Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
14410 | 1wo5 RC | 6327 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ARG 1 1HT ARG 1 -1.035 -1.771 7.130
2 2H ARG 1 2HT ARG 1 -1.357 -0.911 8.580
3 3H ARG 1 3HT ARG 1 -1.339 -0.085 7.076
4 HA ARG 1 HA ARG 1 -3.303 -1.990 8.122
5 1HB ARG 1 2HB ARG 1 -3.200 0.660 8.345
6 2HB ARG 1 1HB ARG 1 -3.893 0.581 6.732
7 1HG ARG 1 2HG ARG 1 -5.783 0.666 8.011
8 2HG ARG 1 1HG ARG 1 -5.570 -1.079 7.857
9 1HD ARG 1 2HD ARG 1 -4.588 0.577 10.177
10 2HD ARG 1 1HD ARG 1 -6.091 -0.345 10.167
11 HE ARG 1 HE ARG 1 -3.432 -1.370 10.507
12 1HH1 ARG 1 1HH1 ARG 1 -6.674 -2.144 9.472
13 2HH1 ARG 1 2HH1 ARG 1 -6.497 -3.841 9.765
14 1HH2 ARG 1 1HH2 ARG 1 -3.197 -3.602 10.893
15 2HH2 ARG 1 2HH2 ARG 1 -4.523 -4.670 10.572
16 H VAL 2 H VAL 2 -1.775 -0.743 5.243
17 HA VAL 2 HA VAL 2 -2.134 -1.079 3.009
18 HB VAL 2 HB VAL 2 -1.128 -3.219 3.741
19 1HG1 VAL 2 1HG1 VAL 2 -4.002 -4.086 3.964
20 2HG1 VAL 2 2HG1 VAL 2 -2.770 -4.088 5.227
21 3HG1 VAL 2 3HG1 VAL 2 -2.646 -5.210 3.871
22 1HG2 VAL 2 1HG2 VAL 2 -3.095 -3.952 1.630
23 2HG2 VAL 2 2HG2 VAL 2 -1.353 -4.217 1.691
24 3HG2 VAL 2 3HG2 VAL 2 -1.989 -2.610 1.334
25 H ILE 3 H ILE 3 -4.485 -0.175 4.463
26 HA ILE 3 HA ILE 3 -6.711 -1.574 3.216
27 HB ILE 3 HB ILE 3 -6.946 -0.798 5.536
28 1HG1 ILE 3 2HG1 ILE 3 -8.872 0.966 4.148
29 2HG1 ILE 3 1HG1 ILE 3 -8.816 -0.699 3.577
30 1HG2 ILE 3 1HG2 ILE 3 -5.556 1.188 5.432
31 2HG2 ILE 3 2HG2 ILE 3 -7.167 1.597 6.020
32 3HG2 ILE 3 3HG2 ILE 3 -6.715 1.966 4.356
33 1HD1 ILE 3 1HD1 ILE 3 -10.184 -1.221 5.232
34 2HD1 ILE 3 2HD1 ILE 3 -10.022 0.385 5.944
35 3HD1 ILE 3 3HD1 ILE 3 -8.867 -0.883 6.355
36 H ALA 4 H ALA 4 -5.038 1.524 3.019
37 HA ALA 4 HA ALA 4 -6.806 2.796 1.235
38 1HB ALA 4 1HB ALA 4 -3.868 3.209 1.751
39 2HB ALA 4 2HB ALA 4 -5.221 4.116 2.428
40 3HB ALA 4 3HB ALA 4 -4.836 4.253 0.712
41 H CYS 5 H CYS 5 -4.340 0.403 0.765
42 HA CYS 5 HA CYS 5 -3.700 0.764 -1.915
43 1HB CYS 5 2HB CYS 5 -2.651 -0.864 -0.290
44 2HB CYS 5 1HB CYS 5 -4.032 -1.919 -0.567
45 H PHE 6 H PHE 6 -4.994 0.867 -3.618
46 HA PHE 6 HA PHE 6 -7.569 -0.526 -3.558
47 1HB PHE 6 2HB PHE 6 -8.184 0.909 -5.443
48 2HB PHE 6 1HB PHE 6 -7.597 1.873 -4.092
49 HD1 PHE 6 1HD PHE 6 -5.382 2.931 -4.195
50 HD2 PHE 6 2HD PHE 6 -7.026 0.848 -7.522
51 HE1 PHE 6 1HE PHE 6 -3.740 4.010 -5.676
52 HE2 PHE 6 2HE PHE 6 -5.386 1.923 -9.010
53 HZ PHE 6 HZ PHE 6 -3.741 3.506 -8.087
54 H LEU 7 H LEU 7 -5.074 -1.965 -3.987
55 HA LEU 7 HA LEU 7 -5.558 -2.942 -6.726
56 1HB LEU 7 2HB LEU 7 -3.036 -2.466 -5.217
57 2HB LEU 7 1HB LEU 7 -3.087 -3.829 -6.320
58 HG LEU 7 HG LEU 7 -3.717 -0.992 -7.128
59 1HD1 LEU 7 1HD1 LEU 7 -1.340 -1.421 -6.342
60 2HD1 LEU 7 2HD1 LEU 7 -1.534 -0.778 -7.972
61 3HD1 LEU 7 3HD1 LEU 7 -1.187 -2.491 -7.736
62 1HD2 LEU 7 1HD2 LEU 7 -2.855 -3.041 -9.068
63 2HD2 LEU 7 2HD2 LEU 7 -4.050 -1.755 -9.228
64 3HD2 LEU 7 3HD2 LEU 7 -4.467 -3.245 -8.382
65 H LYS 8 H LYS 8 -4.703 -5.279 -6.962
66 HA LYS 8 HA LYS 8 -5.932 -6.836 -4.818
67 1HB LYS 8 2HB LYS 8 -5.153 -7.528 -7.649
68 2HB LYS 8 1HB LYS 8 -5.752 -8.716 -6.501
69 1HG LYS 8 2HG LYS 8 -7.722 -8.209 -7.465
70 2HG LYS 8 1HG LYS 8 -7.699 -6.894 -6.288
71 1HD LYS 8 2HD LYS 8 -7.145 -5.309 -7.874
72 2HD LYS 8 1HD LYS 8 -6.428 -6.498 -8.962
73 1HE LYS 8 2HE LYS 8 -8.994 -7.355 -8.897
74 2HE LYS 8 1HE LYS 8 -9.224 -5.620 -8.687
75 1HZ LYS 8 1HZ LYS 8 -7.683 -5.398 -10.682
76 2HZ LYS 8 2HZ LYS 8 -9.254 -5.951 -10.978
77 3HZ LYS 8 3HZ LYS 8 -7.966 -7.046 -10.949
78 H VAL 9 H VAL 9 -3.242 -7.630 -7.002
79 HA VAL 9 HA VAL 9 -1.934 -9.322 -5.215
80 HB VAL 9 HB VAL 9 -1.474 -9.312 -7.626
81 1HG1 VAL 9 1HG1 VAL 9 -0.094 -6.690 -7.066
82 2HG1 VAL 9 2HG1 VAL 9 -1.523 -6.941 -8.069
83 3HG1 VAL 9 3HG1 VAL 9 0.035 -7.598 -8.572
84 1HG2 VAL 9 1HG2 VAL 9 0.712 -9.996 -7.444
85 2HG2 VAL 9 2HG2 VAL 9 0.210 -10.033 -5.753
86 3HG2 VAL 9 3HG2 VAL 9 1.152 -8.672 -6.365
87 H CYS 10 H CYS 10 -1.643 -5.853 -5.707
88 HA CYS 10 HA CYS 10 0.693 -5.425 -4.203
89 1HB CYS 10 2HB CYS 10 -0.566 -3.806 -5.766
90 2HB CYS 10 1HB CYS 10 -1.564 -3.443 -4.364
91 H ALA 11 H ALA 11 -2.705 -4.917 -3.240
92 HA ALA 11 HA ALA 11 -2.066 -4.545 -0.492
93 1HB ALA 11 1HB ALA 11 -4.213 -3.932 -1.980
94 2HB ALA 11 2HB ALA 11 -4.251 -4.038 -0.220
95 3HB ALA 11 3HB ALA 11 -4.802 -5.399 -1.197
96 H ALA 12 H ALA 12 -2.837 -7.316 -2.459
97 HA ALA 12 HA ALA 12 -3.296 -9.048 -0.183
98 1HB ALA 12 1HB ALA 12 -3.878 -10.711 -1.715
99 2HB ALA 12 2HB ALA 12 -2.947 -9.969 -3.015
100 3HB ALA 12 3HB ALA 12 -4.444 -9.218 -2.463
101 H ALA 13 H ALA 13 -0.700 -7.788 -0.260
102 HA ALA 13 HA ALA 13 1.050 -10.084 -0.806
103 1HB ALA 13 1HB ALA 13 1.589 -7.135 -0.706
104 2HB ALA 13 2HB ALA 13 1.846 -8.260 -2.039
105 3HB ALA 13 3HB ALA 13 2.888 -8.324 -0.618
106 H ALA 14 H ALA 14 -0.521 -8.601 1.702
107 HA ALA 14 HA ALA 14 -0.307 -8.593 3.968
108 1HB ALA 14 1HB ALA 14 1.590 -10.870 3.906
109 2HB ALA 14 2HB ALA 14 0.002 -11.111 3.179
110 3HB ALA 14 3HB ALA 14 0.134 -10.632 4.872
111 H ASN 15 H ASN 15 1.683 -7.084 2.379
112 HA ASN 15 HA ASN 15 3.676 -6.781 4.508
113 1HB ASN 15 2HB ASN 15 4.281 -7.919 2.042
114 2HB ASN 15 1HB ASN 15 4.809 -6.248 1.876
115 1HD2 ASN 15 1HD2 ASN 15 5.529 -5.768 4.537
116 2HD2 ASN 15 2HD2 ASN 15 6.932 -6.708 4.899
117 H VAL 16 H VAL 16 2.181 -5.028 5.047
118 HA VAL 16 HA VAL 16 1.587 -2.873 3.379
119 HB VAL 16 HB VAL 16 2.055 -2.645 6.350
120 1HG1 VAL 16 1HG1 VAL 16 0.058 -1.209 4.616
121 2HG1 VAL 16 2HG1 VAL 16 1.665 -0.576 4.969
122 3HG1 VAL 16 3HG1 VAL 16 0.515 -0.841 6.279
123 1HG2 VAL 16 1HG2 VAL 16 -0.695 -3.081 5.678
124 2HG2 VAL 16 2HG2 VAL 16 0.342 -3.996 6.771
125 3HG2 VAL 16 3HG2 VAL 16 0.283 -4.410 5.058
126 H ALA 17 H ALA 17 4.178 -3.093 5.828
127 HA ALA 17 HA ALA 17 5.394 -0.654 5.324
128 1HB ALA 17 1HB ALA 17 5.857 -2.426 7.157
129 2HB ALA 17 2HB ALA 17 7.179 -1.401 6.598
130 3HB ALA 17 3HB ALA 17 7.039 -3.057 6.010
131 H ALA 18 H ALA 18 5.586 -3.646 3.543
132 HA ALA 18 HA ALA 18 7.821 -2.760 1.930
133 1HB ALA 18 1HB ALA 18 7.969 -4.894 1.191
134 2HB ALA 18 2HB ALA 18 6.221 -5.088 1.065
135 3HB ALA 18 3HB ALA 18 7.011 -5.217 2.636
136 H HIS 19 H HIS 19 4.329 -3.027 1.670
137 HA HIS 19 HA HIS 19 4.238 -2.396 -1.119
138 1HB HIS 19 2HB HIS 19 2.152 -3.169 -0.882
139 2HB HIS 19 1HB HIS 19 2.414 -3.311 0.847
140 HD2 HIS 19 2HD HIS 19 1.661 -0.915 2.303
141 HE1 HIS 19 1HE HIS 19 -1.038 0.253 -0.721
142 HE2 HIS 19 2HE HIS 19 -0.212 0.732 1.622
143 H MET 20 H MET 20 4.028 -0.590 1.871
144 HA MET 20 HA MET 20 2.962 1.804 1.114
145 1HB MET 20 2HB MET 20 5.073 1.037 3.068
146 2HB MET 20 1HB MET 20 4.855 2.749 2.728
147 1HG MET 20 2HG MET 20 2.309 2.088 3.142
148 2HG MET 20 1HG MET 20 3.079 0.845 4.127
149 1HE MET 20 1HE MET 20 1.073 2.835 4.902
150 2HE MET 20 2HE MET 20 1.602 4.511 4.756
151 3HE MET 20 3HE MET 20 1.590 3.724 6.334
152 H THR 21 H THR 21 6.069 0.522 0.189
153 HA THR 21 HA THR 21 7.364 2.868 -0.589
154 HB THR 21 HB THR 21 8.446 0.645 -0.434
155 HG1 THR 21 1HG THR 21 9.870 1.102 -1.994
156 1HG2 THR 21 1HG2 THR 21 7.441 0.006 -3.170
157 2HG2 THR 21 2HG2 THR 21 6.554 -0.517 -1.739
158 3HG2 THR 21 3HG2 THR 21 8.218 -1.044 -1.987
159 H HIS 22 H HIS 22 5.253 0.729 -2.490
160 HA HIS 22 HA HIS 22 5.225 2.705 -4.636
161 1HB HIS 22 2HB HIS 22 4.037 0.841 -5.898
162 2HB HIS 22 1HB HIS 22 5.725 0.554 -5.483
163 HD1 HIS 22 1HD HIS 22 5.909 -1.860 -5.025
164 HD2 HIS 22 2HD HIS 22 2.492 -0.229 -3.280
165 HE1 HIS 22 1HE HIS 22 4.874 -3.725 -3.698
166 HE2 HIS 22 2HE HIS 22 2.836 -2.708 -2.626
167 H CYS 23 H CYS 23 3.624 2.563 -1.954
168 HA CYS 23 HA CYS 23 1.111 3.389 -3.175
169 1HB CYS 23 2HB CYS 23 1.559 0.989 -1.559
170 2HB CYS 23 1HB CYS 23 0.241 1.991 -0.977
171 H ALA 24 H ALA 24 3.325 4.785 -1.865
172 HA ALA 24 HA ALA 24 2.410 5.541 0.759
173 1HB ALA 24 1HB ALA 24 4.840 5.573 -0.392
174 2HB ALA 24 2HB ALA 24 4.407 6.568 0.998
175 3HB ALA 24 3HB ALA 24 4.370 7.256 -0.626
176 H LYS 25 H LYS 25 2.739 8.239 0.871
177 HA LYS 25 HA LYS 25 0.306 9.162 -0.402
178 1HB LYS 25 2HB LYS 25 2.162 10.342 1.654
179 2HB LYS 25 1HB LYS 25 0.864 11.284 0.932
180 1HG LYS 25 2HG LYS 25 0.171 8.644 2.090
181 2HG LYS 25 1HG LYS 25 0.554 9.962 3.199
182 1HD LYS 25 2HD LYS 25 -1.108 11.274 1.588
183 2HD LYS 25 1HD LYS 25 -1.733 9.643 1.333
184 1HE LYS 25 2HE LYS 25 -2.320 9.388 3.575
185 2HE LYS 25 1HE LYS 25 -1.259 10.695 4.098
186 1HZ LYS 25 1HZ LYS 25 -2.875 12.075 2.566
187 2HZ LYS 25 2HZ LYS 25 -3.248 11.754 4.184
188 3HZ LYS 25 3HZ LYS 25 -3.946 10.825 2.956
Start of MODEL 2
1 1H ARG 1 1HT ARG 1 -2.338 1.170 7.941
2 2H ARG 1 2HT ARG 1 -0.898 0.277 8.216
3 3H ARG 1 3HT ARG 1 -2.133 0.308 9.408
4 HA ARG 1 HA ARG 1 -1.988 -1.743 8.075
5 1HB ARG 1 2HB ARG 1 -4.419 -0.002 8.337
6 2HB ARG 1 1HB ARG 1 -4.553 -1.586 7.588
7 1HG ARG 1 2HG ARG 1 -3.595 -2.592 9.635
8 2HG ARG 1 1HG ARG 1 -3.602 -0.992 10.381
9 1HD ARG 1 2HD ARG 1 -5.840 -1.000 10.691
10 2HD ARG 1 1HD ARG 1 -6.151 -1.856 9.182
11 HE ARG 1 HE ARG 1 -4.927 -3.537 11.136
12 1HH1 ARG 1 1HH1 ARG 1 -7.973 -2.147 10.149
13 2HH1 ARG 1 2HH1 ARG 1 -8.922 -3.404 10.869
14 1HH2 ARG 1 1HH2 ARG 1 -6.174 -5.191 12.081
15 2HH2 ARG 1 2HH2 ARG 1 -7.901 -5.132 11.966
16 H VAL 2 H VAL 2 -2.090 -2.718 6.102
17 HA VAL 2 HA VAL 2 -1.908 -0.972 3.785
18 HB VAL 2 HB VAL 2 -0.248 -2.757 4.049
19 1HG1 VAL 2 1HG1 VAL 2 -1.023 -4.642 4.988
20 2HG1 VAL 2 2HG1 VAL 2 -1.418 -5.104 3.333
21 3HG1 VAL 2 3HG1 VAL 2 -2.656 -4.398 4.370
22 1HG2 VAL 2 1HG2 VAL 2 -1.100 -3.963 1.729
23 2HG2 VAL 2 2HG2 VAL 2 -0.193 -2.455 1.836
24 3HG2 VAL 2 3HG2 VAL 2 -1.951 -2.419 1.709
25 H ILE 3 H ILE 3 -4.403 -0.726 4.584
26 HA ILE 3 HA ILE 3 -6.002 -2.573 2.941
27 HB ILE 3 HB ILE 3 -6.662 -2.522 5.297
28 1HG1 ILE 3 2HG1 ILE 3 -8.895 -1.041 4.017
29 2HG1 ILE 3 1HG1 ILE 3 -8.314 -2.472 3.175
30 1HG2 ILE 3 1HG2 ILE 3 -6.547 0.380 4.854
31 2HG2 ILE 3 2HG2 ILE 3 -6.278 -0.558 6.321
32 3HG2 ILE 3 3HG2 ILE 3 -7.922 -0.183 5.804
33 1HD1 ILE 3 1HD1 ILE 3 -9.754 -3.572 4.469
34 2HD1 ILE 3 2HD1 ILE 3 -9.888 -2.238 5.614
35 3HD1 ILE 3 3HD1 ILE 3 -8.546 -3.376 5.737
36 H ALA 4 H ALA 4 -5.042 0.728 3.376
37 HA ALA 4 HA ALA 4 -7.075 2.054 1.987
38 1HB ALA 4 1HB ALA 4 -4.174 2.852 1.954
39 2HB ALA 4 2HB ALA 4 -5.227 3.093 3.348
40 3HB ALA 4 3HB ALA 4 -5.591 3.894 1.820
41 H CYS 5 H CYS 5 -4.363 0.177 0.848
42 HA CYS 5 HA CYS 5 -4.210 1.088 -1.790
43 1HB CYS 5 2HB CYS 5 -2.649 -0.528 -0.548
44 2HB CYS 5 1HB CYS 5 -3.789 -1.789 -1.003
45 H PHE 6 H PHE 6 -4.916 -0.045 -3.753
46 HA PHE 6 HA PHE 6 -7.430 -1.524 -3.444
47 1HB PHE 6 2HB PHE 6 -8.491 -0.181 -5.201
48 2HB PHE 6 1HB PHE 6 -8.035 0.822 -3.828
49 HD1 PHE 6 1HD PHE 6 -5.557 1.823 -4.057
50 HD2 PHE 6 2HD PHE 6 -8.073 0.659 -7.286
51 HE1 PHE 6 1HE PHE 6 -4.311 3.318 -5.562
52 HE2 PHE 6 2HE PHE 6 -6.830 2.151 -8.798
53 HZ PHE 6 HZ PHE 6 -4.946 3.483 -7.936
54 H LEU 7 H LEU 7 -4.728 -2.354 -4.134
55 HA LEU 7 HA LEU 7 -5.144 -3.206 -6.924
56 1HB LEU 7 2HB LEU 7 -2.677 -2.599 -5.345
57 2HB LEU 7 1HB LEU 7 -2.590 -3.748 -6.667
58 HG LEU 7 HG LEU 7 -3.816 -1.086 -7.203
59 1HD1 LEU 7 1HD1 LEU 7 -0.866 -1.588 -6.876
60 2HD1 LEU 7 2HD1 LEU 7 -1.859 -0.418 -6.008
61 3HD1 LEU 7 3HD1 LEU 7 -1.546 -0.203 -7.730
62 1HD2 LEU 7 1HD2 LEU 7 -1.860 -2.371 -8.999
63 2HD2 LEU 7 2HD2 LEU 7 -3.395 -1.585 -9.365
64 3HD2 LEU 7 3HD2 LEU 7 -3.375 -3.237 -8.748
65 H LYS 8 H LYS 8 -4.416 -5.380 -7.471
66 HA LYS 8 HA LYS 8 -5.260 -7.276 -5.470
67 1HB LYS 8 2HB LYS 8 -5.797 -7.376 -7.965
68 2HB LYS 8 1HB LYS 8 -4.144 -7.929 -8.192
69 1HG LYS 8 2HG LYS 8 -4.925 -9.647 -6.290
70 2HG LYS 8 1HG LYS 8 -6.478 -9.336 -7.069
71 1HD LYS 8 2HD LYS 8 -5.196 -9.768 -9.272
72 2HD LYS 8 1HD LYS 8 -3.983 -10.519 -8.235
73 1HE LYS 8 2HE LYS 8 -5.531 -12.189 -9.084
74 2HE LYS 8 1HE LYS 8 -5.697 -12.025 -7.336
75 1HZ LYS 8 1HZ LYS 8 -7.452 -10.491 -9.136
76 2HZ LYS 8 2HZ LYS 8 -7.727 -10.981 -7.541
77 3HZ LYS 8 3HZ LYS 8 -7.799 -12.112 -8.797
78 H VAL 9 H VAL 9 -2.281 -6.665 -7.312
79 HA VAL 9 HA VAL 9 -0.826 -8.554 -5.635
80 HB VAL 9 HB VAL 9 -0.413 -8.573 -8.060
81 1HG1 VAL 9 1HG1 VAL 9 -0.564 -5.864 -7.935
82 2HG1 VAL 9 2HG1 VAL 9 0.110 -6.769 -9.290
83 3HG1 VAL 9 3HG1 VAL 9 1.178 -6.108 -8.053
84 1HG2 VAL 9 1HG2 VAL 9 2.169 -7.575 -7.038
85 2HG2 VAL 9 2HG2 VAL 9 1.767 -9.111 -7.806
86 3HG2 VAL 9 3HG2 VAL 9 1.406 -8.858 -6.099
87 H CYS 10 H CYS 10 -1.688 -6.550 -4.070
88 HA CYS 10 HA CYS 10 0.785 -5.353 -3.192
89 1HB CYS 10 2HB CYS 10 -0.483 -3.809 -4.937
90 2HB CYS 10 1HB CYS 10 -1.447 -3.398 -3.523
91 H ALA 11 H ALA 11 -2.697 -4.742 -2.706
92 HA ALA 11 HA ALA 11 -2.395 -4.642 0.139
93 1HB ALA 11 1HB ALA 11 -4.457 -3.755 0.145
94 2HB ALA 11 2HB ALA 11 -5.110 -5.007 -0.911
95 3HB ALA 11 3HB ALA 11 -4.230 -3.642 -1.600
96 H ALA 12 H ALA 12 -3.268 -7.085 -2.188
97 HA ALA 12 HA ALA 12 -4.291 -8.905 -0.182
98 1HB ALA 12 1HB ALA 12 -4.891 -10.316 -1.933
99 2HB ALA 12 2HB ALA 12 -3.656 -9.664 -3.009
100 3HB ALA 12 3HB ALA 12 -5.081 -8.702 -2.620
101 H ALA 13 H ALA 13 -1.276 -7.921 -0.719
102 HA ALA 13 HA ALA 13 -0.013 -10.551 -0.725
103 1HB ALA 13 1HB ALA 13 0.728 -8.282 -1.959
