4 HN GLU 4 -2.153 8.025 2.533
20 HA GLU 4 HA GLU 4 0.548 6.942 2.818
21 1HB GLU 4 HB2 GLU 4 -0.844 9.314 4.026
22 2HB GLU 4 HB1 GLU 4 0.710 8.744 4.617
23 1HG GLU 4 HG2 GLU 4 1.531 8.994 2.222
24 2HG GLU 4 HG1 GLU 4 0.046 9.898 1.930
25 H GLU 5 HN GLU 5 -2.377 6.054 3.748
26 HA GLU 5 HA GLU 5 -1.480 5.096 6.376
27 1HB GLU 5 HB2 GLU 5 -4.189 5.979 5.434
28 2HB GLU 5 HB1 GLU 5 -4.027 4.884 6.800
29 1HG GLU 5 HG2 GLU 5 -2.636 7.542 6.664
30 2HG GLU 5 HG1 GLU 5 -4.247 7.329 7.350
31 H CYS 6 HN CYS 6 -1.464 3.977 3.478
32 HA CYS 6 HA CYS 6 -3.109 1.644 3.701
33 1HB CYS 6 HB2 CYS 6 -1.114 2.579 1.666
34 2HB CYS 6 HB1 CYS 6 -1.827 0.972 1.579
35 HA PRO 7 HA PRO 7 1.521 -0.165 4.190
36 1HB PRO 7 HB2 PRO 7 2.110 1.899 6.272
37 2HB PRO 7 HB1 PRO 7 3.212 1.085 5.155
38 1HG PRO 7 HG2 PRO 7 2.439 3.595 4.708
39 2HG PRO 7 HG1 PRO 7 2.619 2.445 3.369
40 1HD PRO 7 HD2 PRO 7 0.135 3.481 4.653
41 2HD PRO 7 HD1 PRO 7 0.417 3.014 2.968
42 H MET 8 HN MET 8 -0.708 1.312 6.422
43 HA MET 8 HA MET 8 -0.215 -0.447 8.622
44 1HB MET 8 HB2 MET 8 -2.472 1.441 7.938
45 2HB MET 8 HB1 MET 8 -2.426 0.503 9.426
46 1HG MET 8 HG2 MET 8 -0.166 2.311 8.662
47 2HG MET 8 HG1 MET 8 -1.601 2.926 9.481
48 1HE MET 8 HE1 MET 8 -2.519 1.909 11.676
49 2HE MET 8 HE2 MET 8 -1.563 1.007 12.852
50 3HE MET 8 HE3 MET 8 -2.194 0.195 11.419
51 H HIS 9 HN HIS 9 -2.512 -0.275 5.965
52 HA HIS 9 HA HIS 9 -4.028 -2.544 6.843
53 1HB HIS 9 HB2 HIS 9 -5.484 -2.028 5.131
54 2HB HIS 9 HB1 HIS 9 -4.731 -0.472 5.383
55 HD1 HIS 9 HD1 HIS 9 -3.926 -3.486 3.163
56 HD2 HIS 9 HD2 HIS 9 -4.241 0.645 3.044
57 HE1 HIS 9 HE1 HIS 9 -3.394 -2.845 0.790
58 HE2 HIS 9 HE2 HIS 9 -3.485 -0.327 0.765
59 H CYS 10 HN CYS 10 -1.137 -2.119 5.077
60 HA CYS 10 HA CYS 10 -1.155 -4.972 4.394
61 1HB CYS 10 HB2 CYS 10 -1.590 -3.265 2.420
62 2HB CYS 10 HB1 CYS 10 0.157 -3.072 2.498
63 H LYS 11 HN LYS 11 0.567 -5.972 5.195
64 HA LYS 11 HA LYS 11 2.549 -4.742 6.693
65 1HB LYS 11 HB2 LYS 11 2.785 -7.384 5.243
66 2HB LYS 11 HB1 LYS 11 3.728 -6.871 6.636
67 1HG LYS 11 HG2 LYS 11 1.360 -6.632 7.746
68 2HG LYS 11 HG1 LYS 11 0.902 -7.780 6.487
69 1HD LYS 11 HD2 LYS 11 1.489 -9.079 8.374
70 2HD LYS 11 HD1 LYS 11 2.849 -9.201 7.256
71 1HE LYS 11 HE2 LYS 11 4.223 -7.916 8.573
72 2HE LYS 11 HE1 LYS 11 2.879 -7.054 9.320
73 1HZ LYS 11 HZ1 LYS 11 3.378 -8.394 11.039
74 2HZ LYS 11 HZ2 LYS 11 4.117 -9.570 10.075
75 3HZ LYS 11 HZ3 LYS 11 2.431 -9.520 10.202
76 H GLY 12 HN GLY 12 4.228 -3.517 6.155
77 1HA GLY 12 HA2 GLY 12 5.069 -3.414 3.364
78 2HA GLY 12 HA1 GLY 12 5.511 -2.273 4.624
79 H LYS 13 HN LYS 13 5.832 -5.802 4.390
80 HA LYS 13 HA LYS 13 8.704 -5.466 4.775
81 1HB LYS 13 HB2 LYS 13 6.775 -7.339 6.046
82 2HB LYS 13 HB1 LYS 13 8.411 -7.913 5.751
83 1HG LYS 13 HG2 LYS 13 8.962 -7.001 7.695
84 2HG LYS 13 HG1 LYS 13 8.779 -5.429 6.914
85 1HD LYS 13 HD2 LYS 13 7.337 -5.116 8.644
86 2HD LYS 13 HD1 LYS 13 6.221 -5.884 7.513
87 1HE LYS 13 HE2 LYS 13 5.944 -6.952 9.624
88 2HE LYS 13 HE1 LYS 13 6.798 -8.078 8.570
89 1HZ LYS 13 HZ1 LYS 13 8.091 -6.334 10.597
90 2HZ LYS 13 HZ2 LYS 13 8.864 -7.487 9.631
91 3HZ LYS 13 HZ3 LYS 13 7.751 -7.978 10.807
92 H ASN 14 HN ASN 14 6.197 -7.002 2.997
93 HA ASN 14 HA ASN 14 8.158 -7.992 1.121
94 1HB ASN 14 HB2 ASN 14 7.340 -9.856 2.725
95 2HB ASN 14 HB1 ASN 14 5.815 -9.733 1.853
96 1HD2 ASN 14 1HD2 ASN 14 5.683 -10.450 -0.247
97 2HD2 ASN 14 2HD2 ASN 14 6.920 -11.400 -0.991
98 H ALA 15 HN ALA 15 6.370 -5.749 1.304
99 HA ALA 15 HA ALA 15 5.382 -5.692 -1.304
100 1HB ALA 15 HB1 ALA 15 3.730 -7.265 0.083
101 2HB ALA 15 HB2 ALA 15 3.180 -6.224 -1.230
102 3HB ALA 15 HB3 ALA 15 2.999 -5.701 0.444
103 H LYS 16 HN LYS 16 5.203 -3.612 -1.878
104 HA LYS 16 HA LYS 16 4.921 -1.629 0.276
105 1HB LYS 16 HB2 LYS 16 7.054 -1.438 -0.820
106 2HB LYS 16 HB1 LYS 16 6.292 -1.430 -2.404
107 1HG LYS 16 HG2 LYS 16 5.202 0.717 -1.813
108 2HG LYS 16 HG1 LYS 16 6.111 0.715 -0.300
109 1HD LYS 16 HD2 LYS 16 8.200 0.511 -1.748