104 2HB ALA 13 2HB ALA 13 1.858 -9.556 -1.498
105 3HB ALA 13 3HB ALA 13 1.660 -8.138 -0.469
106 H ALA 14 H ALA 14 -1.362 -8.628 1.559
107 HA ALA 14 HA ALA 14 -1.194 -8.453 3.820
108 1HB ALA 14 1HB ALA 14 0.260 -10.411 4.848
109 2HB ALA 14 2HB ALA 14 0.089 -11.064 3.219
110 3HB ALA 14 3HB ALA 14 -1.345 -10.699 4.179
111 H ASN 15 H ASN 15 0.754 -7.067 2.144
112 HA ASN 15 HA ASN 15 3.019 -6.915 4.023
113 1HB ASN 15 2HB ASN 15 3.188 -7.434 1.368
114 2HB ASN 15 1HB ASN 15 3.309 -5.678 1.352
115 1HD2 ASN 15 1HD2 ASN 15 5.075 -8.387 1.375
116 2HD2 ASN 15 2HD2 ASN 15 6.507 -7.820 2.157
117 H VAL 16 H VAL 16 3.614 -4.955 4.858
118 HA VAL 16 HA VAL 16 1.725 -2.750 4.401
119 HB VAL 16 HB VAL 16 3.636 -3.063 6.717
120 1HG1 VAL 16 1HG1 VAL 16 1.760 -1.506 7.695
121 2HG1 VAL 16 2HG1 VAL 16 1.489 -1.128 5.994
122 3HG1 VAL 16 3HG1 VAL 16 3.070 -0.840 6.720
123 1HG2 VAL 16 1HG2 VAL 16 0.696 -3.732 6.650
124 2HG2 VAL 16 2HG2 VAL 16 1.788 -3.887 8.026
125 3HG2 VAL 16 3HG2 VAL 16 1.999 -4.920 6.612
126 H ALA 17 H ALA 17 5.149 -3.045 5.367
127 HA ALA 17 HA ALA 17 5.911 -0.506 4.471
128 1HB ALA 17 1HB ALA 17 7.137 -2.266 5.980
129 2HB ALA 17 2HB ALA 17 8.056 -1.090 5.042
130 3HB ALA 17 3HB ALA 17 7.880 -2.743 4.453
131 H ALA 18 H ALA 18 6.000 -3.652 2.849
132 HA ALA 18 HA ALA 18 7.368 -2.875 0.536
133 1HB ALA 18 1HB ALA 18 5.188 -4.943 0.557
134 2HB ALA 18 2HB ALA 18 6.759 -5.224 1.306
135 3HB ALA 18 3HB ALA 18 6.653 -4.897 -0.423
136 H HIS 19 H HIS 19 4.036 -2.457 1.486
137 HA HIS 19 HA HIS 19 3.082 -1.766 -1.124
138 1HB HIS 19 2HB HIS 19 1.335 -2.509 0.181
139 2HB HIS 19 1HB HIS 19 1.964 -1.758 1.643
140 HD2 HIS 19 2HD HIS 19 0.792 0.573 2.322
141 HE1 HIS 19 1HE HIS 19 -1.176 1.254 -1.353
142 HE2 HIS 19 2HE HIS 19 -1.023 1.948 1.086
143 H MET 20 H MET 20 3.414 0.209 1.833
144 HA MET 20 HA MET 20 2.987 2.692 0.799
145 1HB MET 20 2HB MET 20 3.481 2.034 3.211
146 2HB MET 20 1HB MET 20 5.184 2.167 2.795
147 1HG MET 20 2HG MET 20 4.315 4.541 1.901
148 2HG MET 20 1HG MET 20 3.161 4.266 3.204
149 1HE MET 20 1HE MET 20 3.926 5.241 5.786
150 2HE MET 20 2HE MET 20 3.709 6.217 4.333
151 3HE MET 20 3HE MET 20 5.104 6.488 5.378
152 H THR 21 H THR 21 6.085 0.948 0.784
153 HA THR 21 HA THR 21 7.673 2.965 -0.302
154 HB THR 21 HB THR 21 8.565 0.866 0.628
155 HG1 THR 21 1HG THR 21 10.153 0.554 -0.992
156 1HG2 THR 21 1HG2 THR 21 7.124 -0.334 -1.658
157 2HG2 THR 21 2HG2 THR 21 7.411 -0.962 -0.036
158 3HG2 THR 21 3HG2 THR 21 8.701 -1.004 -1.238
159 H HIS 22 H HIS 22 5.295 0.944 -1.796
160 HA HIS 22 HA HIS 22 6.021 2.013 -4.422
161 1HB HIS 22 2HB HIS 22 6.038 -0.124 -5.103
162 2HB HIS 22 1HB HIS 22 5.439 -0.669 -3.544
163 HD1 HIS 22 1HD HIS 22 4.624 -0.919 -6.938
164 HD2 HIS 22 2HD HIS 22 2.369 -0.125 -3.526
165 HE1 HIS 22 1HE HIS 22 2.248 -1.454 -7.559
166 HE2 HIS 22 2HE HIS 22 0.898 -0.905 -5.506
167 H CYS 23 H CYS 23 3.981 2.601 -2.008
168 HA CYS 23 HA CYS 23 1.906 3.612 -3.794
169 1HB CYS 23 2HB CYS 23 1.652 1.533 -1.714
170 2HB CYS 23 1HB CYS 23 0.416 2.776 -1.685
171 H ALA 24 H ALA 24 2.892 5.664 -3.328
172 HA ALA 24 HA ALA 24 3.315 6.703 -0.763
173 1HB ALA 24 1HB ALA 24 2.976 7.874 -3.474
174 2HB ALA 24 2HB ALA 24 4.335 7.985 -2.354
175 3HB ALA 24 3HB ALA 24 2.885 8.951 -2.080
176 H LYS 25 H LYS 25 2.100 8.428 0.313
177 HA LYS 25 HA LYS 25 -0.775 7.866 0.217
178 1HB LYS 25 2HB LYS 25 0.457 7.592 2.374
179 2HB LYS 25 1HB LYS 25 0.793 9.318 2.354
180 1HG LYS 25 2HG LYS 25 -2.039 8.549 2.073
181 2HG LYS 25 1HG LYS 25 -1.289 8.222 3.637
182 1HD LYS 25 2HD LYS 25 -0.431 10.657 3.468
183 2HD LYS 25 1HD LYS 25 -1.686 10.844 2.241
184 1HE LYS 25 2HE LYS 25 -2.394 9.625 4.868
185 2HE LYS 25 1HE LYS 25 -2.175 11.371 4.768
186 1HZ LYS 25 1HZ LYS 25 -4.042 11.625 3.560
187 2HZ LYS 25 2HZ LYS 25 -4.483 10.161 4.282
188 3HZ LYS 25 3HZ LYS 25 -3.847 10.172 2.715
Start of MODEL 3
1 1H ARG 1 1HT ARG 1 -0.801 0.577 7.352
2 2H ARG 1 2HT ARG 1 -0.345 -1.006 7.834
3 3H ARG 1 3HT ARG 1 -1.216 0.005 8.913
4 HA ARG 1 HA ARG 1 -2.475 -1.794 7.753
5 1HB ARG 1 2HB ARG 1 -3.198 0.527 8.835
6 2HB ARG 1 1HB ARG 1 -3.657 0.884 7.175
7 1HG ARG 1 2HG ARG 1 -5.610 -0.028 7.785
8 2HG ARG 1 1HG ARG 1 -4.776 -1.553 7.477
9 1HD ARG 1 2HD ARG 1 -4.382 -0.419 10.163
10 2HD ARG 1 1HD ARG 1 -6.028 -0.934 9.797
11 HE ARG 1 HE ARG 1 -4.042 -2.890 9.112
12 1HH1 ARG 1 1HH1 ARG 1 -6.043 -1.638 11.683
13 2HH1 ARG 1 2HH1 ARG 1 -6.023 -3.113 12.587
14 1HH2 ARG 1 1HH2 ARG 1 -4.015 -4.833 10.300
15 2HH2 ARG 1 2HH2 ARG 1 -4.871 -4.928 11.802
16 H VAL 2 H VAL 2 -2.139 -2.806 5.865
17 HA VAL 2 HA VAL 2 -1.794 -1.268 3.415
18 HB VAL 2 HB VAL 2 -0.296 -3.170 3.822
19 1HG1 VAL 2 1HG1 VAL 2 -1.211 -4.917 4.881
20 2HG1 VAL 2 2HG1 VAL 2 -1.703 -5.443 3.271
21 3HG1 VAL 2 3HG1 VAL 2 -2.832 -4.549 4.291
22 1HG2 VAL 2 1HG2 VAL 2 -1.960 -2.837 1.461
23 2HG2 VAL 2 2HG2 VAL 2 -1.287 -4.462 1.596
24 3HG2 VAL 2 3HG2 VAL 2 -0.216 -3.060 1.594
25 H ILE 3 H ILE 3 -4.269 -0.796 4.284
26 HA ILE 3 HA ILE 3 -6.018 -2.569 2.710
27 HB ILE 3 HB ILE 3 -6.605 -2.425 5.097
28 1HG1 ILE 3 2HG1 ILE 3 -8.991 -1.815 4.787
29 2HG1 ILE 3 1HG1 ILE 3 -8.584 -1.094 3.233
30 1HG2 ILE 3 1HG2 ILE 3 -5.868 0.185 4.940
31 2HG2 ILE 3 2HG2 ILE 3 -6.810 -0.517 6.256
32 3HG2 ILE 3 3HG2 ILE 3 -7.627 0.317 4.933
33 1HD1 ILE 3 1HD1 ILE 3 -9.222 -3.792 3.841
34 2HD1 ILE 3 2HD1 ILE 3 -7.570 -3.726 3.225
35 3HD1 ILE 3 3HD1 ILE 3 -8.895 -3.056 2.273
36 H ALA 4 H ALA 4 -4.917 0.704 3.156
37 HA ALA 4 HA ALA 4 -6.870 2.119 1.763
38 1HB ALA 4 1HB ALA 4 -4.024 2.568 2.439
39 2HB ALA 4 2HB ALA 4 -5.441 3.567 2.763
40 3HB ALA 4 3HB ALA 4 -4.710 3.567 1.158
41 H CYS 5 H CYS 5 -4.255 0.117 0.598
42 HA CYS 5 HA CYS 5 -4.130 1.010 -2.054
43 1HB CYS 5 2HB CYS 5 -2.626 -0.682 -0.755
44 2HB CYS 5 1HB CYS 5 -3.767 -1.885 -1.348
45 H PHE 6 H PHE 6 -4.971 0.020 -3.988
46 HA PHE 6 HA PHE 6 -7.549 -1.346 -3.581
47 1HB PHE 6 2HB PHE 6 -8.468 -0.095 -5.473
48 2HB PHE 6 1HB PHE 6 -7.914 1.002 -4.213
49 HD1 PHE 6 1HD PHE 6 -7.823 0.265 -7.655
50 HD2 PHE 6 2HD PHE 6 -5.497 1.926 -4.502
51 HE1 PHE 6 1HE PHE 6 -6.439 1.453 -9.306
52 HE2 PHE 6 2HE PHE 6 -4.109 3.117 -6.147
53 HZ PHE 6 HZ PHE 6 -4.579 2.882 -8.553
54 H LEU 7 H LEU 7 -4.911 -2.467 -4.137
55 HA LEU 7 HA LEU 7 -5.370 -3.559 -6.833
56 1HB LEU 7 2HB LEU 7 -2.904 -2.946 -5.285
57 2HB LEU 7 1HB LEU 7 -2.866 -4.328 -6.363
58 HG LEU 7 HG LEU 7 -3.624 -1.544 -7.242
59 1HD1 LEU 7 1HD1 LEU 7 -1.331 -1.513 -6.488
60 2HD1 LEU 7 2HD1 LEU 7 -1.375 -1.465 -8.251
61 3HD1 LEU 7 3HD1 LEU 7 -0.973 -2.967 -7.420
62 1HD2 LEU 7 1HD2 LEU 7 -2.821 -2.750 -9.460
63 2HD2 LEU 7 2HD2 LEU 7 -4.483 -2.871 -8.883
64 3HD2 LEU 7 3HD2 LEU 7 -3.345 -4.182 -8.574
65 H LYS 8 H LYS 8 -4.621 -5.850 -7.105
66 HA LYS 8 HA LYS 8 -5.654 -7.436 -4.880
67 1HB LYS 8 2HB LYS 8 -6.253 -7.593 -7.482
68 2HB LYS 8 1HB LYS 8 -4.890 -8.705 -7.459
69 1HG LYS 8 2HG LYS 8 -5.965 -10.144 -5.927
70 2HG LYS 8 1HG LYS 8 -7.215 -8.949 -5.574
71 1HD LYS 8 2HD LYS 8 -6.794 -10.318 -8.230
72 2HD LYS 8 1HD LYS 8 -8.039 -10.732 -7.050
73 1HE LYS 8 2HE LYS 8 -8.807 -8.316 -7.249
74 2HE LYS 8 1HE LYS 8 -7.761 -8.211 -8.665
75 1HZ LYS 8 1HZ LYS 8 -9.134 -9.496 -9.887
76 2HZ LYS 8 2HZ LYS 8 -10.300 -8.927 -8.802
77 3HZ LYS 8 3HZ LYS 8 -9.612 -10.456 -8.578
78 H VAL 9 H VAL 9 -2.729 -6.871 -6.697
79 HA VAL 9 HA VAL 9 -1.354 -9.078 -5.370
80 HB VAL 9 HB VAL 9 -0.934 -8.732 -7.765
81 1HG1 VAL 9 1HG1 VAL 9 0.025 -6.035 -6.848
82 2HG1 VAL 9 2HG1 VAL 9 -1.187 -6.412 -8.074
83 3HG1 VAL 9 3HG1 VAL 9 0.517 -6.743 -8.387
84 1HG2 VAL 9 1HG2 VAL 9 1.678 -7.976 -6.623
85 2HG2 VAL 9 2HG2 VAL 9 1.227 -9.370 -7.607
86 3HG2 VAL 9 3HG2 VAL 9 0.882 -9.362 -5.877
87 H CYS 10 H CYS 10 -1.584 -5.599 -5.292
88 HA CYS 10 HA CYS 10 0.718 -5.332 -3.541
89 1HB CYS 10 2HB CYS 10 0.001 -3.655 -5.364
90 2HB CYS 10 1HB CYS 10 -1.230 -3.140 -4.217
91 H ALA 11 H ALA 11 -2.747 -4.498 -3.351
92 HA ALA 11 HA ALA 11 -2.781 -3.903 -0.618
93 1HB ALA 11 1HB ALA 11 -5.056 -3.709 -0.820
94 2HB ALA 11 2HB ALA 11 -5.189 -5.096 -1.901
95 3HB ALA 11 3HB ALA 11 -4.570 -3.561 -2.509
96 H ALA 12 H ALA 12 -3.746 -6.915 -2.265
97 HA ALA 12 HA ALA 12 -3.935 -8.313 0.265
98 1HB ALA 12 1HB ALA 12 -5.577 -9.143 -1.056
99 2HB ALA 12 2HB ALA 12 -4.299 -10.271 -1.508
100 3HB ALA 12 3HB ALA 12 -4.664 -8.890 -2.543
101 H ALA 13 H ALA 13 -1.303 -7.336 -0.400
102 HA ALA 13 HA ALA 13 0.186 -9.737 -1.129
103 1HB ALA 13 1HB ALA 13 1.675 -7.300 -0.425
104 2HB ALA 13 2HB ALA 13 0.593 -7.158 -1.811
105 3HB ALA 13 3HB ALA 13 1.857 -8.389 -1.802
106 H ALA 14 H ALA 14 -1.094 -8.526 1.641
107 HA ALA 14 HA ALA 14 -0.718 -8.843 3.861
108 1HB ALA 14 1HB ALA 14 0.817 -11.107 2.641
109 2HB ALA 14 2HB ALA 14 -0.703 -11.143 3.536
110 3HB ALA 14 3HB ALA 14 0.815 -10.854 4.386
111 H ASN 15 H ASN 15 0.965 -6.954 2.411
112 HA ASN 15 HA ASN 15 3.151 -6.804 4.359
113 1HB ASN 15 2HB ASN 15 3.693 -7.617 1.839
114 2HB ASN 15 1HB ASN 15 3.806 -5.873 1.624
115 1HD2 ASN 15 1HD2 ASN 15 5.857 -7.985 1.554
116 2HD2 ASN 15 2HD2 ASN 15 7.053 -7.505 2.705
117 H VAL 16 H VAL 16 3.253 -4.877 5.308
118 HA VAL 16 HA VAL 16 1.594 -2.715 4.281
119 HB VAL 16 HB VAL 16 3.177 -2.769 6.850
120 1HG1 VAL 16 1HG1 VAL 16 0.802 -1.109 6.012
121 2HG1 VAL 16 2HG1 VAL 16 2.473 -0.550 6.073
122 3HG1 VAL 16 3HG1 VAL 16 1.646 -1.021 7.558
123 1HG2 VAL 16 1HG2 VAL 16 0.612 -4.032 6.118
124 2HG2 VAL 16 2HG2 VAL 16 0.637 -3.153 7.647
125 3HG2 VAL 16 3HG2 VAL 16 1.778 -4.468 7.368
126 H ALA 17 H ALA 17 4.959 -3.177 5.357
127 HA ALA 17 HA ALA 17 5.855 -0.613 4.597
128 1HB ALA 17 1HB ALA 17 7.096 -1.956 6.181
129 2HB ALA 17 2HB ALA 17 8.119 -1.572 4.797
130 3HB ALA 17 3HB ALA 17 7.404 -3.177 4.947
131 H ALA 18 H ALA 18 5.960 -3.746 2.929
132 HA ALA 18 HA ALA 18 7.389 -2.941 0.669
133 1HB ALA 18 1HB ALA 18 6.764 -4.958 -0.302
134 2HB ALA 18 2HB ALA 18 5.197 -4.976 0.506
135 3HB ALA 18 3HB ALA 18 6.667 -5.301 1.426
136 H HIS 19 H HIS 19 3.998 -2.608 1.484
137 HA HIS 19 HA HIS 19 3.176 -1.798 -1.136
138 1HB HIS 19 2HB HIS 19 1.368 -2.639 0.011
139 2HB HIS 19 1HB HIS 19 1.906 -1.987 1.553
140 HD2 HIS 19 2HD HIS 19 0.680 0.291 2.327
141 HE1 HIS 19 1HE HIS 19 -1.149 1.170 -1.377
142 HE2 HIS 19 2HE HIS 19 -1.109 1.712 1.104
143 H MET 20 H MET 20 3.342 0.007 1.942
144 HA MET 20 HA MET 20 2.893 2.539 1.035
145 1HB MET 20 2HB MET 20 4.517 1.434 3.275
146 2HB MET 20 1HB MET 20 4.680 3.146 2.907
147 1HG MET 20 2HG MET 20 1.922 2.151 3.097
148 2HG MET 20 1HG MET 20 2.851 2.122 4.594
149 1HE MET 20 1HE MET 20 0.912 3.508 5.427
150 2HE MET 20 2HE MET 20 0.102 4.195 4.019
151 3HE MET 20 3HE MET 20 0.787 5.259 5.248
152 H THR 21 H THR 21 6.030 0.863 1.053
153 HA THR 21 HA THR 21 7.614 2.970 0.152
154 HB THR 21 HB THR 21 8.506 0.831 0.997
155 HG1 THR 21 1HG THR 21 9.767 2.220 -0.396
156 1HG2 THR 21 1HG2 THR 21 7.132 -0.252 -1.361
157 2HG2 THR 21 2HG2 THR 21 7.531 -1.013 0.178
158 3HG2 THR 21 3HG2 THR 21 8.763 -0.860 -1.075
159 H HIS 22 H HIS 22 5.338 1.002 -1.555
160 HA HIS 22 HA HIS 22 6.153 2.235 -4.081
161 1HB HIS 22 2HB HIS 22 6.240 0.140 -4.880
162 2HB HIS 22 1HB HIS 22 5.581 -0.504 -3.386
163 HD1 HIS 22 1HD HIS 22 4.924 -0.552 -6.826
164 HD2 HIS 22 2HD HIS 22 2.506 -0.017 -3.476
165 HE1 HIS 22 1HE HIS 22 2.589 -1.087 -7.587
166 HE2 HIS 22 2HE HIS 22 1.139 -0.693 -5.566
167 H CYS 23 H CYS 23 4.002 2.640 -1.724
168 HA CYS 23 HA CYS 23 1.987 3.726 -3.534
169 1HB CYS 23 2HB CYS 23 1.682 1.519 -1.598
170 2HB CYS 23 1HB CYS 23 0.424 2.737 -1.548
171 H ALA 24 H ALA 24 2.984 5.743 -2.876
172 HA ALA 24 HA ALA 24 3.058 6.562 -0.151
173 1HB ALA 24 1HB ALA 24 4.216 7.489 -2.397
174 2HB ALA 24 2HB ALA 24 4.061 8.433 -0.915
175 3HB ALA 24 3HB ALA 24 2.900 8.651 -2.225
176 H LYS 25 H LYS 25 1.822 8.385 0.737
177 HA LYS 25 HA LYS 25 -1.004 8.138 0.010
178 1HB LYS 25 2HB LYS 25 -0.205 7.743 2.380
179 2HB LYS 25 1HB LYS 25 0.149 9.463 2.464
180 1HG LYS 25 2HG LYS 25 -2.576 8.638 1.622
181 2HG LYS 25 1HG LYS 25 -2.135 8.468 3.322
182 1HD LYS 25 2HD LYS 25 -1.223 10.961 2.834
183 2HD LYS 25 1HD LYS 25 -2.581 10.896 1.708
184 1HE LYS 25 2HE LYS 25 -3.719 9.839 3.919
185 2HE LYS 25 1HE LYS 25 -2.556 10.941 4.654
186 1HZ LYS 25 1HZ LYS 25 -4.637 11.661 2.661
187 2HZ LYS 25 2HZ LYS 25 -3.486 12.731 3.288
188 3HZ LYS 25 3HZ LYS 25 -4.650 12.049 4.308
Start of MODEL 4
1 1H ARG 1 1HT ARG 1 -0.344 -0.249 7.466
2 2H ARG 1 2HT ARG 1 -1.183 -0.076 8.954
3 3H ARG 1 3HT ARG 1 -1.441 1.050 7.684
4 HA ARG 1 HA ARG 1 -2.177 -1.797 7.738
5 1HB ARG 1 2HB ARG 1 -3.499 0.054 8.980
6 2HB ARG 1 1HB ARG 1 -3.962 0.597 7.374
7 1HG ARG 1 2HG ARG 1 -5.700 -0.784 7.687
8 2HG ARG 1 1HG ARG 1 -4.552 -2.026 7.180
9 1HD ARG 1 2HD ARG 1 -3.978 -1.950 9.792
10 2HD ARG 1 1HD ARG 1 -5.662 -1.435 9.862
11 HE ARG 1 HE ARG 1 -5.237 -3.785 8.262
12 1HH1 ARG 1 1HH1 ARG 1 -5.807 -2.586 11.489
13 2HH1 ARG 1 2HH1 ARG 1 -6.486 -4.074 12.057
14 1HH2 ARG 1 1HH2 ARG 1 -6.131 -5.743 9.007
15 2HH2 ARG 1 2HH2 ARG 1 -6.670 -5.867 10.648
16 H VAL 2 H VAL 2 -2.075 -2.748 5.819
17 HA VAL 2 HA VAL 2 -1.861 -1.130 3.406
18 HB VAL 2 HB VAL 2 -0.274 -2.975 3.722
19 1HG1 VAL 2 1HG1 VAL 2 -2.736 -4.476 4.212
20 2HG1 VAL 2 2HG1 VAL 2 -1.086 -4.789 4.752
21 3HG1 VAL 2 3HG1 VAL 2 -1.597 -5.291 3.140
22 1HG2 VAL 2 1HG2 VAL 2 -2.010 -2.649 1.411
23 2HG2 VAL 2 2HG2 VAL 2 -1.266 -4.247 1.484
24 3HG2 VAL 2 3HG2 VAL 2 -0.255 -2.802 1.496
25 H ILE 3 H ILE 3 -4.331 -0.784 4.338
26 HA ILE 3 HA ILE 3 -6.046 -2.599 2.777
27 HB ILE 3 HB ILE 3 -6.595 -2.506 5.169
28 1HG1 ILE 3 2HG1 ILE 3 -8.987 -2.028 4.932
29 2HG1 ILE 3 1HG1 ILE 3 -8.675 -1.143 3.442
30 1HG2 ILE 3 1HG2 ILE 3 -7.001 0.432 4.647
31 2HG2 ILE 3 2HG2 ILE 3 -5.842 -0.311 5.748
32 3HG2 ILE 3 3HG2 ILE 3 -7.569 -0.406 6.091
33 1HD1 ILE 3 1HD1 ILE 3 -9.363 -3.789 3.643
34 2HD1 ILE 3 2HD1 ILE 3 -7.620 -3.847 3.384
35 3HD1 ILE 3 3HD1 ILE 3 -8.654 -3.005 2.231
36 H ALA 4 H ALA 4 -5.080 0.716 3.258
37 HA ALA 4 HA ALA 4 -7.110 2.046 1.882
38 1HB ALA 4 1HB ALA 4 -4.308 2.644 2.608
39 2HB ALA 4 2HB ALA 4 -5.782 3.567 2.905
40 3HB ALA 4 3HB ALA 4 -5.015 3.616 1.317
41 H CYS 5 H CYS 5 -4.362 0.234 0.706
42 HA CYS 5 HA CYS 5 -4.287 1.175 -1.932
43 1HB CYS 5 2HB CYS 5 -2.648 -0.392 -0.682
44 2HB CYS 5 1HB CYS 5 -3.710 -1.688 -1.217
45 H PHE 6 H PHE 6 -4.941 -0.039 -3.885
46 HA PHE 6 HA PHE 6 -7.460 -1.513 -3.508
47 1HB PHE 6 2HB PHE 6 -8.344 -0.355 -5.537
48 2HB PHE 6 1HB PHE 6 -8.090 0.719 -4.167
49 HD1 PHE 6 1HD PHE 6 -5.770 1.931 -4.115
50 HD2 PHE 6 2HD PHE 6 -7.541 0.257 -7.603
51 HE1 PHE 6 1HE PHE 6 -4.379 3.396 -5.520
52 HE2 PHE 6 2HE PHE 6 -6.152 1.717 -9.014
53 HZ PHE 6 HZ PHE 6 -4.568 3.289 -7.974
54 H LEU 7 H LEU 7 -4.805 -2.531 -3.961
55 HA LEU 7 HA LEU 7 -5.222 -3.784 -6.594
56 1HB LEU 7 2HB LEU 7 -2.716 -2.727 -5.341
57 2HB LEU 7 1HB LEU 7 -2.626 -4.064 -6.472
58 HG LEU 7 HG LEU 7 -4.075 -1.573 -7.268
59 1HD1 LEU 7 1HD1 LEU 7 -1.186 -1.796 -7.897
60 2HD1 LEU 7 2HD1 LEU 7 -1.638 -1.222 -6.293
61 3HD1 LEU 7 3HD1 LEU 7 -2.203 -0.365 -7.729
62 1HD2 LEU 7 1HD2 LEU 7 -3.702 -2.302 -9.431
63 2HD2 LEU 7 2HD2 LEU 7 -3.948 -3.816 -8.561
64 3HD2 LEU 7 3HD2 LEU 7 -2.315 -3.288 -8.970
65 H LYS 8 H LYS 8 -4.687 -5.979 -6.775
66 HA LYS 8 HA LYS 8 -5.078 -7.498 -4.389
67 1HB LYS 8 2HB LYS 8 -4.630 -8.171 -7.276
68 2HB LYS 8 1HB LYS 8 -4.543 -9.436 -6.057
69 1HG LYS 8 2HG LYS 8 -6.771 -9.404 -5.660
70 2HG LYS 8 1HG LYS 8 -6.916 -7.675 -5.984
71 1HD LYS 8 2HD LYS 8 -6.250 -9.514 -8.234
72 2HD LYS 8 1HD LYS 8 -7.913 -9.451 -7.647
73 1HE LYS 8 2HE LYS 8 -7.686 -6.906 -7.881
74 2HE LYS 8 1HE LYS 8 -6.259 -7.257 -8.854
75 1HZ LYS 8 1HZ LYS 8 -7.497 -8.093 -10.539
76 2HZ LYS 8 2HZ LYS 8 -8.651 -7.029 -9.909
77 3HZ LYS 8 3HZ LYS 8 -8.720 -8.676 -9.527
78 H VAL 9 H VAL 9 -2.412 -7.502 -6.762
79 HA VAL 9 HA VAL 9 -0.642 -9.036 -5.238
80 HB VAL 9 HB VAL 9 -0.314 -8.625 -7.630
81 1HG1 VAL 9 1HG1 VAL 9 -0.235 -5.831 -6.729
82 2HG1 VAL 9 2HG1 VAL 9 -0.714 -6.512 -8.283
83 3HG1 VAL 9 3HG1 VAL 9 0.993 -6.265 -7.918
84 1HG2 VAL 9 1HG2 VAL 9 2.014 -7.634 -5.986
85 2HG2 VAL 9 2HG2 VAL 9 2.096 -8.342 -7.599
86 3HG2 VAL 9 3HG2 VAL 9 1.583 -9.327 -6.228
87 H CYS 10 H CYS 10 -1.511 -5.695 -4.992
88 HA CYS 10 HA CYS 10 0.790 -5.092 -3.298
89 1HB CYS 10 2HB CYS 10 -0.346 -3.549 -5.139
90 2HB CYS 10 1HB CYS 10 -1.379 -3.104 -3.784
91 H ALA 11 H ALA 11 -2.704 -4.410 -3.053
92 HA ALA 11 HA ALA 11 -2.641 -4.201 -0.225
93 1HB ALA 11 1HB ALA 11 -5.217 -4.817 -1.533
94 2HB ALA 11 2HB ALA 11 -4.376 -3.370 -2.090
95 3HB ALA 11 3HB ALA 11 -4.799 -3.543 -0.386
96 H ALA 12 H ALA 12 -3.722 -6.762 -2.431
97 HA ALA 12 HA ALA 12 -4.355 -8.531 -0.226
98 1HB ALA 12 1HB ALA 12 -4.275 -9.528 -3.019
99 2HB ALA 12 2HB ALA 12 -5.482 -8.309 -2.611
100 3HB ALA 12 3HB ALA 12 -5.444 -9.839 -1.735
101 H ALA 13 H ALA 13 -1.592 -7.713 -0.383
102 HA ALA 13 HA ALA 13 -0.308 -10.279 -1.046
103 1HB ALA 13 1HB ALA 13 0.480 -7.510 -1.547
104 2HB ALA 13 2HB ALA 13 0.973 -8.996 -2.356
105 3HB ALA 13 3HB ALA 13 1.760 -8.506 -0.856
106 H ALA 14 H ALA 14 -1.428 -8.592 1.525
107 HA ALA 14 HA ALA 14 -1.050 -8.641 3.767
108 1HB ALA 14 1HB ALA 14 0.869 -10.880 3.614
109 2HB ALA 14 2HB ALA 14 -0.733 -11.171 2.937
110 3HB ALA 14 3HB ALA 14 -0.564 -10.678 4.622
111 H ASN 15 H ASN 15 0.694 -7.041 2.083
112 HA ASN 15 HA ASN 15 3.066 -6.948 3.829
113 1HB ASN 15 2HB ASN 15 3.122 -7.465 1.138
114 2HB ASN 15 1HB ASN 15 3.358 -5.720 1.171
115 1HD2 ASN 15 1HD2 ASN 15 4.815 -5.332 3.407
116 2HD2 ASN 15 2HD2 ASN 15 6.345 -6.125 3.275
117 H VAL 16 H VAL 16 3.420 -5.085 4.864
118 HA VAL 16 HA VAL 16 1.638 -2.835 4.284
119 HB VAL 16 HB VAL 16 3.462 -3.171 6.665
120 1HG1 VAL 16 1HG1 VAL 16 0.969 -1.563 6.712
121 2HG1 VAL 16 2HG1 VAL 16 2.358 -0.902 5.850
122 3HG1 VAL 16 3HG1 VAL 16 2.495 -1.313 7.559
123 1HG2 VAL 16 1HG2 VAL 16 0.751 -4.249 6.105
124 2HG2 VAL 16 2HG2 VAL 16 1.084 -3.648 7.730
125 3HG2 VAL 16 3HG2 VAL 16 2.072 -4.940 7.048
126 H ALA 17 H ALA 17 5.036 -3.196 5.322
127 HA ALA 17 HA ALA 17 5.856 -0.645 4.522
128 1HB ALA 17 1HB ALA 17 7.478 -3.170 4.813
129 2HB ALA 17 2HB ALA 17 7.168 -1.964 6.061
130 3HB ALA 17 3HB ALA 17 8.151 -1.548 4.657
131 H ALA 18 H ALA 18 5.921 -3.734 2.791
132 HA ALA 18 HA ALA 18 7.330 -2.903 0.526
133 1HB ALA 18 1HB ALA 18 6.559 -4.868 -0.530
134 2HB ALA 18 2HB ALA 18 5.112 -4.932 0.476
135 3HB ALA 18 3HB ALA 18 6.693 -5.264 1.184
136 H HIS 19 H HIS 19 3.979 -2.487 1.427
137 HA HIS 19 HA HIS 19 3.097 -1.659 -1.167
138 1HB HIS 19 2HB HIS 19 1.310 -2.451 0.054
139 2HB HIS 19 1HB HIS 19 1.908 -1.781 1.567
140 HD2 HIS 19 2HD HIS 19 0.733 0.520 2.337
141 HE1 HIS 19 1HE HIS 19 -1.132 1.407 -1.348
142 HE2 HIS 19 2HE HIS 19 -0.760 2.187 1.035
143 H MET 20 H MET 20 3.374 0.160 1.895
144 HA MET 20 HA MET 20 2.990 2.697 0.978
145 1HB MET 20 2HB MET 20 4.852 1.694 3.124
146 2HB MET 20 1HB MET 20 4.588 3.407 2.834
147 1HG MET 20 2HG MET 20 2.434 3.354 3.610
148 2HG MET 20 1HG MET 20 2.233 1.640 3.250
149 1HE MET 20 1HE MET 20 3.533 4.285 5.902
150 2HE MET 20 2HE MET 20 4.982 3.644 5.126
151 3HE MET 20 3HE MET 20 4.652 3.275 6.818
152 H THR 21 H THR 21 6.070 0.923 0.945
153 HA THR 21 HA THR 21 7.705 2.977 0.009
154 HB THR 21 HB THR 21 8.545 0.815 0.845
155 HG1 THR 21 1HG THR 21 9.380 1.349 -1.810
156 1HG2 THR 21 1HG2 THR 21 7.155 -0.231 -1.542
157 2HG2 THR 21 2HG2 THR 21 7.418 -0.966 0.040
158 3HG2 THR 21 3HG2 THR 21 8.725 -0.930 -1.144
159 H HIS 22 H HIS 22 5.340 1.073 -1.650
160 HA HIS 22 HA HIS 22 6.141 2.278 -4.193
161 1HB HIS 22 2HB HIS 22 6.161 0.183 -4.995
162 2HB HIS 22 1HB HIS 22 5.524 -0.444 -3.483
163 HD1 HIS 22 1HD HIS 22 4.786 -0.499 -6.903
164 HD2 HIS 22 2HD HIS 22 2.456 0.118 -3.503
165 HE1 HIS 22 1HE HIS 22 2.422 -0.984 -7.607
166 HE2 HIS 22 2HE HIS 22 1.027 -0.540 -5.558
167 H CYS 23 H CYS 23 4.048 2.750 -1.801
168 HA CYS 23 HA CYS 23 2.023 3.871 -3.578
169 1HB CYS 23 2HB CYS 23 1.705 1.686 -1.619
170 2HB CYS 23 1HB CYS 23 0.477 2.933 -1.556
171 H ALA 24 H ALA 24 4.152 5.085 -2.041
172 HA ALA 24 HA ALA 24 3.338 6.112 0.425
173 1HB ALA 24 1HB ALA 24 5.245 7.093 -1.667
174 2HB ALA 24 2HB ALA 24 5.592 6.405 -0.080
175 3HB ALA 24 3HB ALA 24 4.928 8.034 -0.210
176 H LYS 25 H LYS 25 2.978 8.551 0.769
177 HA LYS 25 HA LYS 25 0.993 9.533 -1.175
178 1HB LYS 25 2HB LYS 25 -0.107 8.650 0.849
179 2HB LYS 25 1HB LYS 25 0.841 9.753 1.837
180 1HG LYS 25 2HG LYS 25 -0.274 11.512 0.145
181 2HG LYS 25 1HG LYS 25 -1.524 10.266 0.157
182 1HD LYS 25 2HD LYS 25 -0.350 11.610 2.592
183 2HD LYS 25 1HD LYS 25 -1.923 11.970 1.876
184 1HE LYS 25 2HE LYS 25 -1.232 9.186 2.737
185 2HE LYS 25 1HE LYS 25 -1.799 10.374 3.909
186 1HZ LYS 25 1HZ LYS 25 -3.831 10.612 2.738
187 2HZ LYS 25 2HZ LYS 25 -3.566 8.951 2.917
188 3HZ LYS 25 3HZ LYS 25 -3.275 9.697 1.428
Start of MODEL 5
1 1H ARG 1 1HT ARG 1 -1.392 0.567 7.940
2 2H ARG 1 2HT ARG 1 -0.356 -0.712 7.452
3 3H ARG 1 3HT ARG 1 -1.052 -0.720 9.020
4 HA ARG 1 HA ARG 1 -2.229 -2.243 7.741
5 1HB ARG 1 2HB ARG 1 -3.486 -0.736 9.255
6 2HB ARG 1 1HB ARG 1 -3.755 0.365 7.911
7 1HG ARG 1 2HG ARG 1 -5.700 -0.740 7.744
8 2HG ARG 1 1HG ARG 1 -4.725 -1.910 6.852
9 1HD ARG 1 2HD ARG 1 -6.037 -3.088 8.479
10 2HD ARG 1 1HD ARG 1 -4.347 -3.133 8.978
11 HE ARG 1 HE ARG 1 -5.556 -0.938 10.208
12 1HH1 ARG 1 1HH1 ARG 1 -5.733 -4.423 10.278
13 2HH1 ARG 1 2HH1 ARG 1 -6.239 -4.489 11.932
14 1HH2 ARG 1 1HH2 ARG 1 -6.222 -1.022 12.385
15 2HH2 ARG 1 2HH2 ARG 1 -6.518 -2.559 13.129
16 H VAL 2 H VAL 2 -1.855 -2.928 5.720
17 HA VAL 2 HA VAL 2 -1.909 -1.119 3.471
18 HB VAL 2 HB VAL 2 -0.271 -2.950 3.551
19 1HG1 VAL 2 1HG1 VAL 2 -0.775 -5.140 3.782
20 2HG1 VAL 2 2HG1 VAL 2 -2.268 -5.007 2.853
21 3HG1 VAL 2 3HG1 VAL 2 -2.230 -4.497 4.541
22 1HG2 VAL 2 1HG2 VAL 2 -2.184 -2.590 1.336
23 2HG2 VAL 2 2HG2 VAL 2 -1.147 -4.013 1.238
24 3HG2 VAL 2 3HG2 VAL 2 -0.431 -2.407 1.366
25 H ILE 3 H ILE 3 -4.303 -0.751 4.316
26 HA ILE 3 HA ILE 3 -6.080 -2.571 2.831
27 HB ILE 3 HB ILE 3 -6.577 -2.433 5.233
28 1HG1 ILE 3 2HG1 ILE 3 -8.985 -1.800 5.019
29 2HG1 ILE 3 1HG1 ILE 3 -8.632 -1.146 3.423
30 1HG2 ILE 3 1HG2 ILE 3 -7.447 -0.342 6.190
31 2HG2 ILE 3 2HG2 ILE 3 -7.044 0.496 4.691
32 3HG2 ILE 3 3HG2 ILE 3 -5.763 -0.197 5.686
33 1HD1 ILE 3 1HD1 ILE 3 -9.085 -3.150 2.605
34 2HD1 ILE 3 2HD1 ILE 3 -9.163 -3.854 4.221
35 3HD1 ILE 3 3HD1 ILE 3 -7.616 -3.736 3.384
36 H ALA 4 H ALA 4 -5.077 0.744 3.268
37 HA ALA 4 HA ALA 4 -7.114 2.060 1.879
38 1HB ALA 4 1HB ALA 4 -5.721 3.490 3.031
39 2HB ALA 4 2HB ALA 4 -5.178 3.729 1.371
40 3HB ALA 4 3HB ALA 4 -4.254 2.693 2.460
41 H CYS 5 H CYS 5 -4.361 0.240 0.738
42 HA CYS 5 HA CYS 5 -4.237 1.173 -1.898
43 1HB CYS 5 2HB CYS 5 -2.629 -0.405 -0.650
44 2HB CYS 5 1HB CYS 5 -3.719 -1.695 -1.143
45 H PHE 6 H PHE 6 -4.930 0.071 -3.865
46 HA PHE 6 HA PHE 6 -7.460 -1.399 -3.531
47 1HB PHE 6 2HB PHE 6 -8.379 -0.193 -5.462
48 2HB PHE 6 1HB PHE 6 -7.952 0.917 -4.165
49 HD1 PHE 6 1HD PHE 6 -7.698 0.278 -7.607
50 HD2 PHE 6 2HD PHE 6 -5.556 1.960 -4.337
51 HE1 PHE 6 1HE PHE 6 -6.323 1.577 -9.181
52 HE2 PHE 6 2HE PHE 6 -4.177 3.262 -5.905
53 HZ PHE 6 HZ PHE 6 -4.561 3.072 -8.330
54 H LEU 7 H LEU 7 -4.777 -2.404 -3.999
55 HA LEU 7 HA LEU 7 -5.187 -3.613 -6.655
56 1HB LEU 7 2HB LEU 7 -2.706 -2.613 -5.327
57 2HB LEU 7 1HB LEU 7 -2.589 -3.974 -6.425
58 HG LEU 7 HG LEU 7 -3.834 -1.348 -7.217
59 1HD1 LEU 7 1HD1 LEU 7 -1.028 -2.216 -7.850
60 2HD1 LEU 7 2HD1 LEU 7 -1.417 -1.162 -6.491
61 3HD1 LEU 7 3HD1 LEU 7 -1.781 -0.648 -8.138
62 1HD2 LEU 7 1HD2 LEU 7 -2.917 -2.419 -9.476
63 2HD2 LEU 7 2HD2 LEU 7 -4.520 -2.782 -8.837
64 3HD2 LEU 7 3HD2 LEU 7 -3.187 -3.905 -8.565
65 H LYS 8 H LYS 8 -4.704 -5.816 -6.883
66 HA LYS 8 HA LYS 8 -5.204 -7.384 -4.548
67 1HB LYS 8 2HB LYS 8 -4.415 -8.253 -7.334
68 2HB LYS 8 1HB LYS 8 -5.026 -9.310 -6.068
69 1HG LYS 8 2HG LYS 8 -7.167 -8.613 -6.323
70 2HG LYS 8 1HG LYS 8 -6.696 -6.980 -6.797
71 1HD LYS 8 2HD LYS 8 -5.921 -9.104 -8.680
72 2HD LYS 8 1HD LYS 8 -7.660 -8.854 -8.505
73 1HE LYS 8 2HE LYS 8 -5.935 -6.458 -8.833
74 2HE LYS 8 1HE LYS 8 -6.202 -7.478 -10.246
75 1HZ LYS 8 1HZ LYS 8 -8.563 -6.773 -8.700
76 2HZ LYS 8 2HZ LYS 8 -8.359 -6.890 -10.375
77 3HZ LYS 8 3HZ LYS 8 -7.829 -5.510 -9.554
78 H VAL 9 H VAL 9 -2.496 -7.515 -6.870
79 HA VAL 9 HA VAL 9 -0.814 -9.096 -5.315
80 HB VAL 9 HB VAL 9 -0.427 -8.664 -7.701
81 1HG1 VAL 9 1HG1 VAL 9 0.220 -5.894 -6.731
82 2HG1 VAL 9 2HG1 VAL 9 -0.932 -6.381 -7.972
83 3HG1 VAL 9 3HG1 VAL 9 0.800 -6.514 -8.276
84 1HG2 VAL 9 1HG2 VAL 9 2.008 -7.695 -6.247
85 2HG2 VAL 9 2HG2 VAL 9 1.896 -8.798 -7.618
86 3HG2 VAL 9 3HG2 VAL 9 1.403 -9.334 -6.012
87 H CYS 10 H CYS 10 -1.594 -5.746 -5.010
88 HA CYS 10 HA CYS 10 0.717 -5.227 -3.302
89 1HB CYS 10 2HB CYS 10 -0.371 -3.623 -5.112
90 2HB CYS 10 1HB CYS 10 -1.413 -3.189 -3.762
91 H ALA 11 H ALA 11 -2.760 -4.470 -3.040
92 HA ALA 11 HA ALA 11 -2.718 -4.254 -0.228
93 1HB ALA 11 1HB ALA 11 -4.463 -3.480 -2.084
94 2HB ALA 11 2HB ALA 11 -4.910 -3.692 -0.391
95 3HB ALA 11 3HB ALA 11 -5.266 -4.962 -1.563
96 H ALA 12 H ALA 12 -3.581 -6.922 -2.387
97 HA ALA 12 HA ALA 12 -4.298 -8.637 -0.167
98 1HB ALA 12 1HB ALA 12 -5.253 -10.007 -1.688
99 2HB ALA 12 2HB ALA 12 -3.954 -9.794 -2.862
100 3HB ALA 12 3HB ALA 12 -5.195 -8.553 -2.683
101 H ALA 13 H ALA 13 -1.423 -7.595 -0.809
102 HA ALA 13 HA ALA 13 -0.040 -10.153 -1.045
103 1HB ALA 13 1HB ALA 13 0.618 -7.385 -1.630
104 2HB ALA 13 2HB ALA 13 1.303 -8.873 -2.279
105 3HB ALA 13 3HB ALA 13 1.902 -8.219 -0.755
106 H ALA 14 H ALA 14 -1.363 -8.417 1.411
107 HA ALA 14 HA ALA 14 -1.093 -8.353 3.668
108 1HB ALA 14 1HB ALA 14 0.448 -10.383 4.480
109 2HB ALA 14 2HB ALA 14 0.089 -10.933 2.844
110 3HB ALA 14 3HB ALA 14 -1.227 -10.593 3.968
111 H ASN 15 H ASN 15 0.803 -6.883 1.993
112 HA ASN 15 HA ASN 15 3.093 -6.789 3.846
113 1HB ASN 15 2HB ASN 15 2.956 -6.761 0.908
114 2HB ASN 15 1HB ASN 15 3.987 -5.508 1.593
115 1HD2 ASN 15 1HD2 ASN 15 5.604 -6.239 3.183
116 2HD2 ASN 15 2HD2 ASN 15 6.359 -7.772 2.930
117 H VAL 16 H VAL 16 3.234 -5.007 5.026
118 HA VAL 16 HA VAL 16 1.559 -2.718 4.378
119 HB VAL 16 HB VAL 16 3.352 -3.073 6.780
120 1HG1 VAL 16 1HG1 VAL 16 1.677 -1.468 7.776
121 2HG1 VAL 16 2HG1 VAL 16 1.076 -1.214 6.137
122 3HG1 VAL 16 3HG1 VAL 16 2.743 -0.799 6.540
123 1HG2 VAL 16 1HG2 VAL 16 1.836 -4.922 6.776
124 2HG2 VAL 16 2HG2 VAL 16 0.474 -3.873 6.383
125 3HG2 VAL 16 3HG2 VAL 16 1.256 -3.750 7.958