110 2HD LYS 16 HD1 LYS 16 7.158 0.927 -3.111
111 1HE LYS 16 HE2 LYS 16 7.801 3.027 -2.566
112 2HE LYS 16 HE1 LYS 16 6.463 2.884 -1.427
113 1HZ LYS 16 HZ1 LYS 16 8.095 3.562 -0.025
114 2HZ LYS 16 HZ2 LYS 16 9.342 2.858 -0.926
115 3HZ LYS 16 HZ3 LYS 16 8.371 1.895 0.068
116 HA PRO 17 HA PRO 17 1.017 -0.552 -1.544
117 1HB PRO 17 HB2 PRO 17 0.640 1.826 -0.288
118 2HB PRO 17 HB1 PRO 17 0.415 0.266 0.508
119 1HG PRO 17 HG2 PRO 17 2.750 2.133 0.620
120 2HG PRO 17 HG1 PRO 17 1.990 1.211 1.930
121 1HD PRO 17 HD2 PRO 17 4.288 0.422 0.720
122 2HD PRO 17 HD1 PRO 17 3.108 -0.727 1.384
123 H THR 18 HN THR 18 0.361 0.518 -3.312
124 HA THR 18 HA THR 18 2.011 2.748 -4.284
125 HB THR 18 HB THR 18 0.803 1.567 -6.483
126 HG1 THR 18 HG1 THR 18 0.660 -0.455 -6.003
127 1HG2 THR 18 1HG2 THR 18 3.639 1.296 -5.555
128 2HG2 THR 18 2HG2 THR 18 2.982 2.622 -6.515
129 3HG2 THR 18 3HG2 THR 18 3.048 0.993 -7.189
130 H CYS 19 HN CYS 19 0.974 4.517 -5.075
131 HA CYS 19 HA CYS 19 -1.960 4.476 -4.880
132 1HB CYS 19 HB2 CYS 19 0.069 6.622 -4.341
133 2HB CYS 19 HB1 CYS 19 -1.595 7.048 -4.724
134 H ASP 20 HN ASP 20 -2.953 4.432 -6.775
135 HA ASP 20 HA ASP 20 -1.850 5.984 -8.987
136 1HB ASP 20 HB2 ASP 20 -1.632 3.369 -9.049
137 2HB ASP 20 HB1 ASP 20 -3.330 3.444 -9.504
138 H ASP 21 HN ASP 21 -3.236 7.648 -9.146
139 HA ASP 21 HA ASP 21 -5.175 8.839 -9.284
140 1HB ASP 21 HB2 ASP 21 -5.701 6.337 -10.829
141 2HB ASP 21 HB1 ASP 21 -7.041 7.443 -10.547
142 H GLY 22 HN GLY 22 -4.906 7.952 -6.801
143 1HA GLY 22 HA2 GLY 22 -6.101 7.719 -4.873
144 2HA GLY 22 HA1 GLY 22 -7.547 7.839 -5.851
145 H VAL 23 HN VAL 23 -5.382 5.390 -6.820
146 HA VAL 23 HA VAL 23 -7.115 3.366 -5.566
147 HB VAL 23 HB VAL 23 -5.399 3.020 -8.026
148 1HG1 VAL 23 1HG1 VAL 23 -6.364 1.095 -6.398
149 2HG1 VAL 23 2HG1 VAL 23 -6.113 0.884 -8.131
150 3HG1 VAL 23 3HG1 VAL 23 -7.717 1.279 -7.513
151 1HG2 VAL 23 1HG2 VAL 23 -7.354 3.286 -9.364
152 2HG2 VAL 23 2HG2 VAL 23 -7.249 4.690 -8.303
153 3HG2 VAL 23 3HG2 VAL 23 -8.387 3.393 -7.939
154 H CYS 24 HN CYS 24 -6.070 2.875 -3.696
155 HA CYS 24 HA CYS 24 -3.204 2.538 -3.621
156 1HB CYS 24 HB2 CYS 24 -4.961 3.324 -1.745
157 2HB CYS 24 HB1 CYS 24 -4.879 1.610 -1.352
158 H ASN 25 HN ASN 25 -2.077 0.669 -3.633
159 HA ASN 25 HA ASN 25 -3.319 -1.877 -3.170
160 1HB ASN 25 HB2 ASN 25 -2.837 -2.814 -5.397
161 2HB ASN 25 HB1 ASN 25 -4.015 -1.508 -5.485
162 1HD2 ASN 25 1HD2 ASN 25 -3.597 0.211 -6.728
163 2HD2 ASN 25 2HD2 ASN 25 -2.125 0.465 -7.598
164 H CYS 26 HN CYS 26 -1.858 -3.057 -2.143
165 HA CYS 26 HA CYS 26 0.961 -2.346 -2.350
166 1HB CYS 26 HB2 CYS 26 1.220 -3.918 -0.415
167 2HB CYS 26 HB1 CYS 26 0.137 -2.566 -0.104
168 H ASN 27 HN ASN 27 2.324 -3.423 -3.604
169 HA ASN 27 HA ASN 27 1.644 -6.180 -4.373
170 1HB ASN 27 HB2 ASN 27 2.911 -3.999 -6.024
171 2HB ASN 27 HB1 ASN 27 2.903 -5.693 -6.507
172 1HD2 ASN 27 1HD2 ASN 27 1.362 -2.823 -6.853
173 2HD2 ASN 27 2HD2 ASN 27 -0.193 -3.384 -7.355
174 H VAL 28 HN VAL 28 4.536 -4.274 -4.956
175 HA VAL 28 HA VAL 28 6.062 -5.999 -3.147
176 HB VAL 28 HB VAL 28 6.986 -5.425 -5.962
177 1HG1 VAL 28 1HG1 VAL 28 8.658 -5.826 -4.076
178 2HG1 VAL 28 2HG1 VAL 28 8.804 -6.836 -5.514
179 3HG1 VAL 28 3HG1 VAL 28 8.055 -7.483 -4.054
180 1HG2 VAL 28 1HG2 VAL 28 6.403 -7.643 -6.575
181 2HG2 VAL 28 2HG2 VAL 28 4.973 -6.934 -5.825
182 3HG2 VAL 28 3HG2 VAL 28 5.978 -8.062 -4.916
Start of MODEL 23
1 1H VAL 1 HT1 VAL 1 -9.252 0.647 0.194
2 2H VAL 1 HT2 VAL 1 -8.550 1.850 -0.809
3 3H VAL 1 HT3 VAL 1 -9.924 2.224 0.150
4 HA VAL 1 HA VAL 1 -8.775 2.294 2.060
5 HB VAL 1 HB VAL 1 -6.449 1.345 2.259
6 1HG1 VAL 1 1HG1 VAL 1 -8.958 -0.180 1.990
7 2HG1 VAL 1 2HG1 VAL 1 -7.849 -0.046 3.355
8 3HG1 VAL 1 3HG1 VAL 1 -7.473 -1.131 2.016
9 1HG2 VAL 1 1HG2 VAL 1 -7.132 0.443 -0.501
10 2HG2 VAL 1 2HG2 VAL 1 -6.128 -0.587 0.520
11 3HG2 VAL 1 3HG2 VAL 1 -5.606 1.054 0.139
12 H GLY 2 HN GLY 2 -7.279 3.870 2.754
13 1HA GLY 2 HA2 GLY 2 -6.776 5.930 0.888
14 2HA GLY 2 HA1 GLY 2 -6.159 5.863 2.532