126 H ALA 17 H ALA 17 4.965 -3.171 5.353
127 HA ALA 17 HA ALA 17 5.785 -0.583 4.593
128 1HB ALA 17 1HB ALA 17 7.192 -3.118 5.283
129 2HB ALA 17 2HB ALA 17 7.247 -1.544 6.077
130 3HB ALA 17 3HB ALA 17 8.110 -1.797 4.560
131 H ALA 18 H ALA 18 5.890 -3.697 2.910
132 HA ALA 18 HA ALA 18 7.341 -2.886 0.660
133 1HB ALA 18 1HB ALA 18 6.965 -4.967 -0.103
134 2HB ALA 18 2HB ALA 18 5.225 -4.863 0.166
135 3HB ALA 18 3HB ALA 18 6.304 -5.240 1.509
136 H HIS 19 H HIS 19 3.983 -2.459 1.508
137 HA HIS 19 HA HIS 19 3.121 -1.714 -1.117
138 1HB HIS 19 2HB HIS 19 1.321 -2.458 0.109
139 2HB HIS 19 1HB HIS 19 1.913 -1.757 1.609
140 HD2 HIS 19 2HD HIS 19 0.773 0.588 2.309
141 HE1 HIS 19 1HE HIS 19 -1.108 1.367 -1.392
142 HE2 HIS 19 2HE HIS 19 -0.997 2.012 1.061
143 H MET 20 H MET 20 3.388 0.200 1.885
144 HA MET 20 HA MET 20 3.008 2.707 0.892
145 1HB MET 20 2HB MET 20 3.413 2.028 3.297
146 2HB MET 20 1HB MET 20 5.134 2.091 2.941
147 1HG MET 20 2HG MET 20 4.669 4.491 2.152
148 2HG MET 20 1HG MET 20 3.148 4.326 3.029
149 1HE MET 20 1HE MET 20 3.140 5.596 5.338
150 2HE MET 20 2HE MET 20 4.048 6.535 4.152
151 3HE MET 20 3HE MET 20 4.664 6.357 5.795
152 H THR 21 H THR 21 6.088 0.933 0.913
153 HA THR 21 HA THR 21 7.717 2.960 -0.094
154 HB THR 21 HB THR 21 8.574 0.842 0.824
155 HG1 THR 21 1HG THR 21 9.877 2.089 -0.616
156 1HG2 THR 21 1HG2 THR 21 7.186 -0.314 -1.518
157 2HG2 THR 21 2HG2 THR 21 7.422 -0.967 0.103
158 3HG2 THR 21 3HG2 THR 21 8.745 -1.002 -1.064
159 H HIS 22 H HIS 22 5.370 0.973 -1.682
160 HA HIS 22 HA HIS 22 6.171 2.077 -4.271
161 1HB HIS 22 2HB HIS 22 6.177 -0.052 -4.978
162 2HB HIS 22 1HB HIS 22 5.524 -0.608 -3.445
163 HD1 HIS 22 1HD HIS 22 4.804 -0.783 -6.870
164 HD2 HIS 22 2HD HIS 22 2.465 -0.027 -3.505
165 HE1 HIS 22 1HE HIS 22 2.439 -1.273 -7.567
166 HE2 HIS 22 2HE HIS 22 1.039 -0.748 -5.541
167 H CYS 23 H CYS 23 4.078 2.654 -1.898
168 HA CYS 23 HA CYS 23 2.063 3.724 -3.720
169 1HB CYS 23 2HB CYS 23 1.727 1.614 -1.684
170 2HB CYS 23 1HB CYS 23 0.509 2.873 -1.663
171 H ALA 24 H ALA 24 3.122 5.738 -3.174
172 HA ALA 24 HA ALA 24 3.333 6.686 -0.513
173 1HB ALA 24 1HB ALA 24 3.338 8.102 -3.168
174 2HB ALA 24 2HB ALA 24 4.719 7.688 -2.153
175 3HB ALA 24 3HB ALA 24 3.582 8.931 -1.630
176 H LYS 25 H LYS 25 2.201 8.825 0.104
177 HA LYS 25 HA LYS 25 -0.643 8.727 -0.629
178 1HB LYS 25 2HB LYS 25 -0.363 7.565 1.514
179 2HB LYS 25 1HB LYS 25 0.451 8.974 2.180
180 1HG LYS 25 2HG LYS 25 -2.247 9.411 1.058
181 2HG LYS 25 1HG LYS 25 -2.142 8.474 2.550
182 1HD LYS 25 2HD LYS 25 -0.494 10.492 3.181
183 2HD LYS 25 1HD LYS 25 -1.560 11.331 2.051
184 1HE LYS 25 2HE LYS 25 -2.377 9.825 4.533
185 2HE LYS 25 1HE LYS 25 -2.405 11.574 4.301
186 1HZ LYS 25 1HZ LYS 25 -4.596 10.837 3.977
187 2HZ LYS 25 2HZ LYS 25 -4.120 9.538 3.005
188 3HZ LYS 25 3HZ LYS 25 -3.998 11.119 2.419
Start of MODEL 6
1 1H ARG 1 1HT ARG 1 -1.747 1.209 7.446
2 2H ARG 1 2HT ARG 1 -0.361 0.265 7.087
3 3H ARG 1 3HT ARG 1 -1.073 0.191 8.648
4 HA ARG 1 HA ARG 1 -1.725 -1.723 7.566
5 1HB ARG 1 2HB ARG 1 -3.460 0.101 8.584
6 2HB ARG 1 1HB ARG 1 -4.141 -0.121 6.979
7 1HG ARG 1 2HG ARG 1 -4.170 -2.576 7.409
8 2HG ARG 1 1HG ARG 1 -3.678 -2.234 9.069
9 1HD ARG 1 2HD ARG 1 -5.775 -0.563 8.847
10 2HD ARG 1 1HD ARG 1 -6.280 -1.833 7.734
11 HE ARG 1 HE ARG 1 -6.272 -1.970 10.561
12 1HH1 ARG 1 1HH1 ARG 1 -5.654 -3.903 7.722
13 2HH1 ARG 1 2HH1 ARG 1 -6.043 -5.399 8.503
14 1HH2 ARG 1 1HH2 ARG 1 -6.784 -3.937 11.590
15 2HH2 ARG 1 2HH2 ARG 1 -6.685 -5.419 10.698
16 H VAL 2 H VAL 2 -1.950 -2.860 5.722
17 HA VAL 2 HA VAL 2 -1.769 -1.384 3.209
18 HB VAL 2 HB VAL 2 -0.136 -3.178 3.617
19 1HG1 VAL 2 1HG1 VAL 2 -2.555 -4.688 4.239
20 2HG1 VAL 2 2HG1 VAL 2 -0.885 -4.962 4.735
21 3HG1 VAL 2 3HG1 VAL 2 -1.446 -5.543 3.167
22 1HG2 VAL 2 1HG2 VAL 2 -1.874 -2.970 1.308
23 2HG2 VAL 2 2HG2 VAL 2 -1.173 -4.582 1.459
24 3HG2 VAL 2 3HG2 VAL 2 -0.123 -3.166 1.390
25 H ILE 3 H ILE 3 -4.249 -1.122 4.285
26 HA ILE 3 HA ILE 3 -5.926 -2.991 2.744
27 HB ILE 3 HB ILE 3 -6.387 -3.000 5.157
28 1HG1 ILE 3 2HG1 ILE 3 -8.813 -2.631 5.020
29 2HG1 ILE 3 1HG1 ILE 3 -8.595 -1.716 3.532
30 1HG2 ILE 3 1HG2 ILE 3 -6.890 -0.067 4.723
31 2HG2 ILE 3 2HG2 ILE 3 -5.762 -0.829 5.847
32 3HG2 ILE 3 3HG2 ILE 3 -7.500 -0.949 6.124
33 1HD1 ILE 3 1HD1 ILE 3 -9.179 -4.367 3.681
34 2HD1 ILE 3 2HD1 ILE 3 -7.431 -4.391 3.455
35 3HD1 ILE 3 3HD1 ILE 3 -8.460 -3.560 2.288
36 H ALA 4 H ALA 4 -5.160 0.365 3.338
37 HA ALA 4 HA ALA 4 -7.303 1.590 2.027
38 1HB ALA 4 1HB ALA 4 -4.563 2.384 2.798
39 2HB ALA 4 2HB ALA 4 -6.109 3.165 3.128
40 3HB ALA 4 3HB ALA 4 -5.346 3.352 1.549
41 H CYS 5 H CYS 5 -4.449 0.019 0.785
42 HA CYS 5 HA CYS 5 -4.375 1.097 -1.792
43 1HB CYS 5 2HB CYS 5 -2.683 -0.455 -0.648
44 2HB CYS 5 1HB CYS 5 -3.718 -1.778 -1.175
45 H PHE 6 H PHE 6 -4.989 0.037 -3.822
46 HA PHE 6 HA PHE 6 -7.427 -1.592 -3.593
47 1HB PHE 6 2HB PHE 6 -8.188 -0.233 -5.687
48 2HB PHE 6 1HB PHE 6 -8.402 0.458 -4.082
49 HD1 PHE 6 1HD PHE 6 -5.554 0.272 -6.495
50 HD2 PHE 6 2HD PHE 6 -8.056 2.718 -4.073
51 HE1 PHE 6 1HE PHE 6 -4.273 2.256 -7.182
52 HE2 PHE 6 2HE PHE 6 -6.780 4.706 -4.757
53 HZ PHE 6 HZ PHE 6 -4.885 4.477 -6.313
54 H LEU 7 H LEU 7 -4.717 -2.397 -4.156
55 HA LEU 7 HA LEU 7 -4.998 -3.268 -6.958
56 1HB LEU 7 2HB LEU 7 -2.617 -2.504 -5.330
57 2HB LEU 7 1HB LEU 7 -2.424 -3.714 -6.583
58 HG LEU 7 HG LEU 7 -3.539 -0.956 -7.081
59 1HD1 LEU 7 1HD1 LEU 7 -0.738 -2.017 -7.227
60 2HD1 LEU 7 2HD1 LEU 7 -1.327 -0.548 -6.448
61 3HD1 LEU 7 3HD1 LEU 7 -1.266 -0.649 -8.208
62 1HD2 LEU 7 1HD2 LEU 7 -4.284 -2.350 -8.799
63 2HD2 LEU 7 2HD2 LEU 7 -2.780 -3.271 -8.830
64 3HD2 LEU 7 3HD2 LEU 7 -2.815 -1.620 -9.449
65 H LYS 8 H LYS 8 -4.432 -5.424 -7.471
66 HA LYS 8 HA LYS 8 -5.230 -7.329 -5.524
67 1HB LYS 8 2HB LYS 8 -4.286 -7.418 -8.345
68 2HB LYS 8 1HB LYS 8 -4.186 -8.904 -7.411
69 1HG LYS 8 2HG LYS 8 -6.271 -9.205 -8.193
70 2HG LYS 8 1HG LYS 8 -6.703 -8.172 -6.829
71 1HD LYS 8 2HD LYS 8 -6.421 -6.212 -8.433
72 2HD LYS 8 1HD LYS 8 -6.398 -7.416 -9.724
73 1HE LYS 8 2HE LYS 8 -8.614 -7.111 -7.701
74 2HE LYS 8 1HE LYS 8 -8.639 -6.418 -9.322
75 1HZ LYS 8 1HZ LYS 8 -8.507 -8.634 -10.248
76 2HZ LYS 8 2HZ LYS 8 -9.838 -8.522 -9.210
77 3HZ LYS 8 3HZ LYS 8 -8.432 -9.316 -8.701
78 H VAL 9 H VAL 9 -2.107 -6.883 -7.193
79 HA VAL 9 HA VAL 9 -0.791 -8.518 -5.176
80 HB VAL 9 HB VAL 9 -0.204 -8.867 -7.533
81 1HG1 VAL 9 1HG1 VAL 9 0.176 -5.961 -7.449
82 2HG1 VAL 9 2HG1 VAL 9 -0.230 -7.018 -8.803
83 3HG1 VAL 9 3HG1 VAL 9 1.449 -6.846 -8.291
84 1HG2 VAL 9 1HG2 VAL 9 2.012 -9.254 -7.133
85 2HG2 VAL 9 2HG2 VAL 9 1.460 -8.965 -5.483
86 3HG2 VAL 9 3HG2 VAL 9 2.266 -7.678 -6.382
87 H CYS 10 H CYS 10 -1.713 -6.370 -3.907
88 HA CYS 10 HA CYS 10 0.696 -5.061 -3.031
89 1HB CYS 10 2HB CYS 10 -0.439 -3.752 -5.049
90 2HB CYS 10 1HB CYS 10 -1.467 -3.141 -3.758
91 H ALA 11 H ALA 11 -2.852 -4.689 -2.901
92 HA ALA 11 HA ALA 11 -2.819 -3.987 -0.126
93 1HB ALA 11 1HB ALA 11 -4.574 -3.504 -2.075
94 2HB ALA 11 2HB ALA 11 -5.025 -3.516 -0.370
95 3HB ALA 11 3HB ALA 11 -5.332 -4.933 -1.373
96 H ALA 12 H ALA 12 -3.988 -6.841 -1.913
97 HA ALA 12 HA ALA 12 -4.322 -8.331 0.549
98 1HB ALA 12 1HB ALA 12 -5.594 -9.778 -0.640
99 2HB ALA 12 2HB ALA 12 -4.553 -9.700 -2.062
100 3HB ALA 12 3HB ALA 12 -5.699 -8.400 -1.736
101 H ALA 13 H ALA 13 -1.615 -7.524 -0.040
102 HA ALA 13 HA ALA 13 -0.334 -10.072 -0.727
103 1HB ALA 13 1HB ALA 13 0.897 -7.328 -0.517
104 2HB ALA 13 2HB ALA 13 0.378 -8.107 -2.012
105 3HB ALA 13 3HB ALA 13 1.701 -8.796 -1.071
106 H ALA 14 H ALA 14 -1.394 -8.549 1.970
107 HA ALA 14 HA ALA 14 -0.944 -8.722 4.191
108 1HB ALA 14 1HB ALA 14 1.022 -10.896 3.868
109 2HB ALA 14 2HB ALA 14 -0.582 -11.193 3.197
110 3HB ALA 14 3HB ALA 14 -0.401 -10.793 4.906
111 H ASN 15 H ASN 15 0.729 -7.011 2.513
112 HA ASN 15 HA ASN 15 3.052 -6.834 4.308
113 1HB ASN 15 2HB ASN 15 3.334 -7.651 1.743
114 2HB ASN 15 1HB ASN 15 3.461 -5.907 1.528
115 1HD2 ASN 15 1HD2 ASN 15 4.961 -8.754 2.717
116 2HD2 ASN 15 2HD2 ASN 15 6.460 -8.034 3.187
117 H VAL 16 H VAL 16 3.464 -4.848 5.097
118 HA VAL 16 HA VAL 16 1.694 -2.674 4.229
119 HB VAL 16 HB VAL 16 3.395 -2.766 6.720
120 1HG1 VAL 16 1HG1 VAL 16 1.492 -1.111 7.396
121 2HG1 VAL 16 2HG1 VAL 16 1.306 -0.922 5.652
122 3HG1 VAL 16 3HG1 VAL 16 2.850 -0.548 6.420
123 1HG2 VAL 16 1HG2 VAL 16 0.522 -3.588 6.321
124 2HG2 VAL 16 2HG2 VAL 16 1.272 -3.319 7.895
125 3HG2 VAL 16 3HG2 VAL 16 1.863 -4.608 6.845
126 H ALA 17 H ALA 17 5.092 -3.221 5.156
127 HA ALA 17 HA ALA 17 6.022 -0.685 4.355
128 1HB ALA 17 1HB ALA 17 7.448 -3.311 4.724
129 2HB ALA 17 2HB ALA 17 7.354 -1.960 5.854
130 3HB ALA 17 3HB ALA 17 8.276 -1.795 4.360
131 H ALA 18 H ALA 18 5.960 -3.812 2.673
132 HA ALA 18 HA ALA 18 7.304 -3.045 0.352
133 1HB ALA 18 1HB ALA 18 6.889 -5.362 0.796
134 2HB ALA 18 2HB ALA 18 6.100 -4.943 -0.724
135 3HB ALA 18 3HB ALA 18 5.144 -5.110 0.749
136 H HIS 19 H HIS 19 3.964 -2.605 1.320
137 HA HIS 19 HA HIS 19 3.055 -1.747 -1.255
138 1HB HIS 19 2HB HIS 19 1.278 -2.544 -0.031
139 2HB HIS 19 1HB HIS 19 1.899 -1.912 1.489
140 HD2 HIS 19 2HD HIS 19 0.754 0.382 2.324
141 HE1 HIS 19 1HE HIS 19 -1.173 1.349 -1.309
142 HE2 HIS 19 2HE HIS 19 -1.035 1.864 1.174
143 H MET 20 H MET 20 3.408 0.027 1.825
144 HA MET 20 HA MET 20 3.003 2.578 0.954
145 1HB MET 20 2HB MET 20 3.415 1.859 3.313
146 2HB MET 20 1HB MET 20 5.134 1.797 2.948
147 1HG MET 20 2HG MET 20 4.752 4.268 2.183
148 2HG MET 20 1HG MET 20 3.335 4.152 3.227
149 1HE MET 20 1HE MET 20 4.352 5.689 5.887
150 2HE MET 20 2HE MET 20 4.152 6.091 4.181
151 3HE MET 20 3HE MET 20 5.703 6.362 4.975
152 H THR 21 H THR 21 6.083 0.804 0.834
153 HA THR 21 HA THR 21 7.702 2.865 -0.107
154 HB THR 21 HB THR 21 8.548 0.682 0.671
155 HG1 THR 21 1HG THR 21 9.787 2.061 -0.773
156 1HG2 THR 21 1HG2 THR 21 7.036 -0.314 -1.635
157 2HG2 THR 21 2HG2 THR 21 7.489 -1.118 -0.133
158 3HG2 THR 21 3HG2 THR 21 8.658 -0.977 -1.446
159 H HIS 22 H HIS 22 5.288 1.006 -1.747
160 HA HIS 22 HA HIS 22 6.040 2.257 -4.284
161 1HB HIS 22 2HB HIS 22 6.038 0.177 -5.122
162 2HB HIS 22 1HB HIS 22 5.422 -0.478 -3.614
163 HD1 HIS 22 1HD HIS 22 4.627 -0.456 -7.022
164 HD2 HIS 22 2HD HIS 22 2.360 0.096 -3.571
165 HE1 HIS 22 1HE HIS 22 2.249 -0.916 -7.696
166 HE2 HIS 22 2HE HIS 22 0.893 -0.512 -5.613
167 H CYS 23 H CYS 23 3.997 2.676 -1.836
168 HA CYS 23 HA CYS 23 1.942 3.852 -3.541
169 1HB CYS 23 2HB CYS 23 1.652 1.621 -1.628
170 2HB CYS 23 1HB CYS 23 0.430 2.872 -1.515
171 H ALA 24 H ALA 24 4.145 4.934 -1.925
172 HA ALA 24 HA ALA 24 3.314 5.931 0.546
173 1HB ALA 24 1HB ALA 24 5.625 6.018 -0.742
174 2HB ALA 24 2HB ALA 24 5.228 7.171 0.533
175 3HB ALA 24 3HB ALA 24 5.050 7.633 -1.160
176 H LYS 25 H LYS 25 2.546 8.003 1.167
177 HA LYS 25 HA LYS 25 1.077 9.441 -0.943
178 1HB LYS 25 2HB LYS 25 -0.414 8.064 0.511
179 2HB LYS 25 1HB LYS 25 0.128 9.006 1.894
180 1HG LYS 25 2HG LYS 25 -0.922 10.548 -0.388
181 2HG LYS 25 1HG LYS 25 -2.089 9.556 0.489
182 1HD LYS 25 2HD LYS 25 -0.200 11.460 1.857
183 2HD LYS 25 1HD LYS 25 -1.809 11.934 1.308
184 1HE LYS 25 2HE LYS 25 -1.287 9.628 3.175
185 2HE LYS 25 1HE LYS 25 -1.660 11.262 3.721
186 1HZ LYS 25 1HZ LYS 25 -3.748 10.450 3.673
187 2HZ LYS 25 2HZ LYS 25 -3.399 9.264 2.520
188 3HZ LYS 25 3HZ LYS 25 -3.662 10.862 2.034
Start of MODEL 7
1 1H ARG 1 1HT ARG 1 -2.812 1.095 9.477
2 2H ARG 1 2HT ARG 1 -3.110 1.683 7.893
3 3H ARG 1 3HT ARG 1 -1.509 1.309 8.384
4 HA ARG 1 HA ARG 1 -1.913 -0.942 8.419
5 1HB ARG 1 2HB ARG 1 -4.321 -0.321 9.383
6 2HB ARG 1 1HB ARG 1 -4.793 -0.630 7.718
7 1HG ARG 1 2HG ARG 1 -3.619 -2.855 7.929
8 2HG ARG 1 1HG ARG 1 -3.512 -2.528 9.660
9 1HD ARG 1 2HD ARG 1 -6.035 -2.154 9.569
10 2HD ARG 1 1HD ARG 1 -5.971 -2.901 7.973
11 HE ARG 1 HE ARG 1 -4.669 -4.633 9.677
12 1HH1 ARG 1 1HH1 ARG 1 -7.868 -3.267 9.409
13 2HH1 ARG 1 2HH1 ARG 1 -8.648 -4.632 10.133
14 1HH2 ARG 1 1HH2 ARG 1 -5.693 -6.430 10.632
15 2HH2 ARG 1 2HH2 ARG 1 -7.414 -6.428 10.828
16 H VAL 2 H VAL 2 -2.244 -2.361 6.552
17 HA VAL 2 HA VAL 2 -1.953 -0.858 4.069
18 HB VAL 2 HB VAL 2 -0.261 -2.560 4.611
19 1HG1 VAL 2 1HG1 VAL 2 -2.321 -4.071 5.533
20 2HG1 VAL 2 2HG1 VAL 2 -0.708 -4.688 5.169
21 3HG1 VAL 2 3HG1 VAL 2 -2.000 -4.836 3.976
22 1HG2 VAL 2 1HG2 VAL 2 -1.539 -3.820 2.287
23 2HG2 VAL 2 2HG2 VAL 2 0.045 -3.062 2.441
24 3HG2 VAL 2 3HG2 VAL 2 -1.388 -2.066 2.192
25 H ILE 3 H ILE 3 -4.521 -0.722 4.895
26 HA ILE 3 HA ILE 3 -5.922 -2.589 3.094
27 HB ILE 3 HB ILE 3 -6.481 -2.975 5.476
28 1HG1 ILE 3 2HG1 ILE 3 -8.998 -1.832 4.433
29 2HG1 ILE 3 1HG1 ILE 3 -8.157 -2.924 3.339
30 1HG2 ILE 3 1HG2 ILE 3 -6.322 -0.308 5.797
31 2HG2 ILE 3 2HG2 ILE 3 -7.174 -1.381 6.908
32 3HG2 ILE 3 3HG2 ILE 3 -8.070 -0.503 5.668
33 1HD1 ILE 3 1HD1 ILE 3 -9.822 -3.557 5.531
34 2HD1 ILE 3 2HD1 ILE 3 -8.192 -4.113 5.911
35 3HD1 ILE 3 3HD1 ILE 3 -8.986 -4.652 4.431
36 H ALA 4 H ALA 4 -4.744 0.007 2.468
37 HA ALA 4 HA ALA 4 -7.174 1.563 1.873
38 1HB ALA 4 1HB ALA 4 -5.858 3.022 3.071
39 2HB ALA 4 2HB ALA 4 -5.375 3.399 1.417
40 3HB ALA 4 3HB ALA 4 -4.353 2.370 2.420
41 H CYS 5 H CYS 5 -4.322 0.054 0.527
42 HA CYS 5 HA CYS 5 -4.366 1.160 -2.041