15 H CYS 3 HN CYS 3 -4.477 6.984 0.901
16 HA CYS 3 HA CYS 3 -2.673 4.954 -0.187
17 1HB CYS 3 HB2 CYS 3 -3.362 7.077 -1.461
18 2HB CYS 3 HB1 CYS 3 -2.287 7.937 -0.364
19 H GLU 4 HN GLU 4 -2.910 7.348 2.347
20 HA GLU 4 HA GLU 4 -0.164 6.801 3.190
21 1HB GLU 4 HB2 GLU 4 -2.154 8.911 3.982
22 2HB GLU 4 HB1 GLU 4 -0.631 8.680 4.830
23 1HG GLU 4 HG2 GLU 4 0.627 9.451 3.066
24 2HG GLU 4 HG1 GLU 4 -0.615 9.067 1.875
25 H GLU 5 HN GLU 5 -3.009 5.422 3.648
26 HA GLU 5 HA GLU 5 -2.450 4.735 6.447
27 1HB GLU 5 HB2 GLU 5 -5.137 4.806 5.076
28 2HB GLU 5 HB1 GLU 5 -4.853 4.317 6.740
29 1HG GLU 5 HG2 GLU 5 -3.702 6.884 6.360
30 2HG GLU 5 HG1 GLU 5 -5.342 6.907 5.714
31 H CYS 6 HN CYS 6 -1.734 3.520 3.697
32 HA CYS 6 HA CYS 6 -3.040 0.969 3.773
33 1HB CYS 6 HB2 CYS 6 -1.105 2.312 1.992
34 2HB CYS 6 HB1 CYS 6 -1.024 0.554 2.041
35 HA PRO 7 HA PRO 7 1.635 -0.181 5.065
36 1HB PRO 7 HB2 PRO 7 1.762 2.197 6.876
37 2HB PRO 7 HB1 PRO 7 3.067 1.370 6.016
38 1HG PRO 7 HG2 PRO 7 2.107 3.692 5.122
39 2HG PRO 7 HG1 PRO 7 2.574 2.402 3.998
40 1HD PRO 7 HD2 PRO 7 -0.145 3.311 4.807
41 2HD PRO 7 HD1 PRO 7 0.398 2.627 3.268
42 H MET 8 HN MET 8 -0.965 1.324 6.830
43 HA MET 8 HA MET 8 -0.564 -0.123 9.277
44 1HB MET 8 HB2 MET 8 -2.818 1.567 8.190
45 2HB MET 8 HB1 MET 8 -2.888 0.789 9.767
46 1HG MET 8 HG2 MET 8 -2.193 2.951 10.242
47 2HG MET 8 HG1 MET 8 -0.700 2.014 10.267
48 1HE MET 8 HE1 MET 8 1.003 3.821 9.936
49 2HE MET 8 HE2 MET 8 1.486 4.189 8.280
50 3HE MET 8 HE3 MET 8 1.346 2.511 8.806
51 H HIS 9 HN HIS 9 -2.658 -0.364 6.454
52 HA HIS 9 HA HIS 9 -4.049 -2.667 7.501
53 1HB HIS 9 HB2 HIS 9 -5.587 -2.273 5.863
54 2HB HIS 9 HB1 HIS 9 -4.845 -0.694 5.882
55 HD1 HIS 9 HD1 HIS 9 -4.089 -3.946 4.010
56 HD2 HIS 9 HD2 HIS 9 -4.530 0.131 3.399
57 HE1 HIS 9 HE1 HIS 9 -3.712 -3.599 1.548
58 HE2 HIS 9 HE2 HIS 9 -4.099 -1.136 1.180
59 H CYS 10 HN CYS 10 -1.814 -2.020 4.809
60 HA CYS 10 HA CYS 10 -1.553 -4.870 4.297
61 1HB CYS 10 HB2 CYS 10 -1.472 -2.680 2.650
62 2HB CYS 10 HB1 CYS 10 0.238 -3.045 2.848
63 H LYS 11 HN LYS 11 0.762 -5.658 3.880
64 HA LYS 11 HA LYS 11 2.232 -5.320 6.326
65 1HB LYS 11 HB2 LYS 11 2.760 -6.964 3.848
66 2HB LYS 11 HB1 LYS 11 3.802 -6.978 5.264
67 1HG LYS 11 HG2 LYS 11 0.953 -7.475 5.794
68 2HG LYS 11 HG1 LYS 11 1.782 -8.711 4.846
69 1HD LYS 11 HD2 LYS 11 3.541 -8.069 6.922
70 2HD LYS 11 HD1 LYS 11 1.945 -8.144 7.671
71 1HE LYS 11 HE2 LYS 11 3.048 -10.292 5.870
72 2HE LYS 11 HE1 LYS 11 3.215 -10.312 7.626
73 1HZ LYS 11 HZ1 LYS 11 0.901 -10.498 7.897
74 2HZ LYS 11 HZ2 LYS 11 1.293 -11.601 6.676
75 3HZ LYS 11 HZ3 LYS 11 0.584 -10.118 6.279
76 H GLY 12 HN GLY 12 4.607 -4.943 6.315
77 1HA GLY 12 HA2 GLY 12 5.402 -3.038 4.205
78 2HA GLY 12 HA1 GLY 12 5.621 -2.649 5.905
79 H LYS 13 HN LYS 13 6.267 -5.552 3.942
80 HA LYS 13 HA LYS 13 9.093 -5.265 4.386
81 1HB LYS 13 HB2 LYS 13 7.835 -6.594 6.325
82 2HB LYS 13 HB1 LYS 13 8.033 -7.919 5.187
83 1HG LYS 13 HG2 LYS 13 9.987 -8.190 6.259
84 2HG LYS 13 HG1 LYS 13 10.527 -6.914 5.166
85 1HD LYS 13 HD2 LYS 13 10.046 -5.239 6.879
86 2HD LYS 13 HD1 LYS 13 9.482 -6.507 7.969
87 1HE LYS 13 HE2 LYS 13 11.597 -6.446 8.735
88 2HE LYS 13 HE1 LYS 13 11.930 -7.454 7.328
89 1HZ LYS 13 HZ1 LYS 13 12.137 -5.033 6.255
90 2HZ LYS 13 HZ2 LYS 13 13.448 -5.862 6.929
91 3HZ LYS 13 HZ3 LYS 13 12.638 -4.684 7.834
92 H ASN 14 HN ASN 14 6.423 -6.807 2.823
93 HA ASN 14 HA ASN 14 8.191 -7.587 0.667
94 1HB ASN 14 HB2 ASN 14 6.397 -9.384 2.220
95 2HB ASN 14 HB1 ASN 14 6.461 -9.621 0.476
96 1HD2 ASN 14 1HD2 ASN 14 7.260 -11.693 1.797
97 2HD2 ASN 14 2HD2 ASN 14 8.981 -11.846 1.837
98 H ALA 15 HN ALA 15 6.446 -5.371 1.164
99 HA ALA 15 HA ALA 15 5.019 -5.395 -1.309
100 1HB ALA 15 HB1 ALA 15 3.573 -5.896 1.196
101 2HB ALA 15 HB2 ALA 15 3.131 -6.281 -0.467
102 3HB ALA 15 HB3 ALA 15 2.873 -4.653 0.160
103 H LYS 16 HN LYS 16 5.264 -3.418 -2.126
104 HA LYS 16 HA LYS 16 5.701 -1.195 -0.264
105 1HB LYS 16 HB2 LYS 16 7.556 -1.356 -1.683
106 2HB LYS 16 HB1 LYS 16 6.566 -1.682 -3.098
107 1HG LYS 16 HG2 LYS 16 5.910 0.573 -3.281
108 2HG LYS 16 HG1 LYS 16 6.502 0.956 -1.663
109 1HD LYS 16 HD2 LYS 16 8.031 1.816 -3.341
110 2HD LYS 16 HD1 LYS 16 8.802 0.521 -2.421
111 1HE LYS 16 HE2 LYS 16 7.371 -0.324 -4.852
112 2HE LYS 16 HE1 LYS 16 8.797 0.678 -5.122
113 1HZ LYS 16 HZ1 LYS 16 8.603 -2.037 -4.112
114 2HZ LYS 16 HZ2 LYS 16 9.742 -1.053 -3.340
115 3HZ LYS 16 HZ3 LYS 16 9.833 -1.300 -5.011
116 HA PRO 17 HA PRO 17 1.677 0.395 -1.282
117 1HB PRO 17 HB2 PRO 17 2.790 3.014 -0.495
118 2HB PRO 17 HB1 PRO 17 1.427 2.121 0.186
119 1HG PRO 17 HG2 PRO 17 3.753 2.350 1.500
120 2HG PRO 17 HG1 PRO 17 2.772 0.876 1.590
121 1HD PRO 17 HD2 PRO 17 5.252 1.411 0.001
122 2HD PRO 17 HD1 PRO 17 4.762 -0.057 0.872
123 H THR 18 HN THR 18 0.837 1.108 -3.143
124 HA THR 18 HA THR 18 2.430 2.933 -4.798
125 HB THR 18 HB THR 18 2.216 0.363 -5.449
126 HG1 THR 18 HG1 THR 18 2.743 1.011 -7.505
127 1HG2 THR 18 1HG2 THR 18 -0.225 0.398 -5.629
128 2HG2 THR 18 2HG2 THR 18 0.560 0.016 -7.161
129 3HG2 THR 18 3HG2 THR 18 -0.094 1.630 -6.881
130 H CYS 19 HN CYS 19 1.388 4.713 -5.401
131 HA CYS 19 HA CYS 19 -1.501 4.834 -4.951
132 1HB CYS 19 HB2 CYS 19 0.557 6.576 -4.299
133 2HB CYS 19 HB1 CYS 19 -0.244 7.350 -5.660
134 H ASP 20 HN ASP 20 -2.809 4.626 -6.634
135 HA ASP 20 HA ASP 20 -1.937 5.622 -9.236
136 1HB ASP 20 HB2 ASP 20 -2.012 3.030 -8.831
137 2HB ASP 20 HB1 ASP 20 -3.744 3.254 -9.040
138 H ASP 21 HN ASP 21 -3.131 7.443 -9.416
139 HA ASP 21 HA ASP 21 -4.931 8.837 -9.499
140 1HB ASP 21 HB2 ASP 21 -5.913 6.233 -10.560
141 2HB ASP 21 HB1 ASP 21 -7.116 7.473 -10.219
142 H GLY 22 HN GLY 22 -4.377 8.316 -6.965
143 1HA GLY 22 HA2 GLY 22 -5.260 8.489 -4.873
144 2HA GLY 22 HA1 GLY 22 -6.816 8.704 -5.646
145 H VAL 23 HN VAL 23 -5.216 5.843 -6.556
146 HA VAL 23 HA VAL 23 -6.895 4.296 -4.692
147 HB VAL 23 HB VAL 23 -5.948 3.430 -7.426
148 1HG1 VAL 23 1HG1 VAL 23 -6.354 1.445 -6.378
149 2HG1 VAL 23 2HG1 VAL 23 -7.990 1.818 -6.922
150 3HG1 VAL 23 3HG1 VAL 23 -7.518 2.148 -5.255
151 1HG2 VAL 23 1HG2 VAL 23 -8.023 3.987 -8.325
152 2HG2 VAL 23 2HG2 VAL 23 -7.643 5.365 -7.292
153 3HG2 VAL 23 3HG2 VAL 23 -8.779 4.135 -6.738
154 H CYS 24 HN CYS 24 -5.552 3.700 -3.084
155 HA CYS 24 HA CYS 24 -2.796 3.173 -3.384
156 1HB CYS 24 HB2 CYS 24 -3.914 3.800 -1.240
157 2HB CYS 24 HB1 CYS 24 -4.628 2.192 -1.186
158 H ASN 25 HN ASN 25 -1.660 1.190 -3.282
159 HA ASN 25 HA ASN 25 -3.047 -1.307 -3.471
160 1HB ASN 25 HB2 ASN 25 -2.450 0.111 -5.876
161 2HB ASN 25 HB1 ASN 25 -1.466 -1.345 -5.811
162 1HD2 ASN 25 1HD2 ASN 25 -2.671 -2.129 -7.595
163 2HD2 ASN 25 2HD2 ASN 25 -4.243 -2.808 -7.367
164 H CYS 26 HN CYS 26 -1.831 -2.775 -2.522
165 HA CYS 26 HA CYS 26 1.085 -2.356 -2.438
166 1HB CYS 26 HB2 CYS 26 0.952 -3.741 -0.301
167 2HB CYS 26 HB1 CYS 26 0.292 -2.111 -0.222
168 H ASN 27 HN ASN 27 2.247 -3.816 -3.493
169 HA ASN 27 HA ASN 27 1.128 -6.514 -3.847
170 1HB ASN 27 HB2 ASN 27 2.573 -4.749 -5.795
171 2HB ASN 27 HB1 ASN 27 2.586 -6.499 -5.988
172 1HD2 ASN 27 1HD2 ASN 27 1.082 -3.770 -6.931
173 2HD2 ASN 27 2HD2 ASN 27 -0.463 -4.410 -7.364
174 H VAL 28 HN VAL 28 4.285 -5.259 -4.721
175 HA VAL 28 HA VAL 28 5.536 -6.825 -2.588
176 HB VAL 28 HB VAL 28 6.460 -7.030 -5.454
177 1HG1 VAL 28 1HG1 VAL 28 7.877 -8.820 -4.622
178 2HG1 VAL 28 2HG1 VAL 28 7.232 -8.598 -2.995
179 3HG1 VAL 28 3HG1 VAL 28 8.196 -7.324 -3.743
180 1HG2 VAL 28 1HG2 VAL 28 4.511 -8.245 -5.575
181 2HG2 VAL 28 2HG2 VAL 28 4.566 -8.708 -3.874
182 3HG2 VAL 28 3HG2 VAL 28 5.642 -9.485 -5.035
Start of MODEL 24
1 1H VAL 1 HT1 VAL 1 -6.908 1.305 4.683
2 2H VAL 1 HT2 VAL 1 -8.560 0.849 4.591
3 3H VAL 1 HT3 VAL 1 -8.128 2.410 5.160
4 HA VAL 1 HA VAL 1 -7.392 1.490 2.484
5 HB VAL 1 HB VAL 1 -9.423 2.800 1.714
6 1HG1 VAL 1 1HG1 VAL 1 -10.848 0.894 1.766
7 2HG1 VAL 1 2HG1 VAL 1 -10.069 0.275 3.223
8 3HG1 VAL 1 3HG1 VAL 1 -9.188 0.301 1.695
9 1HG2 VAL 1 1HG2 VAL 1 -10.731 2.153 4.298