43 1HB CYS 5 2HB CYS 5 -2.620 -0.397 -0.913
44 2HB CYS 5 1HB CYS 5 -3.609 -1.706 -1.548
45 H PHE 6 H PHE 6 -4.967 0.015 -4.064
46 HA PHE 6 HA PHE 6 -7.453 -1.534 -3.736
47 1HB PHE 6 2HB PHE 6 -8.347 -0.393 -5.730
48 2HB PHE 6 1HB PHE 6 -8.003 0.741 -4.429
49 HD1 PHE 6 1HD PHE 6 -7.538 0.015 -7.853
50 HD2 PHE 6 2HD PHE 6 -5.704 1.931 -4.525
51 HE1 PHE 6 1HE PHE 6 -6.151 1.346 -9.389
52 HE2 PHE 6 2HE PHE 6 -4.314 3.266 -6.055
53 HZ PHE 6 HZ PHE 6 -4.536 2.974 -8.490
54 H LEU 7 H LEU 7 -4.809 -2.575 -4.097
55 HA LEU 7 HA LEU 7 -5.147 -3.845 -6.732
56 1HB LEU 7 2HB LEU 7 -2.684 -2.738 -5.447
57 2HB LEU 7 1HB LEU 7 -2.548 -4.109 -6.534
58 HG LEU 7 HG LEU 7 -3.957 -1.605 -7.401
59 1HD1 LEU 7 1HD1 LEU 7 -1.495 -1.332 -6.496
60 2HD1 LEU 7 2HD1 LEU 7 -2.032 -0.522 -7.968
61 3HD1 LEU 7 3HD1 LEU 7 -1.093 -2.011 -8.073
62 1HD2 LEU 7 1HD2 LEU 7 -3.791 -2.455 -9.513
63 2HD2 LEU 7 2HD2 LEU 7 -3.880 -3.959 -8.598
64 3HD2 LEU 7 3HD2 LEU 7 -2.319 -3.357 -9.155
65 H LYS 8 H LYS 8 -4.581 -6.037 -6.879
66 HA LYS 8 HA LYS 8 -5.022 -7.534 -4.487
67 1HB LYS 8 2HB LYS 8 -4.483 -8.241 -7.352
68 2HB LYS 8 1HB LYS 8 -4.432 -9.486 -6.113
69 1HG LYS 8 2HG LYS 8 -6.608 -9.702 -6.602
70 2HG LYS 8 1HG LYS 8 -6.790 -8.317 -5.525
71 1HD LYS 8 2HD LYS 8 -6.156 -7.660 -8.323
72 2HD LYS 8 1HD LYS 8 -7.732 -8.411 -8.064
73 1HE LYS 8 2HE LYS 8 -8.213 -6.704 -6.337
74 2HE LYS 8 1HE LYS 8 -6.675 -5.930 -6.713
75 1HZ LYS 8 1HZ LYS 8 -8.697 -6.397 -8.813
76 2HZ LYS 8 2HZ LYS 8 -7.423 -5.285 -8.800
77 3HZ LYS 8 3HZ LYS 8 -8.777 -5.032 -7.817
78 H VAL 9 H VAL 9 -2.284 -7.471 -6.776
79 HA VAL 9 HA VAL 9 -0.546 -8.975 -5.151
80 HB VAL 9 HB VAL 9 -0.174 -8.689 -7.556
81 1HG1 VAL 9 1HG1 VAL 9 1.130 -6.341 -7.941
82 2HG1 VAL 9 2HG1 VAL 9 -0.126 -5.853 -6.805
83 3HG1 VAL 9 3HG1 VAL 9 -0.568 -6.619 -8.330
84 1HG2 VAL 9 1HG2 VAL 9 2.066 -8.937 -7.384
85 2HG2 VAL 9 2HG2 VAL 9 1.714 -8.918 -5.656
86 3HG2 VAL 9 3HG2 VAL 9 2.269 -7.450 -6.460
87 H CYS 10 H CYS 10 -1.446 -5.637 -5.092
88 HA CYS 10 HA CYS 10 0.831 -4.900 -3.427
89 1HB CYS 10 2HB CYS 10 -0.432 -3.483 -5.321
90 2HB CYS 10 1HB CYS 10 -1.382 -2.981 -3.927
91 H ALA 11 H ALA 11 -2.710 -4.488 -3.200
92 HA ALA 11 HA ALA 11 -2.609 -4.125 -0.363
93 1HB ALA 11 1HB ALA 11 -4.756 -3.465 -0.538
94 2HB ALA 11 2HB ALA 11 -5.198 -4.816 -1.584
95 3HB ALA 11 3HB ALA 11 -4.386 -3.403 -2.261
96 H ALA 12 H ALA 12 -3.668 -6.753 -2.503
97 HA ALA 12 HA ALA 12 -4.253 -8.482 -0.254
98 1HB ALA 12 1HB ALA 12 -5.378 -9.794 -1.711
99 2HB ALA 12 2HB ALA 12 -4.178 -9.596 -2.989
100 3HB ALA 12 3HB ALA 12 -5.359 -8.322 -2.682
101 H ALA 13 H ALA 13 -1.505 -7.624 -0.451
102 HA ALA 13 HA ALA 13 -0.172 -10.159 -1.120
103 1HB ALA 13 1HB ALA 13 1.839 -8.305 -0.806
104 2HB ALA 13 2HB ALA 13 0.548 -7.378 -1.571
105 3HB ALA 13 3HB ALA 13 1.155 -8.845 -2.340
106 H ALA 14 H ALA 14 -1.361 -8.549 1.477
107 HA ALA 14 HA ALA 14 -1.018 -8.639 3.723
108 1HB ALA 14 1HB ALA 14 0.541 -10.703 4.367
109 2HB ALA 14 2HB ALA 14 0.166 -11.154 2.704
110 3HB ALA 14 3HB ALA 14 -1.138 -10.902 3.864
111 H ASN 15 H ASN 15 0.798 -7.047 2.085
112 HA ASN 15 HA ASN 15 3.057 -6.928 3.965
113 1HB ASN 15 2HB ASN 15 3.395 -7.765 1.419
114 2HB ASN 15 1HB ASN 15 3.568 -6.027 1.189
115 1HD2 ASN 15 1HD2 ASN 15 5.377 -8.557 1.344
116 2HD2 ASN 15 2HD2 ASN 15 6.721 -7.997 2.273
117 H VAL 16 H VAL 16 3.183 -5.035 4.963
118 HA VAL 16 HA VAL 16 1.616 -2.790 3.982
119 HB VAL 16 HB VAL 16 3.250 -2.936 6.516
120 1HG1 VAL 16 1HG1 VAL 16 1.446 -1.226 7.192
121 2HG1 VAL 16 2HG1 VAL 16 1.167 -1.060 5.460
122 3HG1 VAL 16 3HG1 VAL 16 2.754 -0.695 6.136
123 1HG2 VAL 16 1HG2 VAL 16 0.290 -3.410 6.336
124 2HG2 VAL 16 2HG2 VAL 16 1.381 -3.737 7.682
125 3HG2 VAL 16 3HG2 VAL 16 1.453 -4.731 6.228
126 H ALA 17 H ALA 17 4.968 -3.328 5.079
127 HA ALA 17 HA ALA 17 5.965 -0.830 4.308
128 1HB ALA 17 1HB ALA 17 7.136 -3.449 5.014
129 2HB ALA 17 2HB ALA 17 7.473 -1.842 5.659
130 3HB ALA 17 3HB ALA 17 8.170 -2.338 4.116
131 H ALA 18 H ALA 18 5.871 -3.913 2.553
132 HA ALA 18 HA ALA 18 7.284 -3.126 0.279
133 1HB ALA 18 1HB ALA 18 6.468 -5.059 -0.759
134 2HB ALA 18 2HB ALA 18 4.971 -5.035 0.172
135 3HB ALA 18 3HB ALA 18 6.492 -5.461 0.958
136 H HIS 19 H HIS 19 3.917 -2.668 1.162
137 HA HIS 19 HA HIS 19 3.112 -1.697 -1.407
138 1HB HIS 19 2HB HIS 19 1.279 -2.516 -0.287
139 2HB HIS 19 1HB HIS 19 1.855 -1.964 1.281
140 HD2 HIS 19 2HD HIS 19 0.724 0.316 2.179
141 HE1 HIS 19 1HE HIS 19 -1.085 1.460 -1.463
142 HE2 HIS 19 2HE HIS 19 -0.726 2.086 0.967
143 H MET 20 H MET 20 3.391 -0.057 1.753
144 HA MET 20 HA MET 20 3.039 2.535 0.975
145 1HB MET 20 2HB MET 20 3.361 1.732 3.314
146 2HB MET 20 1HB MET 20 5.089 1.629 3.003
147 1HG MET 20 2HG MET 20 4.931 4.107 2.384
148 2HG MET 20 1HG MET 20 3.356 4.065 3.173
149 1HE MET 20 1HE MET 20 3.766 2.662 6.305
150 2HE MET 20 2HE MET 20 2.817 3.734 5.276
151 3HE MET 20 3HE MET 20 3.773 4.401 6.600
152 H THR 21 H THR 21 6.099 0.727 0.876
153 HA THR 21 HA THR 21 7.768 2.804 0.065
154 HB THR 21 HB THR 21 8.560 0.578 0.787
155 HG1 THR 21 1HG THR 21 9.927 1.948 -0.460
156 1HG2 THR 21 1HG2 THR 21 7.094 -0.306 -1.579
157 2HG2 THR 21 2HG2 THR 21 7.571 -1.196 -0.131
158 3HG2 THR 21 3HG2 THR 21 8.727 -0.959 -1.442
159 H HIS 22 H HIS 22 5.385 1.040 -1.715
160 HA HIS 22 HA HIS 22 6.231 2.369 -4.181
161 1HB HIS 22 2HB HIS 22 6.225 0.319 -5.093
162 2HB HIS 22 1HB HIS 22 5.551 -0.378 -3.628
163 HD1 HIS 22 1HD HIS 22 4.863 -0.209 -7.059
164 HD2 HIS 22 2HD HIS 22 2.500 0.237 -3.658
165 HE1 HIS 22 1HE HIS 22 2.502 -0.605 -7.822
166 HE2 HIS 22 2HE HIS 22 1.087 -0.264 -5.767
167 H CYS 23 H CYS 23 4.122 2.736 -1.782
168 HA CYS 23 HA CYS 23 2.137 4.000 -3.506
169 1HB CYS 23 2HB CYS 23 1.758 1.706 -1.688
170 2HB CYS 23 1HB CYS 23 0.551 2.969 -1.562
171 H ALA 24 H ALA 24 4.287 5.036 -1.833
172 HA ALA 24 HA ALA 24 3.418 5.946 0.663
173 1HB ALA 24 1HB ALA 24 5.330 7.302 -1.236
174 2HB ALA 24 2HB ALA 24 5.752 6.043 -0.076
175 3HB ALA 24 3HB ALA 24 5.185 7.612 0.495
176 H LYS 25 H LYS 25 2.637 7.995 1.337
177 HA LYS 25 HA LYS 25 1.208 9.504 -0.751
178 1HB LYS 25 2HB LYS 25 -0.366 8.137 0.544
179 2HB LYS 25 1HB LYS 25 0.222 8.860 2.034
180 1HG LYS 25 2HG LYS 25 -0.739 10.746 -0.013
181 2HG LYS 25 1HG LYS 25 -1.961 9.704 0.718
182 1HD LYS 25 2HD LYS 25 0.008 11.319 2.325
183 2HD LYS 25 1HD LYS 25 -1.585 11.920 1.863
184 1HE LYS 25 2HE LYS 25 -1.297 9.291 3.265
185 2HE LYS 25 1HE LYS 25 -1.270 10.798 4.180
186 1HZ LYS 25 1HZ LYS 25 -3.498 9.538 3.736
187 2HZ LYS 25 2HZ LYS 25 -3.443 10.362 2.260
188 3HZ LYS 25 3HZ LYS 25 -3.448 11.230 3.712
Start of MODEL 8
1 1H ARG 1 1HT ARG 1 -1.554 1.099 8.076
2 2H ARG 1 2HT ARG 1 -0.611 -0.335 8.082
3 3H ARG 1 3HT ARG 1 -1.540 0.090 9.462
4 HA ARG 1 HA ARG 1 -2.590 -1.650 8.259
5 1HB ARG 1 2HB ARG 1 -3.714 0.585 9.265
6 2HB ARG 1 1HB ARG 1 -4.281 0.699 7.604
7 1HG ARG 1 2HG ARG 1 -5.983 -0.542 8.376
8 2HG ARG 1 1HG ARG 1 -4.859 -1.879 8.126
9 1HD ARG 1 2HD ARG 1 -4.880 -0.396 10.723
10 2HD ARG 1 1HD ARG 1 -6.091 -1.638 10.404
11 HE ARG 1 HE ARG 1 -3.307 -2.038 10.977
12 1HH1 ARG 1 1HH1 ARG 1 -6.121 -3.401 9.426
13 2HH1 ARG 1 2HH1 ARG 1 -5.548 -5.031 9.538
14 1HH2 ARG 1 1HH2 ARG 1 -2.553 -4.183 11.128
15 2HH2 ARG 1 2HH2 ARG 1 -3.524 -5.475 10.505
16 H VAL 2 H VAL 2 -2.237 -2.640 6.380
17 HA VAL 2 HA VAL 2 -2.011 -1.089 3.923
18 HB VAL 2 HB VAL 2 -0.333 -2.831 4.373
19 1HG1 VAL 2 1HG1 VAL 2 -2.388 -4.326 5.328
20 2HG1 VAL 2 2HG1 VAL 2 -0.801 -4.963 4.899
21 3HG1 VAL 2 3HG1 VAL 2 -2.132 -5.063 3.746
22 1HG2 VAL 2 1HG2 VAL 2 -1.975 -2.662 1.976
23 2HG2 VAL 2 2HG2 VAL 2 -1.137 -4.206 2.125
24 3HG2 VAL 2 3HG2 VAL 2 -0.220 -2.700 2.147
25 H ILE 3 H ILE 3 -4.542 -0.896 4.793
26 HA ILE 3 HA ILE 3 -6.036 -2.725 3.028
27 HB ILE 3 HB ILE 3 -6.546 -3.096 5.425
28 1HG1 ILE 3 2HG1 ILE 3 -9.053 -1.886 4.424
29 2HG1 ILE 3 1HG1 ILE 3 -8.266 -3.024 3.333
30 1HG2 ILE 3 1HG2 ILE 3 -6.250 -0.505 5.833
31 2HG2 ILE 3 2HG2 ILE 3 -7.298 -1.488 6.857
32 3HG2 ILE 3 3HG2 ILE 3 -7.994 -0.506 5.567
33 1HD1 ILE 3 1HD1 ILE 3 -9.833 -3.526 5.682
34 2HD1 ILE 3 2HD1 ILE 3 -8.235 -4.257 5.833
35 3HD1 ILE 3 3HD1 ILE 3 -9.259 -4.651 4.452
36 H ALA 4 H ALA 4 -4.799 -0.127 2.420
37 HA ALA 4 HA ALA 4 -7.216 1.455 1.835
38 1HB ALA 4 1HB ALA 4 -5.966 2.961 2.993
39 2HB ALA 4 2HB ALA 4 -5.300 3.242 1.384
40 3HB ALA 4 3HB ALA 4 -4.435 2.217 2.530
41 H CYS 5 H CYS 5 -4.375 -0.070 0.491
42 HA CYS 5 HA CYS 5 -4.359 1.078 -2.055
43 1HB CYS 5 2HB CYS 5 -2.667 -0.540 -0.951
44 2HB CYS 5 1HB CYS 5 -3.696 -1.818 -1.589
45 H PHE 6 H PHE 6 -4.982 0.017 -4.106
46 HA PHE 6 HA PHE 6 -7.467 -1.540 -3.855
47 1HB PHE 6 2HB PHE 6 -8.447 -0.251 -5.693
48 2HB PHE 6 1HB PHE 6 -8.030 0.801 -4.345
49 HD1 PHE 6 1HD PHE 6 -7.859 0.403 -7.812
50 HD2 PHE 6 2HD PHE 6 -5.620 1.869 -4.503
51 HE1 PHE 6 1HE PHE 6 -6.546 1.821 -9.334
52 HE2 PHE 6 2HE PHE 6 -4.304 3.291 -6.019
53 HZ PHE 6 HZ PHE 6 -4.766 3.268 -8.439
54 H LEU 7 H LEU 7 -4.751 -2.418 -4.392
55 HA LEU 7 HA LEU 7 -5.097 -3.426 -7.141
56 1HB LEU 7 2HB LEU 7 -2.677 -2.530 -5.648
57 2HB LEU 7 1HB LEU 7 -2.502 -3.826 -6.816
58 HG LEU 7 HG LEU 7 -3.764 -1.197 -7.549
59 1HD1 LEU 7 1HD1 LEU 7 -1.299 -1.185 -6.596
60 2HD1 LEU 7 2HD1 LEU 7 -1.757 -0.220 -8.000
61 3HD1 LEU 7 3HD1 LEU 7 -0.928 -1.760 -8.221
62 1HD2 LEU 7 1HD2 LEU 7 -2.220 -2.877 -9.435
63 2HD2 LEU 7 2HD2 LEU 7 -3.684 -1.927 -9.695
64 3HD2 LEU 7 3HD2 LEU 7 -3.782 -3.498 -8.900
65 H LYS 8 H LYS 8 -4.411 -5.600 -7.548
66 HA LYS 8 HA LYS 8 -5.177 -7.408 -5.492
67 1HB LYS 8 2HB LYS 8 -5.138 -7.557 -8.188
68 2HB LYS 8 1HB LYS 8 -3.674 -8.458 -7.817
69 1HG LYS 8 2HG LYS 8 -5.027 -10.218 -7.624
70 2HG LYS 8 1HG LYS 8 -5.465 -9.534 -6.058
71 1HD LYS 8 2HD LYS 8 -6.895 -8.996 -8.660
72 2HD LYS 8 1HD LYS 8 -7.439 -10.117 -7.410
73 1HE LYS 8 2HE LYS 8 -8.078 -8.447 -5.995
74 2HE LYS 8 1HE LYS 8 -6.856 -7.326 -6.593
75 1HZ LYS 8 1HZ LYS 8 -8.157 -6.798 -8.448
76 2HZ LYS 8 2HZ LYS 8 -9.251 -6.815 -7.158
77 3HZ LYS 8 3HZ LYS 8 -9.188 -8.122 -8.230
78 H VAL 9 H VAL 9 -2.075 -7.074 -7.230
79 HA VAL 9 HA VAL 9 -0.717 -8.525 -5.110
80 HB VAL 9 HB VAL 9 -0.145 -9.000 -7.455
81 1HG1 VAL 9 1HG1 VAL 9 -0.336 -6.333 -7.878
82 2HG1 VAL 9 2HG1 VAL 9 0.466 -7.458 -8.972
83 3HG1 VAL 9 3HG1 VAL 9 1.414 -6.535 -7.807
84 1HG2 VAL 9 1HG2 VAL 9 2.441 -8.238 -7.048
85 2HG2 VAL 9 2HG2 VAL 9 1.687 -9.669 -6.346
86 3HG2 VAL 9 3HG2 VAL 9 1.787 -8.177 -5.412
87 H CYS 10 H CYS 10 -1.629 -6.377 -3.906
88 HA CYS 10 HA CYS 10 0.743 -4.965 -3.138
89 1HB CYS 10 2HB CYS 10 -0.388 -3.798 -5.248
90 2HB CYS 10 1HB CYS 10 -1.422 -3.106 -4.001
91 H ALA 11 H ALA 11 -2.814 -4.739 -3.051
92 HA ALA 11 HA ALA 11 -2.847 -3.766 -0.359
93 1HB ALA 11 1HB ALA 11 -5.077 -3.462 -0.653
94 2HB ALA 11 2HB ALA 11 -5.286 -4.988 -1.512
95 3HB ALA 11 3HB ALA 11 -4.614 -3.588 -2.350
96 H ALA 12 H ALA 12 -4.054 -6.803 -1.797
97 HA ALA 12 HA ALA 12 -4.120 -8.062 0.811
98 1HB ALA 12 1HB ALA 12 -5.427 -9.688 -0.129
99 2HB ALA 12 2HB ALA 12 -4.623 -9.587 -1.695
100 3HB ALA 12 3HB ALA 12 -5.774 -8.341 -1.212
101 H ALA 13 H ALA 13 -1.494 -7.315 -0.123
102 HA ALA 13 HA ALA 13 -0.245 -9.851 -0.846
103 1HB ALA 13 1HB ALA 13 0.295 -7.497 -1.847
104 2HB ALA 13 2HB ALA 13 1.587 -8.662 -1.556
105 3HB ALA 13 3HB ALA 13 1.311 -7.346 -0.414
106 H ALA 14 H ALA 14 -1.200 -8.441 1.955
107 HA ALA 14 HA ALA 14 -0.662 -8.697 4.149
108 1HB ALA 14 1HB ALA 14 -0.789 -11.027 3.813
109 2HB ALA 14 2HB ALA 14 0.714 -10.758 4.698
110 3HB ALA 14 3HB ALA 14 0.756 -11.068 2.962
111 H ASN 15 H ASN 15 0.985 -6.958 2.483
112 HA ASN 15 HA ASN 15 3.294 -6.792 4.270
113 1HB ASN 15 2HB ASN 15 3.647 -7.867 1.805
114 2HB ASN 15 1HB ASN 15 3.887 -6.161 1.442
115 1HD2 ASN 15 1HD2 ASN 15 5.035 -5.339 3.836
116 2HD2 ASN 15 2HD2 ASN 15 6.596 -6.065 3.980
117 H VAL 16 H VAL 16 2.959 -4.896 5.233
118 HA VAL 16 HA VAL 16 1.611 -2.719 3.943
119 HB VAL 16 HB VAL 16 3.150 -2.629 6.539
120 1HG1 VAL 16 1HG1 VAL 16 0.987 -0.912 5.343
121 2HG1 VAL 16 2HG1 VAL 16 2.623 -0.438 5.801
122 3HG1 VAL 16 3HG1 VAL 16 1.442 -0.848 7.046
123 1HG2 VAL 16 1HG2 VAL 16 0.600 -2.869 7.333
124 2HG2 VAL 16 2HG2 VAL 16 1.685 -4.246 7.145
125 3HG2 VAL 16 3HG2 VAL 16 0.541 -3.843 5.864
126 H ALA 17 H ALA 17 4.944 -3.284 5.050
127 HA ALA 17 HA ALA 17 5.999 -0.818 4.231
128 1HB ALA 17 1HB ALA 17 7.577 -3.373 4.257
129 2HB ALA 17 2HB ALA 17 7.058 -2.577 5.743
130 3HB ALA 17 3HB ALA 17 8.124 -1.735 4.617
131 H ALA 18 H ALA 18 5.869 -3.947 2.549
132 HA ALA 18 HA ALA 18 7.250 -3.218 0.241
133 1HB ALA 18 1HB ALA 18 6.494 -5.192 -0.697
134 2HB ALA 18 2HB ALA 18 4.928 -5.096 0.108
135 3HB ALA 18 3HB ALA 18 6.367 -5.528 1.031
136 H HIS 19 H HIS 19 3.878 -2.761 1.131
137 HA HIS 19 HA HIS 19 3.073 -1.811 -1.447
138 1HB HIS 19 2HB HIS 19 1.240 -2.634 -0.331
139 2HB HIS 19 1HB HIS 19 1.811 -2.081 1.238
140 HD2 HIS 19 2HD HIS 19 0.673 0.196 2.136
141 HE1 HIS 19 1HE HIS 19 -1.148 1.329 -1.504
142 HE2 HIS 19 2HE HIS 19 -0.788 1.956 0.925
143 H MET 20 H MET 20 3.359 -0.159 1.708
144 HA MET 20 HA MET 20 2.982 2.428 0.918
145 1HB MET 20 2HB MET 20 3.553 1.341 3.258
146 2HB MET 20 1HB MET 20 5.176 1.894 2.871
147 1HG MET 20 2HG MET 20 4.535 4.139 2.858