10 2HG2 VAL 1 2HG2 VAL 1 -11.080 3.437 3.140
11 3HG2 VAL 1 3HG2 VAL 1 -9.707 3.588 4.236
12 H GLY 2 HN GLY 2 -6.861 3.252 1.114
13 1HA GLY 2 HA2 GLY 2 -6.866 5.789 1.029
14 2HA GLY 2 HA1 GLY 2 -6.120 5.683 2.617
15 H CYS 3 HN CYS 3 -4.648 7.094 1.085
16 HA CYS 3 HA CYS 3 -2.698 5.338 -0.240
17 1HB CYS 3 HB2 CYS 3 -3.749 7.270 -1.513
18 2HB CYS 3 HB1 CYS 3 -2.847 8.345 -0.452
19 H GLU 4 HN GLU 4 -3.083 7.789 2.239
20 HA GLU 4 HA GLU 4 -0.247 7.722 2.880
21 1HB GLU 4 HB2 GLU 4 -2.539 9.309 4.017
22 2HB GLU 4 HB1 GLU 4 -0.885 9.431 4.601
23 1HG GLU 4 HG2 GLU 4 -0.213 10.665 2.846
24 2HG GLU 4 HG1 GLU 4 -1.233 9.791 1.704
25 H GLU 5 HN GLU 5 -2.685 5.754 3.509
26 HA GLU 5 HA GLU 5 -1.815 5.174 6.252
27 1HB GLU 5 HB2 GLU 5 -4.473 4.895 4.904
28 2HB GLU 5 HB1 GLU 5 -4.072 3.856 6.265
29 1HG GLU 5 HG2 GLU 5 -3.393 6.301 7.235
30 2HG GLU 5 HG1 GLU 5 -4.764 6.697 6.199
31 H CYS 6 HN CYS 6 -1.730 4.063 3.071
32 HA CYS 6 HA CYS 6 -1.989 1.353 3.159
33 1HB CYS 6 HB2 CYS 6 -0.592 3.253 1.493
34 2HB CYS 6 HB1 CYS 6 0.310 1.748 1.619
35 HA PRO 7 HA PRO 7 2.808 1.180 4.534
36 1HB PRO 7 HB2 PRO 7 2.436 3.520 6.358
37 2HB PRO 7 HB1 PRO 7 3.886 2.980 5.504
38 1HG PRO 7 HG2 PRO 7 2.462 5.057 4.614
39 2HG PRO 7 HG1 PRO 7 3.213 3.908 3.493
40 1HD PRO 7 HD2 PRO 7 0.352 4.228 4.230
41 2HD PRO 7 HD1 PRO 7 1.066 3.638 2.723
42 H MET 8 HN MET 8 -0.048 2.050 6.370
43 HA MET 8 HA MET 8 0.783 0.209 8.509
44 1HB MET 8 HB2 MET 8 0.045 2.769 8.827
45 2HB MET 8 HB1 MET 8 -1.539 2.010 8.913
46 1HG MET 8 HG2 MET 8 -1.166 1.201 10.951
47 2HG MET 8 HG1 MET 8 0.456 0.652 10.534
48 1HE MET 8 HE1 MET 8 2.351 4.114 10.706
49 2HE MET 8 HE2 MET 8 1.904 2.867 9.542
50 3HE MET 8 HE3 MET 8 2.777 2.430 11.011
51 H HIS 9 HN HIS 9 -1.707 0.925 6.155
52 HA HIS 9 HA HIS 9 -3.362 -1.250 7.178
53 1HB HIS 9 HB2 HIS 9 -5.143 -0.362 5.974
54 2HB HIS 9 HB1 HIS 9 -4.252 1.064 6.459
55 HD1 HIS 9 HD1 HIS 9 -4.127 -1.219 3.389
56 HD2 HIS 9 HD2 HIS 9 -4.263 2.791 4.440
57 HE1 HIS 9 HE1 HIS 9 -4.128 0.041 1.216
58 HE2 HIS 9 HE2 HIS 9 -4.318 2.465 1.875
59 H CYS 10 HN CYS 10 -0.722 -1.376 5.510
60 HA CYS 10 HA CYS 10 -1.704 -3.523 3.774
61 1HB CYS 10 HB2 CYS 10 -0.751 -1.067 2.803
62 2HB CYS 10 HB1 CYS 10 0.566 -2.208 2.557
63 H LYS 11 HN LYS 11 -0.954 -4.870 5.509
64 HA LYS 11 HA LYS 11 1.728 -4.891 6.403
65 1HB LYS 11 HB2 LYS 11 -0.206 -7.212 6.363
66 2HB LYS 11 HB1 LYS 11 1.205 -7.032 7.397
67 1HG LYS 11 HG2 LYS 11 -0.761 -4.858 7.585
68 2HG LYS 11 HG1 LYS 11 -1.322 -6.437 8.139
69 1HD LYS 11 HD2 LYS 11 -0.399 -5.506 10.058
70 2HD LYS 11 HD1 LYS 11 0.910 -6.515 9.439
71 1HE LYS 11 HE2 LYS 11 2.208 -4.738 8.903
72 2HE LYS 11 HE1 LYS 11 0.830 -3.730 8.461
73 1HZ LYS 11 HZ1 LYS 11 1.999 -4.203 11.122
74 2HZ LYS 11 HZ2 LYS 11 0.377 -3.741 10.984
75 3HZ LYS 11 HZ3 LYS 11 1.596 -2.738 10.377
76 H GLY 12 HN GLY 12 3.232 -6.753 6.074
77 1HA GLY 12 HA2 GLY 12 3.376 -8.641 4.231
78 2HA GLY 12 HA1 GLY 12 3.507 -7.216 3.214
79 H LYS 13 HN LYS 13 5.075 -5.584 4.728
80 HA LYS 13 HA LYS 13 7.166 -5.125 5.479
81 1HB LYS 13 HB2 LYS 13 6.809 -7.264 6.752
82 2HB LYS 13 HB1 LYS 13 7.673 -8.067 5.454
83 1HG LYS 13 HG2 LYS 13 9.269 -7.696 7.148
84 2HG LYS 13 HG1 LYS 13 9.587 -6.477 5.911
85 1HD LYS 13 HD2 LYS 13 7.682 -5.650 7.986
86 2HD LYS 13 HD1 LYS 13 9.318 -5.961 8.571
87 1HE LYS 13 HE2 LYS 13 10.247 -4.309 7.216
88 2HE LYS 13 HE1 LYS 13 8.852 -4.276 6.138
89 1HZ LYS 13 HZ1 LYS 13 7.734 -2.879 7.483
90 2HZ LYS 13 HZ2 LYS 13 9.281 -2.459 8.020
91 3HZ LYS 13 HZ3 LYS 13 8.347 -3.554 8.909
92 H ASN 14 HN ASN 14 6.435 -6.951 2.758
93 HA ASN 14 HA ASN 14 8.820 -5.995 1.416
94 1HB ASN 14 HB2 ASN 14 8.661 -8.619 2.129
95 2HB ASN 14 HB1 ASN 14 7.925 -8.662 0.530
96 1HD2 ASN 14 1HD2 ASN 14 10.728 -7.257 2.189
97 2HD2 ASN 14 2HD2 ASN 14 11.847 -7.542 0.903
98 H ALA 15 HN ALA 15 6.165 -5.017 1.485
99 HA ALA 15 HA ALA 15 5.484 -5.282 -1.353
100 1HB ALA 15 HB1 ALA 15 3.205 -4.905 0.480
101 2HB ALA 15 HB2 ALA 15 3.961 -6.499 0.498
102 3HB ALA 15 HB3 ALA 15 3.323 -5.843 -1.010
103 H LYS 16 HN LYS 16 5.903 -3.328 -2.161
104 HA LYS 16 HA LYS 16 5.592 -0.953 -0.544
105 1HB LYS 16 HB2 LYS 16 7.525 -1.043 -1.954
106 2HB LYS 16 HB1 LYS 16 6.545 -1.373 -3.374
107 1HG LYS 16 HG2 LYS 16 7.065 0.857 -3.631
108 2HG LYS 16 HG1 LYS 16 5.479 0.935 -2.864
109 1HD LYS 16 HD2 LYS 16 6.539 2.383 -1.486
110 2HD LYS 16 HD1 LYS 16 7.038 0.896 -0.677
111 1HE LYS 16 HE2 LYS 16 8.735 1.791 -2.919
112 2HE LYS 16 HE1 LYS 16 8.753 2.810 -1.481
113 1HZ LYS 16 HZ1 LYS 16 9.424 0.959 -0.156
114 2HZ LYS 16 HZ2 LYS 16 10.467 1.047 -1.484
115 3HZ LYS 16 HZ3 LYS 16 9.241 -0.118 -1.448
116 HA PRO 17 HA PRO 17 1.443 -0.208 -1.953
117 1HB PRO 17 HB2 PRO 17 1.155 2.292 -0.964
118 2HB PRO 17 HB1 PRO 17 1.133 0.852 0.061
119 1HG PRO 17 HG2 PRO 17 3.372 2.771 -0.463
120 2HG PRO 17 HG1 PRO 17 2.854 2.049 1.072
121 1HD PRO 17 HD2 PRO 17 4.974 1.119 -0.352
122 2HD PRO 17 HD1 PRO 17 3.956 0.071 0.657
123 H THR 18 HN THR 18 0.490 0.690 -3.698
124 HA THR 18 HA THR 18 1.985 2.738 -5.185
125 HB THR 18 HB THR 18 0.398 1.319 -6.984
126 HG1 THR 18 HG1 THR 18 0.374 -0.435 -5.580
127 1HG2 THR 18 1HG2 THR 18 2.390 0.847 -8.130
128 2HG2 THR 18 2HG2 THR 18 3.349 0.991 -6.656
129 3HG2 THR 18 3HG2 THR 18 2.605 2.424 -7.369
130 H CYS 19 HN CYS 19 0.910 4.547 -5.597
131 HA CYS 19 HA CYS 19 -1.961 4.573 -5.066
132 1HB CYS 19 HB2 CYS 19 -0.004 6.257 -4.213
133 2HB CYS 19 HB1 CYS 19 -0.621 7.133 -5.607
134 H ASP 20 HN ASP 20 -3.219 4.274 -6.776
135 HA ASP 20 HA ASP 20 -2.565 5.662 -9.258
136 1HB ASP 20 HB2 ASP 20 -2.228 3.060 -9.142
137 2HB ASP 20 HB1 ASP 20 -3.978 3.034 -9.321
138 H ASP 21 HN ASP 21 -4.043 7.254 -9.318
139 HA ASP 21 HA ASP 21 -6.038 8.353 -9.231
140 1HB ASP 21 HB2 ASP 21 -6.640 5.722 -10.493
141 2HB ASP 21 HB1 ASP 21 -8.006 6.734 -10.032
142 H GLY 22 HN GLY 22 -5.328 7.702 -6.763
143 1HA GLY 22 HA2 GLY 22 -6.179 7.591 -4.651
144 2HA GLY 22 HA1 GLY 22 -7.769 7.579 -5.383
145 H VAL 23 HN VAL 23 -5.680 5.126 -6.501
146 HA VAL 23 HA VAL 23 -7.075 3.166 -4.802
147 HB VAL 23 HB VAL 23 -5.827 2.667 -7.505
148 1HG1 VAL 23 1HG1 VAL 23 -7.587 0.691 -7.202
149 2HG1 VAL 23 2HG1 VAL 23 -7.225 0.990 -5.502
150 3HG1 VAL 23 3HG1 VAL 23 -5.925 0.576 -6.621
151 1HG2 VAL 23 1HG2 VAL 23 -7.843 4.249 -7.426
152 2HG2 VAL 23 2HG2 VAL 23 -8.775 2.824 -6.968
153 3HG2 VAL 23 3HG2 VAL 23 -7.927 2.864 -8.514
154 H CYS 24 HN CYS 24 -5.685 2.868 -3.126
155 HA CYS 24 HA CYS 24 -2.842 2.581 -3.591
156 1HB CYS 24 HB2 CYS 24 -4.087 3.663 -1.536
157 2HB CYS 24 HB1 CYS 24 -4.119 2.003 -0.949
158 H ASN 25 HN ASN 25 -1.673 0.722 -3.515
159 HA ASN 25 HA ASN 25 -2.786 -1.748 -2.560
160 1HB ASN 25 HB2 ASN 25 -2.653 -2.950 -4.701
161 2HB ASN 25 HB1 ASN 25 -3.836 -1.648 -4.771
162 1HD2 ASN 25 1HD2 ASN 25 -3.223 0.318 -5.839
163 2HD2 ASN 25 2HD2 ASN 25 -2.055 0.278 -7.111
164 H CYS 26 HN CYS 26 -1.156 -2.768 -1.614
165 HA CYS 26 HA CYS 26 1.582 -2.119 -2.384
166 1HB CYS 26 HB2 CYS 26 2.182 -3.378 -0.305
167 2HB CYS 26 HB1 CYS 26 1.135 -1.991 -0.026
168 H ASN 27 HN ASN 27 2.835 -3.429 -3.542
169 HA ASN 27 HA ASN 27 1.957 -6.212 -3.919
170 1HB ASN 27 HB2 ASN 27 3.250 -4.299 -5.852
171 2HB ASN 27 HB1 ASN 27 3.200 -6.036 -6.136
172 1HD2 ASN 27 1HD2 ASN 27 2.000 -3.884 -7.667
173 2HD2 ASN 27 2HD2 ASN 27 0.303 -4.205 -7.707
174 H VAL 28 HN VAL 28 4.949 -4.634 -4.856
175 HA VAL 28 HA VAL 28 6.440 -6.163 -2.863
176 HB VAL 28 HB VAL 28 7.196 -6.254 -5.784
177 1HG1 VAL 28 1HG1 VAL 28 8.391 -7.276 -3.263
178 2HG1 VAL 28 2HG1 VAL 28 9.172 -6.613 -4.698
179 3HG1 VAL 28 3HG1 VAL 28 8.545 -8.261 -4.717
180 1HG2 VAL 28 1HG2 VAL 28 5.873 -8.378 -4.098
181 2HG2 VAL 28 2HG2 VAL 28 6.488 -8.604 -5.735
182 3HG2 VAL 28 3HG2 VAL 28 5.138 -7.507 -5.445
Start of MODEL 25
1 1H VAL 1 HT1 VAL 1 -9.577 3.298 1.252
2 2H VAL 1 HT2 VAL 1 -9.883 2.119 2.461
3 3H VAL 1 HT3 VAL 1 -8.548 1.936 1.398
4 HA VAL 1 HA VAL 1 -8.933 3.863 3.571