148 2HG MET 20 1HG MET 20 2.823 3.741 2.736
149 1HE MET 20 1HE MET 20 3.241 5.760 5.742
150 2HE MET 20 2HE MET 20 4.283 5.731 4.320
151 3HE MET 20 3HE MET 20 4.934 5.292 5.900
152 H THR 21 H THR 21 6.050 0.635 0.819
153 HA THR 21 HA THR 21 7.707 2.719 0.002
154 HB THR 21 HB THR 21 8.505 0.491 0.727
155 HG1 THR 21 1HG THR 21 10.175 0.354 -0.843
156 1HG2 THR 21 1HG2 THR 21 7.043 -0.396 -1.636
157 2HG2 THR 21 2HG2 THR 21 7.548 -1.291 -0.203
158 3HG2 THR 21 3HG2 THR 21 8.685 -1.026 -1.525
159 H HIS 22 H HIS 22 5.318 0.958 -1.765
160 HA HIS 22 HA HIS 22 6.156 2.284 -4.237
161 1HB HIS 22 2HB HIS 22 6.162 0.234 -5.147
162 2HB HIS 22 1HB HIS 22 5.495 -0.468 -3.682
163 HD1 HIS 22 1HD HIS 22 4.801 -0.306 -7.112
164 HD2 HIS 22 2HD HIS 22 2.439 0.130 -3.708
165 HE1 HIS 22 1HE HIS 22 2.441 -0.717 -7.871
166 HE2 HIS 22 2HE HIS 22 1.027 -0.382 -5.814
167 H CYS 23 H CYS 23 4.048 2.635 -1.832
168 HA CYS 23 HA CYS 23 2.053 3.888 -3.554
169 1HB CYS 23 2HB CYS 23 1.690 1.592 -1.734
170 2HB CYS 23 1HB CYS 23 0.476 2.848 -1.606
171 H ALA 24 H ALA 24 4.216 4.895 -1.839
172 HA ALA 24 HA ALA 24 3.290 5.822 0.636
173 1HB ALA 24 1HB ALA 24 5.427 6.740 -1.246
174 2HB ALA 24 2HB ALA 24 5.581 6.003 0.348
175 3HB ALA 24 3HB ALA 24 5.046 7.677 0.199
176 H LYS 25 H LYS 25 3.067 8.257 1.102
177 HA LYS 25 HA LYS 25 0.808 9.202 -0.426
178 1HB LYS 25 2HB LYS 25 2.197 10.146 2.069
179 2HB LYS 25 1HB LYS 25 0.966 11.127 1.285
180 1HG LYS 25 2HG LYS 25 0.235 8.320 1.803
181 2HG LYS 25 1HG LYS 25 0.446 9.348 3.222
182 1HD LYS 25 2HD LYS 25 -1.035 11.012 1.812
183 2HD LYS 25 1HD LYS 25 -1.556 9.522 1.024
184 1HE LYS 25 2HE LYS 25 -2.494 8.672 2.964
185 2HE LYS 25 1HE LYS 25 -1.517 9.703 4.008
186 1HZ LYS 25 1HZ LYS 25 -3.792 10.455 3.980
187 2HZ LYS 25 2HZ LYS 25 -3.776 10.586 2.294
188 3HZ LYS 25 3HZ LYS 25 -2.811 11.612 3.231
Start of MODEL 9
1 1H ARG 1 1HT ARG 1 -1.668 1.722 7.490
2 2H ARG 1 2HT ARG 1 -2.348 1.415 9.035
3 3H ARG 1 3HT ARG 1 -3.361 1.848 7.719
4 HA ARG 1 HA ARG 1 -1.865 -0.641 8.144
5 1HB ARG 1 2HB ARG 1 -4.328 0.082 8.964
6 2HB ARG 1 1HB ARG 1 -4.722 -0.499 7.352
7 1HG ARG 1 2HG ARG 1 -4.264 -2.657 7.864
8 2HG ARG 1 1HG ARG 1 -2.998 -2.231 9.018
9 1HD ARG 1 2HD ARG 1 -5.164 -1.225 10.275
10 2HD ARG 1 1HD ARG 1 -5.897 -2.582 9.420
11 HE ARG 1 HE ARG 1 -3.721 -3.692 10.575
12 1HH1 ARG 1 1HH1 ARG 1 -6.336 -1.739 11.812
13 2HH1 ARG 1 2HH1 ARG 1 -6.289 -2.452 13.389
14 1HH2 ARG 1 1HH2 ARG 1 -3.657 -4.630 12.649
15 2HH2 ARG 1 2HH2 ARG 1 -4.767 -4.093 13.865
16 H VAL 2 H VAL 2 -2.414 -2.272 6.404
17 HA VAL 2 HA VAL 2 -1.951 -1.016 3.803
18 HB VAL 2 HB VAL 2 -0.366 -2.754 4.540
19 1HG1 VAL 2 1HG1 VAL 2 -2.820 -4.494 4.528
20 2HG1 VAL 2 2HG1 VAL 2 -1.697 -4.199 5.855
21 3HG1 VAL 2 3HG1 VAL 2 -1.181 -5.144 4.458
22 1HG2 VAL 2 1HG2 VAL 2 -1.659 -4.136 2.296
23 2HG2 VAL 2 2HG2 VAL 2 -0.038 -3.452 2.430
24 3HG2 VAL 2 3HG2 VAL 2 -1.409 -2.406 2.058
25 H ILE 3 H ILE 3 -4.564 -0.818 4.780
26 HA ILE 3 HA ILE 3 -6.010 -2.643 2.971
27 HB ILE 3 HB ILE 3 -6.537 -3.054 5.353
28 1HG1 ILE 3 2HG1 ILE 3 -9.052 -1.859 4.357
29 2HG1 ILE 3 1HG1 ILE 3 -8.244 -2.966 3.252
30 1HG2 ILE 3 1HG2 ILE 3 -6.720 -0.185 5.408
31 2HG2 ILE 3 2HG2 ILE 3 -6.669 -1.332 6.746
32 3HG2 ILE 3 3HG2 ILE 3 -8.213 -0.914 6.002
33 1HD1 ILE 3 1HD1 ILE 3 -9.726 -3.506 5.695
34 2HD1 ILE 3 2HD1 ILE 3 -8.172 -4.335 5.618
35 3HD1 ILE 3 3HD1 ILE 3 -9.357 -4.560 4.331
36 H ALA 4 H ALA 4 -4.812 -0.027 2.390
37 HA ALA 4 HA ALA 4 -7.244 1.533 1.816
38 1HB ALA 4 1HB ALA 4 -4.429 2.343 2.391
39 2HB ALA 4 2HB ALA 4 -5.937 2.966 3.060
40 3HB ALA 4 3HB ALA 4 -5.460 3.392 1.417
41 H CYS 5 H CYS 5 -4.394 0.044 0.457
42 HA CYS 5 HA CYS 5 -4.389 1.208 -2.080
43 1HB CYS 5 2HB CYS 5 -2.695 -0.422 -0.976
44 2HB CYS 5 1HB CYS 5 -3.709 -1.688 -1.656
45 H PHE 6 H PHE 6 -5.027 0.194 -4.137
46 HA PHE 6 HA PHE 6 -7.568 -1.278 -3.876
47 1HB PHE 6 2HB PHE 6 -8.282 -0.115 -5.967
48 2HB PHE 6 1HB PHE 6 -8.047 0.971 -4.602
49 HD1 PHE 6 1HD PHE 6 -7.150 0.225 -7.976
50 HD2 PHE 6 2HD PHE 6 -5.866 2.260 -4.465
51 HE1 PHE 6 1HE PHE 6 -5.614 1.587 -9.331
52 HE2 PHE 6 2HE PHE 6 -4.329 3.627 -5.815
53 HZ PHE 6 HZ PHE 6 -4.202 3.292 -8.252
54 H LEU 7 H LEU 7 -4.974 -2.462 -4.150
55 HA LEU 7 HA LEU 7 -5.358 -3.807 -6.735
56 1HB LEU 7 2HB LEU 7 -2.814 -2.705 -5.584
57 2HB LEU 7 1HB LEU 7 -2.784 -4.044 -6.717
58 HG LEU 7 HG LEU 7 -4.284 -1.591 -7.495
59 1HD1 LEU 7 1HD1 LEU 7 -1.354 -1.755 -7.069
60 2HD1 LEU 7 2HD1 LEU 7 -2.444 -0.374 -6.946
61 3HD1 LEU 7 3HD1 LEU 7 -1.929 -0.953 -8.530
62 1HD2 LEU 7 1HD2 LEU 7 -3.969 -2.349 -9.624
63 2HD2 LEU 7 2HD2 LEU 7 -3.929 -3.884 -8.758
64 3HD2 LEU 7 3HD2 LEU 7 -2.422 -3.108 -9.245
65 H LYS 8 H LYS 8 -4.949 -6.003 -6.762
66 HA LYS 8 HA LYS 8 -5.188 -7.355 -4.265
67 1HB LYS 8 2HB LYS 8 -4.944 -8.205 -7.125
68 2HB LYS 8 1HB LYS 8 -4.740 -9.400 -5.851
69 1HG LYS 8 2HG LYS 8 -6.932 -9.269 -5.185
70 2HG LYS 8 1HG LYS 8 -7.135 -7.630 -5.806
71 1HD LYS 8 2HD LYS 8 -6.520 -9.675 -7.831
72 2HD LYS 8 1HD LYS 8 -8.082 -9.855 -7.030
73 1HE LYS 8 2HE LYS 8 -8.491 -8.508 -8.917
74 2HE LYS 8 1HE LYS 8 -8.467 -7.403 -7.543
75 1HZ LYS 8 1HZ LYS 8 -6.270 -7.856 -9.489
76 2HZ LYS 8 2HZ LYS 8 -6.138 -6.888 -8.108
77 3HZ LYS 8 3HZ LYS 8 -7.218 -6.463 -9.338
78 H VAL 9 H VAL 9 -2.646 -7.463 -6.768
79 HA VAL 9 HA VAL 9 -0.806 -8.961 -5.293
80 HB VAL 9 HB VAL 9 -0.597 -8.597 -7.711
81 1HG1 VAL 9 1HG1 VAL 9 0.484 -5.857 -7.146
82 2HG1 VAL 9 2HG1 VAL 9 -1.222 -6.122 -7.504
83 3HG1 VAL 9 3HG1 VAL 9 0.007 -6.563 -8.690
84 1HG2 VAL 9 1HG2 VAL 9 1.922 -7.442 -6.648
85 2HG2 VAL 9 2HG2 VAL 9 1.671 -8.811 -7.732
86 3HG2 VAL 9 3HG2 VAL 9 1.393 -8.994 -6.000
87 H CYS 10 H CYS 10 -1.591 -5.573 -5.186
88 HA CYS 10 HA CYS 10 0.761 -4.928 -3.599
89 1HB CYS 10 2HB CYS 10 -0.517 -3.445 -5.405
90 2HB CYS 10 1HB CYS 10 -1.453 -2.972 -3.991
91 H ALA 11 H ALA 11 -2.722 -4.283 -3.161
92 HA ALA 11 HA ALA 11 -2.545 -3.920 -0.377
93 1HB ALA 11 1HB ALA 11 -4.461 -3.453 -2.219
94 2HB ALA 11 2HB ALA 11 -4.746 -3.447 -0.478
95 3HB ALA 11 3HB ALA 11 -5.122 -4.885 -1.428
96 H ALA 12 H ALA 12 -3.553 -6.735 -2.300
97 HA ALA 12 HA ALA 12 -3.830 -8.371 0.075
98 1HB ALA 12 1HB ALA 12 -3.904 -9.601 -2.617
99 2HB ALA 12 2HB ALA 12 -5.159 -8.424 -2.230
100 3HB ALA 12 3HB ALA 12 -4.952 -9.855 -1.221
101 H ALA 13 H ALA 13 -1.177 -7.343 -0.401
102 HA ALA 13 HA ALA 13 0.319 -9.710 -1.251
103 1HB ALA 13 1HB ALA 13 1.845 -7.337 -0.457
104 2HB ALA 13 2HB ALA 13 0.734 -7.081 -1.804
105 3HB ALA 13 3HB ALA 13 1.968 -8.338 -1.905
106 H ALA 14 H ALA 14 -0.969 -8.557 1.548
107 HA ALA 14 HA ALA 14 -0.606 -8.928 3.762
108 1HB ALA 14 1HB ALA 14 1.362 -11.075 3.313
109 2HB ALA 14 2HB ALA 14 -0.202 -11.285 2.527
110 3HB ALA 14 3HB ALA 14 -0.115 -11.069 4.275
111 H ASN 15 H ASN 15 1.156 -7.070 2.349
112 HA ASN 15 HA ASN 15 3.251 -6.933 4.370
113 1HB ASN 15 2HB ASN 15 3.934 -8.024 2.002
114 2HB ASN 15 1HB ASN 15 4.167 -6.322 1.617
115 1HD2 ASN 15 1HD2 ASN 15 6.337 -7.777 1.484
116 2HD2 ASN 15 2HD2 ASN 15 7.375 -7.530 2.841
117 H VAL 16 H VAL 16 2.753 -5.044 5.287
118 HA VAL 16 HA VAL 16 1.523 -2.882 3.919
119 HB VAL 16 HB VAL 16 2.998 -2.730 6.548
120 1HG1 VAL 16 1HG1 VAL 16 0.849 -1.063 5.263
121 2HG1 VAL 16 2HG1 VAL 16 2.461 -0.559 5.771
122 3HG1 VAL 16 3HG1 VAL 16 1.242 -0.969 6.979
123 1HG2 VAL 16 1HG2 VAL 16 0.462 -4.041 5.834
124 2HG2 VAL 16 2HG2 VAL 16 0.397 -2.983 7.243
125 3HG2 VAL 16 3HG2 VAL 16 1.544 -4.322 7.199
126 H ALA 17 H ALA 17 4.835 -3.414 5.100
127 HA ALA 17 HA ALA 17 5.904 -0.955 4.305
128 1HB ALA 17 1HB ALA 17 7.052 -2.485 5.828
129 2HB ALA 17 2HB ALA 17 8.086 -2.033 4.473
130 3HB ALA 17 3HB ALA 17 7.311 -3.616 4.501
131 H ALA 18 H ALA 18 5.730 -4.050 2.574
132 HA ALA 18 HA ALA 18 7.152 -3.318 0.290
133 1HB ALA 18 1HB ALA 18 6.343 -5.255 -0.694
134 2HB ALA 18 2HB ALA 18 4.785 -5.142 0.126
135 3HB ALA 18 3HB ALA 18 6.224 -5.621 1.027
136 H HIS 19 H HIS 19 3.776 -2.812 1.149
137 HA HIS 19 HA HIS 19 3.027 -1.792 -1.420
138 1HB HIS 19 2HB HIS 19 1.163 -2.604 -0.349
139 2HB HIS 19 1HB HIS 19 1.721 -2.097 1.240
140 HD2 HIS 19 2HD HIS 19 0.612 0.181 2.173
141 HE1 HIS 19 1HE HIS 19 -1.132 1.429 -1.466
142 HE2 HIS 19 2HE HIS 19 -1.086 1.783 1.048
143 H MET 20 H MET 20 3.296 -0.214 1.774
144 HA MET 20 HA MET 20 2.980 2.396 1.037
145 1HB MET 20 2HB MET 20 3.214 1.644 3.362
146 2HB MET 20 1HB MET 20 4.927 1.346 3.096
147 1HG MET 20 2HG MET 20 3.843 4.064 2.566
148 2HG MET 20 1HG MET 20 4.092 3.549 4.234
149 1HE MET 20 1HE MET 20 5.691 5.161 4.960
150 2HE MET 20 2HE MET 20 5.815 6.112 3.481
151 3HE MET 20 3HE MET 20 7.275 5.515 4.269
152 H THR 21 H THR 21 6.016 0.548 0.945
153 HA THR 21 HA THR 21 7.725 2.616 0.197
154 HB THR 21 HB THR 21 8.462 0.352 0.883
155 HG1 THR 21 1HG THR 21 10.118 1.308 -0.042
156 1HG2 THR 21 1HG2 THR 21 8.656 -1.092 -1.424
157 2HG2 THR 21 2HG2 THR 21 7.018 -0.445 -1.515
158 3HG2 THR 21 3HG2 THR 21 7.515 -1.396 -0.115
159 H HIS 22 H HIS 22 5.325 0.946 -1.642
160 HA HIS 22 HA HIS 22 6.226 2.309 -4.070
161 1HB HIS 22 2HB HIS 22 6.209 0.281 -5.029
162 2HB HIS 22 1HB HIS 22 5.508 -0.442 -3.589
163 HD1 HIS 22 1HD HIS 22 4.867 -0.188 -7.024
164 HD2 HIS 22 2HD HIS 22 2.463 0.210 -3.644
165 HE1 HIS 22 1HE HIS 22 2.511 -0.540 -7.826
166 HE2 HIS 22 2HE HIS 22 1.074 -0.226 -5.782
167 H CYS 23 H CYS 23 4.091 2.646 -1.690
168 HA CYS 23 HA CYS 23 2.143 3.973 -3.412
169 1HB CYS 23 2HB CYS 23 1.712 1.644 -1.649
170 2HB CYS 23 1HB CYS 23 0.519 2.919 -1.510
171 H ALA 24 H ALA 24 4.297 4.903 -1.644
172 HA ALA 24 HA ALA 24 3.351 5.793 0.836
173 1HB ALA 24 1HB ALA 24 5.642 5.955 0.616
174 2HB ALA 24 2HB ALA 24 5.145 7.637 0.437
175 3HB ALA 24 3HB ALA 24 5.543 6.679 -0.989
176 H LYS 25 H LYS 25 3.088 8.173 1.389
177 HA LYS 25 HA LYS 25 0.835 9.181 -0.021
178 1HB LYS 25 2HB LYS 25 2.533 10.313 2.200
179 2HB LYS 25 1HB LYS 25 1.152 11.172 1.533
180 1HG LYS 25 2HG LYS 25 0.659 8.392 2.378
181 2HG LYS 25 1HG LYS 25 1.011 9.550 3.662
182 1HD LYS 25 2HD LYS 25 -0.748 11.034 2.489
183 2HD LYS 25 1HD LYS 25 -1.249 9.541 1.694
184 1HE LYS 25 2HE LYS 25 -1.674 8.498 3.829
185 2HE LYS 25 1HE LYS 25 -1.048 9.911 4.679
186 1HZ LYS 25 1HZ LYS 25 -2.906 11.134 4.205
187 2HZ LYS 25 2HZ LYS 25 -3.595 9.595 4.339
188 3HZ LYS 25 3HZ LYS 25 -3.287 10.252 2.812
Start of MODEL 10
1 1H ARG 1 1HT ARG 1 -0.859 0.752 7.957
2 2H ARG 1 2HT ARG 1 -1.920 1.004 9.282
3 3H ARG 1 3HT ARG 1 -2.186 1.825 7.799
4 HA ARG 1 HA ARG 1 -2.355 -1.078 8.257
5 1HB ARG 1 2HB ARG 1 -4.136 0.603 9.151
6 2HB ARG 1 1HB ARG 1 -4.583 0.773 7.459
7 1HG ARG 1 2HG ARG 1 -6.006 -0.892 7.996
8 2HG ARG 1 1HG ARG 1 -4.597 -1.889 7.624
9 1HD ARG 1 2HD ARG 1 -4.149 -2.320 9.843
10 2HD ARG 1 1HD ARG 1 -4.966 -0.861 10.400
11 HE ARG 1 HE ARG 1 -6.922 -2.462 9.293
12 1HH1 ARG 1 1HH1 ARG 1 -4.629 -2.691 11.915
13 2HH1 ARG 1 2HH1 ARG 1 -5.632 -3.735 12.866
14 1HH2 ARG 1 1HH2 ARG 1 -8.241 -3.835 10.543
15 2HH2 ARG 1 2HH2 ARG 1 -7.681 -4.385 12.088
16 H VAL 2 H VAL 2 -2.413 -2.320 6.469
17 HA VAL 2 HA VAL 2 -1.983 -0.998 3.901
18 HB VAL 2 HB VAL 2 -0.399 -2.754 4.561
19 1HG1 VAL 2 1HG1 VAL 2 -1.531 -4.289 5.861
20 2HG1 VAL 2 2HG1 VAL 2 -1.354 -5.163 4.341
21 3HG1 VAL 2 3HG1 VAL 2 -2.889 -4.396 4.743
22 1HG2 VAL 2 1HG2 VAL 2 -1.917 -2.701 2.098
23 2HG2 VAL 2 2HG2 VAL 2 -1.252 -4.303 2.417
24 3HG2 VAL 2 3HG2 VAL 2 -0.183 -2.903 2.351
25 H ILE 3 H ILE 3 -4.551 -0.674 4.720
26 HA ILE 3 HA ILE 3 -6.036 -2.508 2.954
27 HB ILE 3 HB ILE 3 -6.598 -2.888 5.336
28 1HG1 ILE 3 2HG1 ILE 3 -9.035 -1.610 4.192
29 2HG1 ILE 3 1HG1 ILE 3 -8.262 -2.885 3.255
30 1HG2 ILE 3 1HG2 ILE 3 -6.206 -0.483 5.992
31 2HG2 ILE 3 2HG2 ILE 3 -7.634 -1.251 6.687
32 3HG2 ILE 3 3HG2 ILE 3 -7.804 -0.134 5.332
33 1HD1 ILE 3 1HD1 ILE 3 -9.858 -3.043 5.688
34 2HD1 ILE 3 2HD1 ILE 3 -8.375 -3.997 5.740
35 3HD1 ILE 3 3HD1 ILE 3 -9.546 -4.258 4.448
36 H ALA 4 H ALA 4 -4.768 0.050 2.338
37 HA ALA 4 HA ALA 4 -7.145 1.692 1.760
38 1HB ALA 4 1HB ALA 4 -4.356 2.373 2.464
39 2HB ALA 4 2HB ALA 4 -5.865 3.197 2.864
40 3HB ALA 4 3HB ALA 4 -5.146 3.400 1.266
41 H CYS 5 H CYS 5 -4.364 0.079 0.397
42 HA CYS 5 HA CYS 5 -4.337 1.210 -2.155
43 1HB CYS 5 2HB CYS 5 -2.710 -0.487 -1.030
44 2HB CYS 5 1HB CYS 5 -3.769 -1.707 -1.727
45 H PHE 6 H PHE 6 -5.038 0.206 -4.193
46 HA PHE 6 HA PHE 6 -7.628 -1.171 -3.893
47 1HB PHE 6 2HB PHE 6 -8.224 -0.004 -6.082
48 2HB PHE 6 1HB PHE 6 -8.150 1.010 -4.645
49 HD1 PHE 6 1HD PHE 6 -6.927 0.479 -7.957
50 HD2 PHE 6 2HD PHE 6 -6.042 2.361 -4.244
51 HE1 PHE 6 1HE PHE 6 -5.328 1.963 -9.095
52 HE2 PHE 6 2HE PHE 6 -4.442 3.849 -5.375
53 HZ PHE 6 HZ PHE 6 -4.083 3.651 -7.804
54 H LEU 7 H LEU 7 -5.083 -2.451 -4.189
55 HA LEU 7 HA LEU 7 -5.527 -3.771 -6.781
56 1HB LEU 7 2HB LEU 7 -2.781 -3.440 -5.612
57 2HB LEU 7 1HB LEU 7 -3.224 -3.894 -7.245
58 HG LEU 7 HG LEU 7 -3.891 -1.167 -6.188
59 1HD1 LEU 7 1HD1 LEU 7 -1.528 -1.403 -5.785
60 2HD1 LEU 7 2HD1 LEU 7 -1.779 -0.371 -7.193
61 3HD1 LEU 7 3HD1 LEU 7 -1.280 -2.048 -7.407
62 1HD2 LEU 7 1HD2 LEU 7 -4.243 -0.601 -8.378
63 2HD2 LEU 7 2HD2 LEU 7 -4.718 -2.299 -8.413
64 3HD2 LEU 7 3HD2 LEU 7 -3.123 -1.819 -8.989