5 HB VAL 1 HB VAL 1 -6.506 2.191 2.995
6 1HG1 VAL 1 1HG1 VAL 1 -6.471 2.354 5.581
7 2HG1 VAL 1 2HG1 VAL 1 -7.615 3.675 5.343
8 3HG1 VAL 1 3HG1 VAL 1 -6.007 3.760 4.623
9 1HG2 VAL 1 1HG2 VAL 1 -7.507 0.613 4.765
10 2HG2 VAL 1 2HG2 VAL 1 -8.093 0.485 3.107
11 3HG2 VAL 1 3HG2 VAL 1 -9.056 1.330 4.318
12 H GLY 2 HN GLY 2 -7.053 5.338 3.854
13 1HA GLY 2 HA2 GLY 2 -6.652 6.868 1.499
14 2HA GLY 2 HA1 GLY 2 -5.869 7.136 3.049
15 H CYS 3 HN CYS 3 -4.381 7.649 0.912
16 HA CYS 3 HA CYS 3 -2.865 5.318 0.112
17 1HB CYS 3 HB2 CYS 3 -3.412 7.495 -1.264
18 2HB CYS 3 HB1 CYS 3 -1.975 8.118 -0.461
19 H GLU 4 HN GLU 4 -2.620 7.904 2.426
20 HA GLU 4 HA GLU 4 0.167 7.367 2.994
21 1HB GLU 4 HB2 GLU 4 -1.267 9.626 3.166
22 2HB GLU 4 HB1 GLU 4 -1.448 9.049 4.816
23 1HG GLU 4 HG2 GLU 4 1.242 9.270 3.517
24 2HG GLU 4 HG1 GLU 4 0.475 10.647 4.307
25 H GLU 5 HN GLU 5 -2.506 5.751 3.672
26 HA GLU 5 HA GLU 5 -1.674 5.005 6.386
27 1HB GLU 5 HB2 GLU 5 -4.341 5.031 5.029
28 2HB GLU 5 HB1 GLU 5 -4.055 3.919 6.361
29 1HG GLU 5 HG2 GLU 5 -3.757 6.912 6.475
30 2HG GLU 5 HG1 GLU 5 -5.113 5.981 7.111
31 H CYS 6 HN CYS 6 -1.470 3.982 3.237
32 HA CYS 6 HA CYS 6 -2.038 1.252 3.424
33 1HB CYS 6 HB2 CYS 6 -0.017 2.565 1.623
34 2HB CYS 6 HB1 CYS 6 -0.799 1.010 1.360
35 HA PRO 7 HA PRO 7 2.840 1.002 4.341
36 1HB PRO 7 HB2 PRO 7 2.724 3.250 6.293
37 2HB PRO 7 HB1 PRO 7 4.036 2.763 5.215
38 1HG PRO 7 HG2 PRO 7 2.527 4.903 4.677
39 2HG PRO 7 HG1 PRO 7 3.114 3.838 3.387
40 1HD PRO 7 HD2 PRO 7 0.381 4.065 4.554
41 2HD PRO 7 HD1 PRO 7 0.871 3.670 2.900
42 H MET 8 HN MET 8 0.126 1.814 6.381
43 HA MET 8 HA MET 8 1.109 -0.038 8.443
44 1HB MET 8 HB2 MET 8 0.396 2.475 8.884
45 2HB MET 8 HB1 MET 8 -1.213 1.767 8.933
46 1HG MET 8 HG2 MET 8 -0.788 0.580 10.842
47 2HG MET 8 HG1 MET 8 0.949 0.520 10.548
48 1HE MET 8 HE1 MET 8 -1.505 3.765 12.568
49 2HE MET 8 HE2 MET 8 -2.073 2.445 11.545
50 3HE MET 8 HE3 MET 8 -1.463 3.929 10.812
51 H HIS 9 HN HIS 9 -1.611 0.712 6.329
52 HA HIS 9 HA HIS 9 -3.119 -1.536 7.392
53 1HB HIS 9 HB2 HIS 9 -4.989 -0.711 6.253
54 2HB HIS 9 HB1 HIS 9 -4.137 0.731 6.767
55 HD1 HIS 9 HD1 HIS 9 -3.946 -1.415 3.599
56 HD2 HIS 9 HD2 HIS 9 -4.355 2.531 4.815
57 HE1 HIS 9 HE1 HIS 9 -4.084 -0.073 1.481
58 HE2 HIS 9 HE2 HIS 9 -4.461 2.298 2.243
59 H CYS 10 HN CYS 10 -0.571 -1.683 5.661
60 HA CYS 10 HA CYS 10 -1.633 -3.754 3.875
61 1HB CYS 10 HB2 CYS 10 -0.800 -1.393 2.858
62 2HB CYS 10 HB1 CYS 10 0.728 -2.267 2.884
63 H LYS 11 HN LYS 11 -0.957 -5.139 5.646
64 HA LYS 11 HA LYS 11 1.670 -5.329 6.594
65 1HB LYS 11 HB2 LYS 11 -0.379 -6.434 7.567
66 2HB LYS 11 HB1 LYS 11 -0.259 -7.631 6.285
67 1HG LYS 11 HG2 LYS 11 1.591 -8.618 7.186
68 2HG LYS 11 HG1 LYS 11 2.135 -7.135 7.974
69 1HD LYS 11 HD2 LYS 11 0.509 -7.355 9.695
70 2HD LYS 11 HD1 LYS 11 -0.324 -8.649 8.831
71 1HE LYS 11 HE2 LYS 11 0.862 -9.903 10.319
72 2HE LYS 11 HE1 LYS 11 2.049 -9.805 9.018
73 1HZ LYS 11 HZ1 LYS 11 2.772 -7.677 10.320
74 2HZ LYS 11 HZ2 LYS 11 3.310 -9.205 10.807
75 3HZ LYS 11 HZ3 LYS 11 2.030 -8.460 11.624
76 H GLY 12 HN GLY 12 3.159 -7.190 6.207
77 1HA GLY 12 HA2 GLY 12 3.415 -8.960 4.288
78 2HA GLY 12 HA1 GLY 12 3.527 -7.495 3.326
79 H LYS 13 HN LYS 13 5.010 -5.882 4.952
80 HA LYS 13 HA LYS 13 7.069 -5.394 5.769
81 1HB LYS 13 HB2 LYS 13 6.751 -7.606 6.928
82 2HB LYS 13 HB1 LYS 13 7.677 -8.312 5.616
83 1HG LYS 13 HG2 LYS 13 9.387 -6.399 6.304
84 2HG LYS 13 HG1 LYS 13 8.570 -6.592 7.856
85 1HD LYS 13 HD2 LYS 13 9.116 -8.937 7.909
86 2HD LYS 13 HD1 LYS 13 9.788 -8.856 6.279
87 1HE LYS 13 HE2 LYS 13 11.302 -6.993 7.392
88 2HE LYS 13 HE1 LYS 13 10.915 -7.893 8.857
89 1HZ LYS 13 HZ1 LYS 13 11.966 -9.221 6.431
90 2HZ LYS 13 HZ2 LYS 13 11.912 -9.820 8.012
91 3HZ LYS 13 HZ3 LYS 13 12.988 -8.577 7.615
92 H ASN 14 HN ASN 14 6.455 -7.112 2.951
93 HA ASN 14 HA ASN 14 8.834 -6.016 1.710
94 1HB ASN 14 HB2 ASN 14 8.109 -8.882 1.884
95 2HB ASN 14 HB1 ASN 14 8.654 -8.317 0.308
96 1HD2 ASN 14 1HD2 ASN 14 9.608 -9.508 3.255
97 2HD2 ASN 14 2HD2 ASN 14 11.284 -9.094 3.187
98 H ALA 15 HN ALA 15 6.135 -5.142 1.762
99 HA ALA 15 HA ALA 15 5.530 -5.313 -1.105
100 1HB ALA 15 HB1 ALA 15 3.389 -5.960 -0.826
101 2HB ALA 15 HB2 ALA 15 3.196 -5.046 0.670
102 3HB ALA 15 HB3 ALA 15 4.000 -6.616 0.693
103 H LYS 16 HN LYS 16 5.994 -3.313 -1.801
104 HA LYS 16 HA LYS 16 5.500 -1.007 -0.127
105 1HB LYS 16 HB2 LYS 16 7.520 -0.917 -1.362
106 2HB LYS 16 HB1 LYS 16 6.713 -1.354 -2.861
107 1HG LYS 16 HG2 LYS 16 5.554 0.809 -2.851
108 2HG LYS 16 HG1 LYS 16 6.401 1.242 -1.365
109 1HD LYS 16 HD2 LYS 16 8.463 0.496 -2.995
110 2HD LYS 16 HD1 LYS 16 7.343 1.234 -4.141
111 1HE LYS 16 HE2 LYS 16 8.331 3.153 -3.514
112 2HE LYS 16 HE1 LYS 16 7.267 3.032 -2.114
113 1HZ LYS 16 HZ1 LYS 16 9.674 3.444 -1.619
114 2HZ LYS 16 HZ2 LYS 16 9.995 1.875 -2.163
115 3HZ LYS 16 HZ3 LYS 16 8.995 2.116 -0.820
116 HA PRO 17 HA PRO 17 1.474 -0.332 -1.903
117 1HB PRO 17 HB2 PRO 17 0.880 1.965 -0.650
118 2HB PRO 17 HB1 PRO 17 0.946 0.425 0.215
119 1HG PRO 17 HG2 PRO 17 2.988 2.608 0.074
120 2HG PRO 17 HG1 PRO 17 2.462 1.657 1.475
121 1HD PRO 17 HD2 PRO 17 4.750 1.143 0.052
122 2HD PRO 17 HD1 PRO 17 3.856 -0.087 0.965
123 H THR 18 HN THR 18 0.573 0.820 -3.559
124 HA THR 18 HA THR 18 2.071 3.124 -4.586
125 HB THR 18 HB THR 18 2.521 1.020 -5.887
126 HG1 THR 18 HG1 THR 18 2.893 2.451 -7.353
127 1HG2 THR 18 1HG2 THR 18 0.219 1.107 -7.523
128 2HG2 THR 18 2HG2 THR 18 -0.285 0.838 -5.857
129 3HG2 THR 18 3HG2 THR 18 0.880 -0.249 -6.610
130 H CYS 19 HN CYS 19 0.847 4.681 -5.748
131 HA CYS 19 HA CYS 19 -2.019 4.580 -5.099
132 1HB CYS 19 HB2 CYS 19 -0.086 6.544 -4.580
133 2HB CYS 19 HB1 CYS 19 -1.109 7.205 -5.848
134 H ASP 20 HN ASP 20 -3.335 4.229 -6.751
135 HA ASP 20 HA ASP 20 -2.615 5.275 -9.381
136 1HB ASP 20 HB2 ASP 20 -2.447 2.691 -8.953
137 2HB ASP 20 HB1 ASP 20 -4.197 2.756 -9.123
138 H ASP 21 HN ASP 21 -3.973 6.978 -9.551
139 HA ASP 21 HA ASP 21 -5.894 8.205 -9.596
140 1HB ASP 21 HB2 ASP 21 -6.743 5.495 -10.553
141 2HB ASP 21 HB1 ASP 21 -7.957 6.749 -10.323
142 H GLY 22 HN GLY 22 -5.246 7.751 -7.072
143 1HA GLY 22 HA2 GLY 22 -6.099 7.851 -4.963
144 2HA GLY 22 HA1 GLY 22 -7.682 7.924 -5.704
145 H VAL 23 HN VAL 23 -5.822 5.214 -6.615
146 HA VAL 23 HA VAL 23 -7.326 3.530 -4.720
147 HB VAL 23 HB VAL 23 -6.371 2.750 -7.477
148 1HG1 VAL 23 1HG1 VAL 23 -6.562 0.728 -6.458
149 2HG1 VAL 23 2HG1 VAL 23 -8.255 0.959 -6.896
150 3HG1 VAL 23 3HG1 VAL 23 -7.712 1.317 -5.257
151 1HG2 VAL 23 1HG2 VAL 23 -8.976 2.697 -7.804
152 2HG2 VAL 23 2HG2 VAL 23 -8.071 4.197 -8.009
153 3HG2 VAL 23 3HG2 VAL 23 -8.947 3.893 -6.508
154 H CYS 24 HN CYS 24 -5.898 3.049 -3.142
155 HA CYS 24 HA CYS 24 -3.106 2.717 -3.586
156 1HB CYS 24 HB2 CYS 24 -3.954 3.453 -1.418
157 2HB CYS 24 HB1 CYS 24 -4.821 1.935 -1.217
158 H ASN 25 HN ASN 25 -1.877 0.881 -3.734
159 HA ASN 25 HA ASN 25 -3.006 -1.738 -3.435
160 1HB ASN 25 HB2 ASN 25 -2.334 -2.340 -5.866
161 2HB ASN 25 HB1 ASN 25 -3.876 -1.536 -5.594
162 1HD2 ASN 25 1HD2 ASN 25 -1.483 -1.633 -7.675
163 2HD2 ASN 25 2HD2 ASN 25 -1.415 0.012 -8.196
164 H CYS 26 HN CYS 26 -1.454 -2.958 -2.618
165 HA CYS 26 HA CYS 26 1.327 -2.127 -2.941
166 1HB CYS 26 HB2 CYS 26 0.216 -4.266 -1.119
167 2HB CYS 26 HB1 CYS 26 1.814 -3.533 -1.044
168 H ASN 27 HN ASN 27 2.984 -3.847 -3.200
169 HA ASN 27 HA ASN 27 2.100 -6.239 -4.592
170 1HB ASN 27 HB2 ASN 27 3.765 -4.084 -5.877
171 2HB ASN 27 HB1 ASN 27 3.754 -5.744 -6.464
172 1HD2 ASN 27 1HD2 ASN 27 2.176 -2.744 -6.464
173 2HD2 ASN 27 2HD2 ASN 27 0.798 -3.198 -7.400
174 H VAL 28 HN VAL 28 5.213 -4.613 -4.598
175 HA VAL 28 HA VAL 28 6.288 -6.438 -2.613
176 HB VAL 28 HB VAL 28 6.524 -7.720 -4.689
177 1HG1 VAL 28 1HG1 VAL 28 7.359 -6.925 -6.631
178 2HG1 VAL 28 2HG1 VAL 28 8.528 -5.877 -5.828
179 3HG1 VAL 28 3HG1 VAL 28 6.842 -5.378 -5.963
180 1HG2 VAL 28 1HG2 VAL 28 8.388 -7.401 -2.794
181 2HG2 VAL 28 2HG2 VAL 28 9.316 -6.875 -4.198
182 3HG2 VAL 28 3HG2 VAL 28 8.593 -8.484 -4.170