65 H LYS 8 H LYS 8 -4.550 -5.976 -6.862
66 HA LYS 8 HA LYS 8 -5.161 -7.369 -4.386
67 1HB LYS 8 2HB LYS 8 -4.789 -8.193 -7.242
68 2HB LYS 8 1HB LYS 8 -4.682 -9.400 -5.968
69 1HG LYS 8 2HG LYS 8 -6.935 -8.808 -5.222
70 2HG LYS 8 1HG LYS 8 -7.040 -7.607 -6.510
71 1HD LYS 8 2HD LYS 8 -6.494 -10.515 -7.052
72 2HD LYS 8 1HD LYS 8 -8.131 -9.862 -6.953
73 1HE LYS 8 2HE LYS 8 -6.247 -8.403 -8.697
74 2HE LYS 8 1HE LYS 8 -6.718 -10.014 -9.239
75 1HZ LYS 8 1HZ LYS 8 -8.122 -7.903 -9.850
76 2HZ LYS 8 2HZ LYS 8 -8.826 -8.192 -8.341
77 3HZ LYS 8 3HZ LYS 8 -8.870 -9.387 -9.537
78 H VAL 9 H VAL 9 -2.528 -7.506 -6.792
79 HA VAL 9 HA VAL 9 -0.765 -9.011 -5.222
80 HB VAL 9 HB VAL 9 -0.474 -8.718 -7.643
81 1HG1 VAL 9 1HG1 VAL 9 -0.997 -6.149 -7.358
82 2HG1 VAL 9 2HG1 VAL 9 0.003 -6.741 -8.685
83 3HG1 VAL 9 3HG1 VAL 9 0.760 -6.041 -7.255
84 1HG2 VAL 9 1HG2 VAL 9 1.967 -8.413 -7.646
85 2HG2 VAL 9 2HG2 VAL 9 1.427 -9.452 -6.328
86 3HG2 VAL 9 3HG2 VAL 9 1.878 -7.777 -6.004
87 H CYS 10 H CYS 10 -1.506 -5.615 -5.221
88 HA CYS 10 HA CYS 10 0.816 -4.941 -3.609
89 1HB CYS 10 2HB CYS 10 -0.436 -3.489 -5.445
90 2HB CYS 10 1HB CYS 10 -1.413 -3.010 -4.062
91 H ALA 11 H ALA 11 -2.682 -4.350 -3.214
92 HA ALA 11 HA ALA 11 -2.531 -3.930 -0.433
93 1HB ALA 11 1HB ALA 11 -4.738 -3.486 -0.555
94 2HB ALA 11 2HB ALA 11 -5.086 -4.936 -1.499
95 3HB ALA 11 3HB ALA 11 -4.434 -3.502 -2.292
96 H ALA 12 H ALA 12 -3.503 -6.782 -2.320
97 HA ALA 12 HA ALA 12 -3.775 -8.385 0.078
98 1HB ALA 12 1HB ALA 12 -3.825 -9.686 -2.573
99 2HB ALA 12 2HB ALA 12 -5.072 -8.478 -2.261
100 3HB ALA 12 3HB ALA 12 -4.908 -9.872 -1.193
101 H ALA 13 H ALA 13 -1.128 -7.341 -0.404
102 HA ALA 13 HA ALA 13 0.398 -9.688 -1.240
103 1HB ALA 13 1HB ALA 13 1.888 -7.313 -0.387
104 2HB ALA 13 2HB ALA 13 0.798 -7.048 -1.748
105 3HB ALA 13 3HB ALA 13 2.045 -8.292 -1.847
106 H ALA 14 H ALA 14 -0.951 -8.604 1.553
107 HA ALA 14 HA ALA 14 -0.624 -9.016 3.766
108 1HB ALA 14 1HB ALA 14 0.055 -11.135 4.309
109 2HB ALA 14 2HB ALA 14 1.391 -11.122 3.158
110 3HB ALA 14 3HB ALA 14 -0.262 -11.342 2.586
111 H ASN 15 H ASN 15 1.120 -7.090 2.418
112 HA ASN 15 HA ASN 15 3.141 -6.901 4.502
113 1HB ASN 15 2HB ASN 15 3.964 -8.049 2.225
114 2HB ASN 15 1HB ASN 15 4.149 -6.361 1.756
115 1HD2 ASN 15 1HD2 ASN 15 6.401 -7.536 1.710
116 2HD2 ASN 15 2HD2 ASN 15 7.370 -7.256 3.113
117 H VAL 16 H VAL 16 2.749 -4.967 5.345
118 HA VAL 16 HA VAL 16 1.485 -2.860 3.896
119 HB VAL 16 HB VAL 16 2.908 -2.608 6.545
120 1HG1 VAL 16 1HG1 VAL 16 0.909 -0.944 6.805
121 2HG1 VAL 16 2HG1 VAL 16 0.910 -0.977 5.042
122 3HG1 VAL 16 3HG1 VAL 16 2.355 -0.463 5.915
123 1HG2 VAL 16 1HG2 VAL 16 0.271 -2.895 7.169
124 2HG2 VAL 16 2HG2 VAL 16 1.476 -4.180 7.264
125 3HG2 VAL 16 3HG2 VAL 16 0.449 -4.039 5.838
126 H ALA 17 H ALA 17 4.786 -3.425 5.060
127 HA ALA 17 HA ALA 17 5.875 -0.958 4.288
128 1HB ALA 17 1HB ALA 17 7.386 -3.559 4.323
129 2HB ALA 17 2HB ALA 17 6.923 -2.697 5.791
130 3HB ALA 17 3HB ALA 17 8.003 -1.934 4.624
131 H ALA 18 H ALA 18 5.724 -4.059 2.558
132 HA ALA 18 HA ALA 18 7.132 -3.322 0.272
133 1HB ALA 18 1HB ALA 18 6.190 -5.219 -0.783
134 2HB ALA 18 2HB ALA 18 4.771 -5.186 0.265
135 3HB ALA 18 3HB ALA 18 6.345 -5.631 0.925
136 H HIS 19 H HIS 19 3.753 -2.827 1.127
137 HA HIS 19 HA HIS 19 3.006 -1.804 -1.441
138 1HB HIS 19 2HB HIS 19 1.144 -2.629 -0.374
139 2HB HIS 19 1HB HIS 19 1.694 -2.117 1.217
140 HD2 HIS 19 2HD HIS 19 0.559 0.147 2.146
141 HE1 HIS 19 1HE HIS 19 -1.164 1.394 -1.503
142 HE2 HIS 19 2HE HIS 19 -0.853 1.956 0.948
143 H MET 20 H MET 20 3.261 -0.234 1.757
144 HA MET 20 HA MET 20 2.935 2.378 1.022
145 1HB MET 20 2HB MET 20 4.651 1.133 3.153
146 2HB MET 20 1HB MET 20 4.563 2.877 2.960
147 1HG MET 20 2HG MET 20 2.030 2.582 3.128
148 2HG MET 20 1HG MET 20 2.393 0.966 3.734
149 1HE MET 20 1HE MET 20 0.820 3.295 5.897
150 2HE MET 20 2HE MET 20 1.349 4.102 4.421
151 3HE MET 20 3HE MET 20 1.942 4.652 5.989
152 H THR 21 H THR 21 5.978 0.541 0.939
153 HA THR 21 HA THR 21 7.686 2.615 0.211
154 HB THR 21 HB THR 21 8.426 0.350 0.885
155 HG1 THR 21 1HG THR 21 10.132 0.239 -0.637
156 1HG2 THR 21 1HG2 THR 21 8.626 -1.086 -1.427
157 2HG2 THR 21 2HG2 THR 21 6.988 -0.439 -1.519
158 3HG2 THR 21 3HG2 THR 21 7.483 -1.394 -0.121
159 H HIS 22 H HIS 22 5.296 0.955 -1.650
160 HA HIS 22 HA HIS 22 6.203 2.340 -4.064
161 1HB HIS 22 2HB HIS 22 6.204 0.322 -5.042
162 2HB HIS 22 1HB HIS 22 5.508 -0.420 -3.610
163 HD1 HIS 22 1HD HIS 22 4.871 -0.155 -7.041
164 HD2 HIS 22 2HD HIS 22 2.456 0.217 -3.666
165 HE1 HIS 22 1HE HIS 22 2.519 -0.519 -7.850
166 HE2 HIS 22 2HE HIS 22 1.075 -0.224 -5.809
167 H CYS 23 H CYS 23 4.053 2.645 -1.693
168 HA CYS 23 HA CYS 23 2.105 3.969 -3.416
169 1HB CYS 23 2HB CYS 23 1.681 1.628 -1.667
170 2HB CYS 23 1HB CYS 23 0.480 2.895 -1.529
171 H ALA 24 H ALA 24 3.188 5.875 -2.588
172 HA ALA 24 HA ALA 24 2.958 6.423 0.258
173 1HB ALA 24 1HB ALA 24 5.000 7.110 -0.810
174 2HB ALA 24 2HB ALA 24 4.106 8.547 -0.316
175 3HB ALA 24 3HB ALA 24 4.107 8.048 -2.007
176 H LYS 25 H LYS 25 2.155 8.686 0.848
177 HA LYS 25 HA LYS 25 -0.077 9.581 -0.807
178 1HB LYS 25 2HB LYS 25 -0.914 7.849 0.827
179 2HB LYS 25 1HB LYS 25 -0.459 8.949 2.120
180 1HG LYS 25 2HG LYS 25 -2.201 10.027 -0.015
181 2HG LYS 25 1HG LYS 25 -2.911 8.860 1.103
182 1HD LYS 25 2HD LYS 25 -1.313 11.132 2.193
183 2HD LYS 25 1HD LYS 25 -2.960 11.431 1.633
184 1HE LYS 25 2HE LYS 25 -3.341 9.209 3.119
185 2HE LYS 25 1HE LYS 25 -1.992 9.942 3.985
186 1HZ LYS 25 1HZ LYS 25 -4.476 10.564 4.520
187 2HZ LYS 25 2HZ LYS 25 -4.241 11.665 3.257
188 3HZ LYS 25 3HZ LYS 25 -3.238 11.715 4.620
Start of MODEL 11
1 1H ARG 1 1HT ARG 1 -1.004 0.847 7.879
2 2H ARG 1 2HT ARG 1 -2.060 0.992 9.224
3 3H ARG 1 3HT ARG 1 -2.445 1.766 7.741
4 HA ARG 1 HA ARG 1 -2.276 -1.135 8.213
5 1HB ARG 1 2HB ARG 1 -4.562 0.810 7.895
6 2HB ARG 1 1HB ARG 1 -4.761 -0.926 7.709
7 1HG ARG 1 2HG ARG 1 -3.550 -0.877 10.097
8 2HG ARG 1 1HG ARG 1 -4.365 0.688 10.143
9 1HD ARG 1 2HD ARG 1 -6.453 -0.245 10.116
10 2HD ARG 1 1HD ARG 1 -5.920 -1.677 9.236
11 HE ARG 1 HE ARG 1 -4.868 -1.501 11.905
12 1HH1 ARG 1 1HH1 ARG 1 -7.563 -2.562 9.958
13 2HH1 ARG 1 2HH1 ARG 1 -8.084 -3.750 11.105
14 1HH2 ARG 1 1HH2 ARG 1 -5.554 -3.062 13.415
15 2HH2 ARG 1 2HH2 ARG 1 -6.945 -4.034 13.067
16 H VAL 2 H VAL 2 -2.387 -2.410 6.426
17 HA VAL 2 HA VAL 2 -2.068 -1.066 3.851
18 HB VAL 2 HB VAL 2 -0.391 -2.746 4.466
19 1HG1 VAL 2 1HG1 VAL 2 -1.193 -4.443 5.705
20 2HG1 VAL 2 2HG1 VAL 2 -1.473 -5.205 4.140
21 3HG1 VAL 2 3HG1 VAL 2 -2.791 -4.370 4.963
22 1HG2 VAL 2 1HG2 VAL 2 -2.015 -2.830 2.052
23 2HG2 VAL 2 2HG2 VAL 2 -1.169 -4.346 2.360
24 3HG2 VAL 2 3HG2 VAL 2 -0.261 -2.840 2.238
25 H ILE 3 H ILE 3 -4.600 -0.761 4.572
26 HA ILE 3 HA ILE 3 -6.042 -2.689 2.880
27 HB ILE 3 HB ILE 3 -6.553 -3.116 5.264
28 1HG1 ILE 3 2HG1 ILE 3 -9.093 -1.965 4.280
29 2HG1 ILE 3 1HG1 ILE 3 -8.269 -3.054 3.167
30 1HG2 ILE 3 1HG2 ILE 3 -6.792 -0.250 5.323
31 2HG2 ILE 3 2HG2 ILE 3 -6.712 -1.398 6.659
32 3HG2 ILE 3 3HG2 ILE 3 -8.267 -1.008 5.924
33 1HD1 ILE 3 1HD1 ILE 3 -9.458 -3.619 5.839
34 2HD1 ILE 3 2HD1 ILE 3 -8.140 -4.624 5.235
35 3HD1 ILE 3 3HD1 ILE 3 -9.640 -4.489 4.316
36 H ALA 4 H ALA 4 -4.894 -0.042 2.313
37 HA ALA 4 HA ALA 4 -7.361 1.460 1.732
38 1HB ALA 4 1HB ALA 4 -5.515 3.326 1.330
39 2HB ALA 4 2HB ALA 4 -4.618 2.316 2.464
40 3HB ALA 4 3HB ALA 4 -6.180 2.991 2.929
41 H CYS 5 H CYS 5 -4.449 0.072 0.394
42 HA CYS 5 HA CYS 5 -4.453 1.257 -2.133
43 1HB CYS 5 2HB CYS 5 -2.713 -0.315 -1.033
44 2HB CYS 5 1HB CYS 5 -3.681 -1.618 -1.712
45 H PHE 6 H PHE 6 -5.087 0.325 -4.196
46 HA PHE 6 HA PHE 6 -7.583 -1.227 -3.978
47 1HB PHE 6 2HB PHE 6 -8.346 -0.086 -6.007
48 2HB PHE 6 1HB PHE 6 -7.952 1.078 -4.747
49 HD1 PHE 6 1HD PHE 6 -7.333 0.026 -8.104
50 HD2 PHE 6 2HD PHE 6 -5.710 2.250 -4.860
51 HE1 PHE 6 1HE PHE 6 -5.826 1.191 -9.662
52 HE2 PHE 6 2HE PHE 6 -4.200 3.420 -6.411
53 HZ PHE 6 HZ PHE 6 -4.258 2.892 -8.815
54 H LEU 7 H LEU 7 -4.932 -2.349 -4.197
55 HA LEU 7 HA LEU 7 -5.239 -3.724 -6.781
56 1HB LEU 7 2HB LEU 7 -2.765 -2.600 -5.519
57 2HB LEU 7 1HB LEU 7 -2.653 -3.990 -6.582
58 HG LEU 7 HG LEU 7 -4.040 -1.494 -7.499
59 1HD1 LEU 7 1HD1 LEU 7 -1.547 -1.265 -6.580
60 2HD1 LEU 7 2HD1 LEU 7 -2.127 -0.390 -7.997
61 3HD1 LEU 7 3HD1 LEU 7 -1.191 -1.872 -8.196
62 1HD2 LEU 7 1HD2 LEU 7 -2.381 -3.260 -9.215
63 2HD2 LEU 7 2HD2 LEU 7 -3.866 -2.385 -9.589
64 3HD2 LEU 7 3HD2 LEU 7 -3.934 -3.877 -8.651
65 H LYS 8 H LYS 8 -4.904 -5.922 -6.784
66 HA LYS 8 HA LYS 8 -5.255 -7.273 -4.306
67 1HB LYS 8 2HB LYS 8 -4.494 -8.517 -6.949
68 2HB LYS 8 1HB LYS 8 -5.309 -9.293 -5.598
69 1HG LYS 8 2HG LYS 8 -7.328 -8.451 -6.153
70 2HG LYS 8 1HG LYS 8 -6.655 -6.933 -6.748
71 1HD LYS 8 2HD LYS 8 -5.679 -8.606 -8.603
72 2HD LYS 8 1HD LYS 8 -7.147 -9.483 -8.166
73 1HE LYS 8 2HE LYS 8 -8.533 -7.698 -8.798
74 2HE LYS 8 1HE LYS 8 -7.192 -6.552 -8.815
75 1HZ LYS 8 1HZ LYS 8 -7.052 -8.823 -10.649
76 2HZ LYS 8 2HZ LYS 8 -6.514 -7.232 -10.855
77 3HZ LYS 8 3HZ LYS 8 -8.158 -7.595 -11.015
78 H VAL 9 H VAL 9 -2.615 -7.431 -6.703
79 HA VAL 9 HA VAL 9 -0.866 -8.939 -5.111
80 HB VAL 9 HB VAL 9 -0.571 -8.685 -7.535
81 1HG1 VAL 9 1HG1 VAL 9 0.130 -5.845 -6.826
82 2HG1 VAL 9 2HG1 VAL 9 -1.155 -6.408 -7.894
83 3HG1 VAL 9 3HG1 VAL 9 0.534 -6.593 -8.371
84 1HG2 VAL 9 1HG2 VAL 9 1.661 -9.021 -7.433
85 2HG2 VAL 9 2HG2 VAL 9 1.370 -8.972 -5.695
86 3HG2 VAL 9 3HG2 VAL 9 1.954 -7.534 -6.533
87 H CYS 10 H CYS 10 -1.573 -5.532 -5.177
88 HA CYS 10 HA CYS 10 0.752 -4.839 -3.586
89 1HB CYS 10 2HB CYS 10 -0.565 -3.415 -5.419
90 2HB CYS 10 1HB CYS 10 -1.477 -2.910 -4.000
91 H ALA 11 H ALA 11 -2.752 -4.306 -3.154
92 HA ALA 11 HA ALA 11 -2.566 -3.838 -0.379
93 1HB ALA 11 1HB ALA 11 -4.797 -3.462 -0.456
94 2HB ALA 11 2HB ALA 11 -5.115 -4.888 -1.444
95 3HB ALA 11 3HB ALA 11 -4.489 -3.419 -2.192
96 H ALA 12 H ALA 12 -3.552 -6.720 -2.216
97 HA ALA 12 HA ALA 12 -3.754 -8.300 0.204
98 1HB ALA 12 1HB ALA 12 -4.892 -9.820 -1.028
99 2HB ALA 12 2HB ALA 12 -3.859 -9.616 -2.442
100 3HB ALA 12 3HB ALA 12 -5.115 -8.429 -2.090
101 H ALA 13 H ALA 13 -1.126 -7.244 -0.350
102 HA ALA 13 HA ALA 13 0.404 -9.567 -1.232
103 1HB ALA 13 1HB ALA 13 1.896 -7.212 -0.337
104 2HB ALA 13 2HB ALA 13 0.779 -6.907 -1.667
105 3HB ALA 13 3HB ALA 13 2.026 -8.143 -1.830
106 H ALA 14 H ALA 14 -0.920 -8.565 1.604
107 HA ALA 14 HA ALA 14 -0.562 -9.027 3.802
108 1HB ALA 14 1HB ALA 14 0.707 -11.096 4.302
109 2HB ALA 14 2HB ALA 14 1.182 -11.176 2.606
110 3HB ALA 14 3HB ALA 14 -0.519 -11.314 3.053
111 H ASN 15 H ASN 15 1.156 -7.060 2.487
112 HA ASN 15 HA ASN 15 3.166 -6.871 4.565
113 1HB ASN 15 2HB ASN 15 4.025 -8.091 2.345
114 2HB ASN 15 1HB ASN 15 4.230 -6.422 1.822
115 1HD2 ASN 15 1HD2 ASN 15 4.699 -8.109 4.909
116 2HD2 ASN 15 2HD2 ASN 15 6.333 -7.594 5.136
117 H VAL 16 H VAL 16 2.670 -4.932 5.356
118 HA VAL 16 HA VAL 16 1.497 -2.843 3.836
119 HB VAL 16 HB VAL 16 2.877 -2.587 6.510
120 1HG1 VAL 16 1HG1 VAL 16 1.064 -0.852 4.908
121 2HG1 VAL 16 2HG1 VAL 16 2.468 -0.422 5.885
122 3HG1 VAL 16 3HG1 VAL 16 0.937 -0.817 6.667
123 1HG2 VAL 16 1HG2 VAL 16 -0.047 -2.825 6.449
124 2HG2 VAL 16 2HG2 VAL 16 1.128 -3.526 7.563
125 3HG2 VAL 16 3HG2 VAL 16 0.822 -4.295 6.005
126 H ALA 17 H ALA 17 4.782 -3.420 5.038
127 HA ALA 17 HA ALA 17 5.914 -0.985 4.243
128 1HB ALA 17 1HB ALA 17 6.952 -3.671 4.937
129 2HB ALA 17 2HB ALA 17 7.350 -2.091 5.611
130 3HB ALA 17 3HB ALA 17 8.035 -2.588 4.065
131 H ALA 18 H ALA 18 5.672 -4.083 2.521
132 HA ALA 18 HA ALA 18 7.100 -3.387 0.230
133 1HB ALA 18 1HB ALA 18 6.083 -5.254 -0.828
134 2HB ALA 18 2HB ALA 18 4.698 -5.202 0.263
135 3HB ALA 18 3HB ALA 18 6.284 -5.677 0.872
136 H HIS 19 H HIS 19 3.728 -2.828 1.084
137 HA HIS 19 HA HIS 19 3.007 -1.783 -1.483
138 1HB HIS 19 2HB HIS 19 1.123 -2.570 -0.430
139 2HB HIS 19 1HB HIS 19 1.681 -2.092 1.166
140 HD2 HIS 19 2HD HIS 19 0.614 0.198 2.120
141 HE1 HIS 19 1HE HIS 19 -1.111 1.506 -1.507
142 HE2 HIS 19 2HE HIS 19 -0.767 2.046 0.945
143 H MET 20 H MET 20 3.298 -0.233 1.723
144 HA MET 20 HA MET 20 3.014 2.388 1.005
145 1HB MET 20 2HB MET 20 3.358 1.391 3.327
146 2HB MET 20 1HB MET 20 5.083 1.507 3.009
147 1HG MET 20 2HG MET 20 4.883 3.510 3.980
148 2HG MET 20 1HG MET 20 4.300 4.014 2.393
149 1HE MET 20 1HE MET 20 1.884 3.552 6.245
150 2HE MET 20 2HE MET 20 3.635 3.686 6.075
151 3HE MET 20 3HE MET 20 2.818 2.184 5.642
152 H THR 21 H THR 21 6.023 0.498 0.893
153 HA THR 21 HA THR 21 7.761 2.550 0.165
154 HB THR 21 HB THR 21 8.469 0.270 0.831
155 HG1 THR 21 1HG THR 21 10.186 1.060 -0.076
156 1HG2 THR 21 1HG2 THR 21 7.009 -0.488 -1.569
157 2HG2 THR 21 2HG2 THR 21 7.498 -1.457 -0.179
158 3HG2 THR 21 3HG2 THR 21 8.639 -1.156 -1.491
159 H HIS 22 H HIS 22 5.340 0.927 -1.689
160 HA HIS 22 HA HIS 22 6.259 2.299 -4.105
161 1HB HIS 22 2HB HIS 22 6.211 0.279 -5.079
162 2HB HIS 22 1HB HIS 22 5.496 -0.444 -3.647
163 HD1 HIS 22 1HD HIS 22 4.866 -0.149 -7.081
164 HD2 HIS 22 2HD HIS 22 2.464 0.257 -3.701
165 HE1 HIS 22 1HE HIS 22 2.506 -0.454 -7.890
166 HE2 HIS 22 2HE HIS 22 1.070 -0.138 -5.845
167 H CYS 23 H CYS 23 4.127 2.645 -1.721
168 HA CYS 23 HA CYS 23 2.201 4.018 -3.429
169 1HB CYS 23 2HB CYS 23 1.735 1.679 -1.689
170 2HB CYS 23 1HB CYS 23 0.562 2.972 -1.537
171 H ALA 24 H ALA 24 3.317 5.902 -2.603
172 HA ALA 24 HA ALA 24 3.449 6.477 0.179
173 1HB ALA 24 1HB ALA 24 4.649 7.525 -1.989
174 2HB ALA 24 2HB ALA 24 4.558 8.346 -0.431
175 3HB ALA 24 3HB ALA 24 3.406 8.744 -1.706
176 H LYS 25 H LYS 25 2.450 8.762 0.836
177 HA LYS 25 HA LYS 25 -0.384 8.800 0.056
178 1HB LYS 25 2HB LYS 25 0.251 7.649 2.340
179 2HB LYS 25 1HB LYS 25 0.367 9.309 2.904
180 1HG LYS 25 2HG LYS 25 -2.073 8.399 1.446
181 2HG LYS 25 1HG LYS 25 -1.861 8.012 3.155
182 1HD LYS 25 2HD LYS 25 -1.272 10.612 3.247
183 2HD LYS 25 1HD LYS 25 -2.335 10.626 1.839
184 1HE LYS 25 2HE LYS 25 -3.778 9.088 3.522
185 2HE LYS 25 1HE LYS 25 -2.948 10.127 4.679
186 1HZ LYS 25 1HZ LYS 25 -4.741 10.947 2.470
187 2HZ LYS 25 2HZ LYS 25 -3.747 12.041 3.290
188 3HZ LYS 25 3HZ LYS 25 -4.951 11.201 4.129
Start of MODEL 12
1 1H ARG 1 1HT ARG 1 -1.254 0.926 7.231
2 2H ARG 1 2HT ARG 1 -2.272 0.608 8.575
3 3H ARG 1 3HT ARG 1 -2.946 1.175 7.102
4 HA ARG 1 HA ARG 1 -1.568 -1.397 7.492
5 1HB ARG 1 2HB ARG 1 -4.386 -0.487 7.705
6 2HB ARG 1 1HB ARG 1 -4.116 -2.010 6.870
7 1HG ARG 1 2HG ARG 1 -4.289 -2.875 8.931
8 2HG ARG 1 1HG ARG 1 -2.598 -2.388 9.066
9 1HD ARG 1 2HD ARG 1 -3.182 -0.382 10.203
10 2HD ARG 1 1HD ARG 1 -4.895 -0.608 9.851
11 HE ARG 1 HE ARG 1 -3.411 -1.768 12.002
12 1HH1 ARG 1 1HH1 ARG 1 -6.138 -2.246 9.878
13 2HH1 ARG 1 2HH1 ARG 1 -6.975 -3.285 10.980
14 1HH2 ARG 1 1HH2 ARG 1 -4.511 -3.135 13.455
15 2HH2 ARG 1 2HH2 ARG 1 -6.052 -3.789 13.012
16 H VAL 2 H VAL 2 -2.248 -2.885 5.646
17 HA VAL 2 HA VAL 2 -1.817 -1.439 3.142
18 HB VAL 2 HB VAL 2 -0.295 -3.304 3.684
19 1HG1 VAL 2 1HG1 VAL 2 -2.476 -4.594 4.637
20 2HG1 VAL 2 2HG1 VAL 2 -0.953 -5.384 4.230
21 3HG1 VAL 2 3HG1 VAL 2 -2.281 -5.380 3.070
22 1HG2 VAL 2 1HG2 VAL 2 -1.227 -4.650 1.439
23 2HG2 VAL 2 2HG2 VAL 2 -0.099 -3.295 1.467
24 3HG2 VAL 2 3HG2 VAL 2 -1.824 -3.002 1.246
25 H ILE 3 H ILE 3 -4.372 -1.149 4.153
26 HA ILE 3 HA ILE 3 -6.002 -2.913 2.447
27 HB ILE 3 HB ILE 3 -6.595 -2.987 4.831
28 1HG1 ILE 3 2HG1 ILE 3 -8.892 -1.507 3.677
29 2HG1 ILE 3 1HG1 ILE 3 -8.290 -2.871 2.739
30 1HG2 ILE 3 1HG2 ILE 3 -5.963 -0.858 5.629
31 2HG2 ILE 3 2HG2 ILE 3 -7.717 -0.941 5.800
32 3HG2 ILE 3 3HG2 ILE 3 -7.002 -0.032 4.467
33 1HD1 ILE 3 1HD1 ILE 3 -9.794 -2.823 5.239
34 2HD1 ILE 3 2HD1 ILE 3 -8.433 -3.944 5.232
35 3HD1 ILE 3 3HD1 ILE 3 -9.687 -4.070 3.998
36 H ALA 4 H ALA 4 -5.156 0.393 3.166
37 HA ALA 4 HA ALA 4 -7.199 1.744 1.827
38 1HB ALA 4 1HB ALA 4 -4.413 2.395 2.612
39 2HB ALA 4 2HB ALA 4 -5.927 3.198 3.031
40 3HB ALA 4 3HB ALA 4 -5.205 3.449 1.442
41 H CYS 5 H CYS 5 -4.438 0.017 0.602
42 HA CYS 5 HA CYS 5 -4.196 1.150 -1.934
43 1HB CYS 5 2HB CYS 5 -2.709 -0.608 -0.791
44 2HB CYS 5 1HB CYS 5 -3.849 -1.797 -1.410
45 H PHE 6 H PHE 6 -4.847 0.198 -4.019
46 HA PHE 6 HA PHE 6 -7.604 -0.823 -3.875
47 1HB PHE 6 2HB PHE 6 -7.865 0.170 -6.158
48 2HB PHE 6 1HB PHE 6 -7.556 1.353 -4.891
49 HD1 PHE 6 1HD PHE 6 -6.200 -0.315 -7.848
50 HD2 PHE 6 2HD PHE 6 -5.480 2.577 -4.811
51 HE1 PHE 6 1HE PHE 6 -4.296 0.560 -9.138
52 HE2 PHE 6 2HE PHE 6 -3.576 3.459 -6.096
53 HZ PHE 6 HZ PHE 6 -2.983 2.450 -8.262
54 H LEU 7 H LEU 7 -4.423 -1.506 -4.968
55 HA LEU 7 HA LEU 7 -5.252 -3.436 -6.960
56 1HB LEU 7 2HB LEU 7 -2.609 -2.509 -5.891
57 2HB LEU 7 1HB LEU 7 -2.710 -3.965 -6.862
58 HG LEU 7 HG LEU 7 -3.809 -1.348 -7.850
59 1HD1 LEU 7 1HD1 LEU 7 -1.283 -1.382 -7.151
60 2HD1 LEU 7 2HD1 LEU 7 -1.786 -0.667 -8.682
61 3HD1 LEU 7 3HD1 LEU 7 -1.101 -2.291 -8.651
62 1HD2 LEU 7 1HD2 LEU 7 -2.967 -2.653 -10.013
63 2HD2 LEU 7 2HD2 LEU 7 -4.568 -2.904 -9.317
64 3HD2 LEU 7 3HD2 LEU 7 -3.265 -4.038 -8.962
65 H LYS 8 H LYS 8 -5.372 -5.602 -6.725
66 HA LYS 8 HA LYS 8 -5.612 -6.694 -4.120
67 1HB LYS 8 2HB LYS 8 -5.301 -8.311 -6.642
68 2HB LYS 8 1HB LYS 8 -6.181 -8.734 -5.181
69 1HG LYS 8 2HG LYS 8 -7.985 -8.101 -6.334
70 2HG LYS 8 1HG LYS 8 -7.465 -6.461 -5.942
71 1HD LYS 8 2HD LYS 8 -5.971 -6.983 -8.156
72 2HD LYS 8 1HD LYS 8 -7.444 -7.890 -8.508
73 1HE LYS 8 2HE LYS 8 -8.581 -5.643 -7.687
74 2HE LYS 8 1HE LYS 8 -7.036 -4.962 -8.198
75 1HZ LYS 8 1HZ LYS 8 -7.403 -6.104 -10.369
76 2HZ LYS 8 2HZ LYS 8 -8.504 -4.865 -10.037
77 3HZ LYS 8 3HZ LYS 8 -8.971 -6.481 -9.855
78 H VAL 9 H VAL 9 -3.228 -7.254 -6.710
79 HA VAL 9 HA VAL 9 -1.585 -9.019 -5.301
80 HB VAL 9 HB VAL 9 -1.395 -8.661 -7.723
81 1HG1 VAL 9 1HG1 VAL 9 -0.366 -5.963 -6.890
82 2HG1 VAL 9 2HG1 VAL 9 -1.688 -6.341 -7.995
83 3HG1 VAL 9 3HG1 VAL 9 -0.021 -6.662 -8.471
84 1HG2 VAL 9 1HG2 VAL 9 1.041 -8.724 -7.875
85 2HG2 VAL 9 2HG2 VAL 9 0.469 -9.672 -6.503
86 3HG2 VAL 9 3HG2 VAL 9 1.167 -8.075 -6.241
87 H CYS 10 H CYS 10 -1.849 -5.551 -5.163
88 HA CYS 10 HA CYS 10 0.617 -5.260 -3.655
89 1HB CYS 10 2HB CYS 10 -0.322 -3.576 -5.370
90 2HB CYS 10 1HB CYS 10 -1.430 -3.098 -4.089
91 H ALA 11 H ALA 11 -2.821 -4.481 -3.093
92 HA ALA 11 HA ALA 11 -2.552 -3.969 -0.344
93 1HB ALA 11 1HB ALA 11 -4.525 -3.553 -2.065
94 2HB ALA 11 2HB ALA 11 -4.808 -3.659 -0.328
95 3HB ALA 11 3HB ALA 11 -5.120 -5.056 -1.360
96 H ALA 12 H ALA 12 -3.528 -6.912 -2.077
97 HA ALA 12 HA ALA 12 -3.693 -8.424 0.389
98 1HB ALA 12 1HB ALA 12 -4.818 -9.991 -0.790
99 2HB ALA 12 2HB ALA 12 -3.788 -9.823 -2.212
100 3HB ALA 12 3HB ALA 12 -5.059 -8.640 -1.898
101 H ALA 13 H ALA 13 -1.086 -7.341 -0.212
102 HA ALA 13 HA ALA 13 0.473 -9.677 -1.011
103 1HB ALA 13 1HB ALA 13 0.826 -7.149 -1.732
104 2HB ALA 13 2HB ALA 13 2.176 -8.270 -1.554
105 3HB ALA 13 3HB ALA 13 1.799 -7.133 -0.260
106 H ALA 14 H ALA 14 -0.820 -8.519 1.786
107 HA ALA 14 HA ALA 14 -0.426 -8.851 4.001
108 1HB ALA 14 1HB ALA 14 1.192 -11.095 2.822
109 2HB ALA 14 2HB ALA 14 -0.430 -11.163 3.512
110 3HB ALA 14 3HB ALA 14 0.962 -10.887 4.559
111 H ASN 15 H ASN 15 1.280 -6.972 2.548
112 HA ASN 15 HA ASN 15 3.410 -6.787 4.535
113 1HB ASN 15 2HB ASN 15 4.036 -7.806 2.100
114 2HB ASN 15 1HB ASN 15 4.266 -6.087 1.794
115 1HD2 ASN 15 1HD2 ASN 15 5.200 -5.213 4.207
116 2HD2 ASN 15 2HD2 ASN 15 6.736 -5.934 4.533
117 H VAL 16 H VAL 16 2.876 -4.929 5.491
118 HA VAL 16 HA VAL 16 1.563 -2.781 4.173
119 HB VAL 16 HB VAL 16 3.053 -2.645 6.794
120 1HG1 VAL 16 1HG1 VAL 16 0.572 -1.123 6.332
121 2HG1 VAL 16 2HG1 VAL 16 1.977 -0.609 5.399
122 3HG1 VAL 16 3HG1 VAL 16 2.057 -0.654 7.160
123 1HG2 VAL 16 1HG2 VAL 16 0.510 -2.973 7.554
124 2HG2 VAL 16 2HG2 VAL 16 1.632 -4.320 7.356
125 3HG2 VAL 16 3HG2 VAL 16 0.488 -3.929 6.072
126 H ALA 17 H ALA 17 4.908 -3.307 5.235
127 HA ALA 17 HA ALA 17 5.887 -0.775 4.464
128 1HB ALA 17 1HB ALA 17 7.278 -1.889 5.937
129 2HB ALA 17 2HB ALA 17 8.126 -2.091 4.404
130 3HB ALA 17 3HB ALA 17 7.161 -3.413 5.058
131 H ALA 18 H ALA 18 5.859 -3.910 2.791
132 HA ALA 18 HA ALA 18 7.257 -3.156 0.501
133 1HB ALA 18 1HB ALA 18 6.314 -5.479 1.331
134 2HB ALA 18 2HB ALA 18 6.648 -5.178 -0.374
135 3HB ALA 18 3HB ALA 18 4.997 -5.069 0.234
136 H HIS 19 H HIS 19 3.878 -2.739 1.361
137 HA HIS 19 HA HIS 19 3.066 -1.846 -1.234
138 1HB HIS 19 2HB HIS 19 1.241 -2.670 -0.104
139 2HB HIS 19 1HB HIS 19 1.801 -2.076 1.454
140 HD2 HIS 19 2HD HIS 19 0.642 0.211 2.298
141 HE1 HIS 19 1HE HIS 19 -1.190 1.238 -1.368
142 HE2 HIS 19 2HE HIS 19 -1.118 1.710 1.127
143 H MET 20 H MET 20 3.298 -0.127 1.888
144 HA MET 20 HA MET 20 2.901 2.438 1.052
145 1HB MET 20 2HB MET 20 3.193 1.781 3.403
146 2HB MET 20 1HB MET 20 4.911 1.539 3.124
147 1HG MET 20 2HG MET 20 4.638 4.080 2.274
148 2HG MET 20 1HG MET 20 3.382 4.019 3.508
149 1HE MET 20 1HE MET 20 4.032 2.443 5.698
150 2HE MET 20 2HE MET 20 3.967 4.137 6.185
151 3HE MET 20 3HE MET 20 5.302 3.117 6.721
152 H THR 21 H THR 21 5.997 0.688 0.998
153 HA THR 21 HA THR 21 7.623 2.780 0.140
154 HB THR 21 HB THR 21 8.462 0.590 0.921
155 HG1 THR 21 1HG THR 21 10.132 0.437 -0.639
156 1HG2 THR 21 1HG2 THR 21 7.024 -0.387 -1.426
157 2HG2 THR 21 2HG2 THR 21 7.508 -1.226 0.048
158 3HG2 THR 21 3HG2 THR 21 8.667 -1.004 -1.261
159 H HIS 22 H HIS 22 5.292 0.908 -1.601
160 HA HIS 22 HA HIS 22 6.116 2.189 -4.100
161 1HB HIS 22 2HB HIS 22 6.145 0.114 -4.953
162 2HB HIS 22 1HB HIS 22 5.477 -0.552 -3.471
163 HD1 HIS 22 1HD HIS 22 4.799 -0.493 -6.907
164 HD2 HIS 22 2HD HIS 22 2.416 0.016 -3.529
165 HE1 HIS 22 1HE HIS 22 2.448 -0.947 -7.666
166 HE2 HIS 22 2HE HIS 22 1.020 -0.567 -5.628
167 H CYS 23 H CYS 23 3.995 2.586 -1.715
168 HA CYS 23 HA CYS 23 1.995 3.772 -3.479
169 1HB CYS 23 2HB CYS 23 1.648 1.520 -1.602
170 2HB CYS 23 1HB CYS 23 0.422 2.767 -1.507
171 H ALA 24 H ALA 24 3.035 5.747 -2.778
172 HA ALA 24 HA ALA 24 3.271 6.521 -0.081
173 1HB ALA 24 1HB ALA 24 4.087 8.465 -0.888
174 2HB ALA 24 2HB ALA 24 2.782 8.652 -2.060
175 3HB ALA 24 3HB ALA 24 4.130 7.568 -2.406
176 H LYS 25 H LYS 25 2.078 8.617 0.677
177 HA LYS 25 HA LYS 25 -0.787 8.438 0.067
178 1HB LYS 25 2HB LYS 25 -0.200 7.109 2.137
179 2HB LYS 25 1HB LYS 25 0.273 8.627 2.887
180 1HG LYS 25 2HG LYS 25 -2.437 8.442 1.689
181 2HG LYS 25 1HG LYS 25 -2.133 7.611 3.215
182 1HD LYS 25 2HD LYS 25 -1.016 9.994 3.762
183 2HD LYS 25 1HD LYS 25 -2.256 10.502 2.614
184 1HE LYS 25 2HE LYS 25 -3.682 8.822 4.180
185 2HE LYS 25 1HE LYS 25 -2.521 9.446 5.350
186 1HZ LYS 25 1HZ LYS 25 -3.383 11.521 5.240
187 2HZ LYS 25 2HZ LYS 25 -4.784 10.674 4.813
188 3HZ LYS 25 3HZ LYS 25 -3.832 11.390 3.614
Start of MODEL 13
1 1H ARG 1 1HT ARG 1 -2.549 2.041 7.581
2 2H ARG 1 2HT ARG 1 -1.095 1.393 8.224
3 3H ARG 1 3HT ARG 1 -2.483 1.548 9.222
4 HA ARG 1 HA ARG 1 -1.948 -0.716 8.378
5 1HB ARG 1 2HB ARG 1 -4.213 0.422 9.167
6 2HB ARG 1 1HB ARG 1 -4.671 0.135 7.493
7 1HG ARG 1 2HG ARG 1 -4.474 -2.191 7.722
8 2HG ARG 1 1HG ARG 1 -3.578 -2.048 9.236
9 1HD ARG 1 2HD ARG 1 -5.788 -0.820 10.008
10 2HD ARG 1 1HD ARG 1 -6.494 -1.788 8.714
11 HE ARG 1 HE ARG 1 -6.265 -3.636 10.035
12 1HH1 ARG 1 1HH1 ARG 1 -4.193 -1.119 11.281
13 2HH1 ARG 1 2HH1 ARG 1 -3.753 -2.011 12.699
14 1HH2 ARG 1 1HH2 ARG 1 -5.687 -4.810 11.898
15 2HH2 ARG 1 2HH2 ARG 1 -4.601 -4.107 13.049
16 H VAL 2 H VAL 2 -2.362 -2.189 6.612
17 HA VAL 2 HA VAL 2 -1.804 -0.940 4.028
18 HB VAL 2 HB VAL 2 -0.294 -2.730 4.793
19 1HG1 VAL 2 1HG1 VAL 2 -1.679 -4.143 6.074
20 2HG1 VAL 2 2HG1 VAL 2 -1.195 -5.096 4.672
21 3HG1 VAL 2 3HG1 VAL 2 -2.806 -4.381 4.738
22 1HG2 VAL 2 1HG2 VAL 2 -1.248 -2.335 2.292
23 2HG2 VAL 2 2HG2 VAL 2 -1.599 -4.049 2.512
24 3HG2 VAL 2 3HG2 VAL 2 0.053 -3.458 2.691
25 H ILE 3 H ILE 3 -4.427 -0.647 4.928
26 HA ILE 3 HA ILE 3 -5.893 -2.428 3.092
27 HB ILE 3 HB ILE 3 -6.494 -2.801 5.465
28 1HG1 ILE 3 2HG1 ILE 3 -8.941 -1.527 4.408
29 2HG1 ILE 3 1HG1 ILE 3 -8.145 -2.657 3.315
30 1HG2 ILE 3 1HG2 ILE 3 -6.151 -0.219 5.900
31 2HG2 ILE 3 2HG2 ILE 3 -7.247 -1.186 6.887
32 3HG2 ILE 3 3HG2 ILE 3 -7.886 -0.181 5.586
33 1HD1 ILE 3 1HD1 ILE 3 -9.224 -4.275 4.367
34 2HD1 ILE 3 2HD1 ILE 3 -9.772 -3.173 5.630
35 3HD1 ILE 3 3HD1 ILE 3 -8.199 -3.960 5.767
36 H ALA 4 H ALA 4 -4.610 0.030 2.369
37 HA ALA 4 HA ALA 4 -6.983 1.592 1.595
38 1HB ALA 4 1HB ALA 4 -6.123 3.131 3.027
39 2HB ALA 4 2HB ALA 4 -5.163 3.537 1.603
40 3HB ALA 4 3HB ALA 4 -4.476 2.521 2.870
41 H CYS 5 H CYS 5 -5.513 -0.525 0.195
42 HA CYS 5 HA CYS 5 -4.500 1.031 -2.093
43 1HB CYS 5 2HB CYS 5 -2.853 -0.493 -0.910
44 2HB CYS 5 1HB CYS 5 -3.821 -1.847 -1.483
45 H PHE 6 H PHE 6 -5.202 0.509 -4.150
46 HA PHE 6 HA PHE 6 -7.624 -1.151 -4.238
47 1HB PHE 6 2HB PHE 6 -8.175 0.084 -6.298
48 2HB PHE 6 1HB PHE 6 -7.943 1.169 -4.931
49 HD1 PHE 6 1HD PHE 6 -6.744 0.155 -8.195
50 HD2 PHE 6 2HD PHE 6 -5.909 2.546 -4.776
51 HE1 PHE 6 1HE PHE 6 -5.088 1.429 -9.495
52 HE2 PHE 6 2HE PHE 6 -4.252 3.824 -6.069
53 HZ PHE 6 HZ PHE 6 -3.839 3.266 -8.432
54 H LEU 7 H LEU 7 -5.015 -2.338 -4.273
55 HA LEU 7 HA LEU 7 -5.108 -3.578 -6.940
56 1HB LEU 7 2HB LEU 7 -2.742 -2.531 -5.436
57 2HB LEU 7 1HB LEU 7 -2.546 -3.898 -6.517
58 HG LEU 7 HG LEU 7 -3.685 -1.240 -7.376
59 1HD1 LEU 7 1HD1 LEU 7 -0.988 -2.084 -8.235
60 2HD1 LEU 7 2HD1 LEU 7 -1.149 -1.514 -6.573
61 3HD1 LEU 7 3HD1 LEU 7 -1.628 -0.473 -7.914
62 1HD2 LEU 7 1HD2 LEU 7 -2.771 -2.342 -9.609
63 2HD2 LEU 7 2HD2 LEU 7 -4.395 -2.663 -9.003
64 3HD2 LEU 7 3HD2 LEU 7 -3.099 -3.824 -8.711
65 H LYS 8 H LYS 8 -4.812 -5.778 -7.012
66 HA LYS 8 HA LYS 8 -5.330 -7.211 -4.592
67 1HB LYS 8 2HB LYS 8 -4.606 -8.312 -7.313
68 2HB LYS 8 1HB LYS 8 -5.365 -9.194 -5.994
69 1HG LYS 8 2HG LYS 8 -7.264 -8.728 -7.078
70 2HG LYS 8 1HG LYS 8 -7.110 -7.146 -6.312
71 1HD LYS 8 2HD LYS 8 -6.360 -6.136 -8.246
72 2HD LYS 8 1HD LYS 8 -5.753 -7.648 -8.924
73 1HE LYS 8 2HE LYS 8 -8.408 -8.180 -8.740
74 2HE LYS 8 1HE LYS 8 -8.431 -6.448 -9.067
75 1HZ LYS 8 1HZ LYS 8 -7.594 -8.648 -10.777
76 2HZ LYS 8 2HZ LYS 8 -6.670 -7.234 -10.876
77 3HZ LYS 8 3HZ LYS 8 -8.333 -7.181 -11.183
78 H VAL 9 H VAL 9 -2.669 -7.480 -6.958
79 HA VAL 9 HA VAL 9 -1.023 -9.098 -5.384
80 HB VAL 9 HB VAL 9 -0.658 -8.786 -7.785
81 1HG1 VAL 9 1HG1 VAL 9 0.787 -6.575 -8.222
82 2HG1 VAL 9 2HG1 VAL 9 -0.286 -5.973 -6.957
83 3HG1 VAL 9 3HG1 VAL 9 -0.962 -6.642 -8.442
84 1HG2 VAL 9 1HG2 VAL 9 1.870 -7.767 -6.603
85 2HG2 VAL 9 2HG2 VAL 9 1.596 -9.126 -7.693
86 3HG2 VAL 9 3HG2 VAL 9 1.215 -9.281 -5.978
87 H CYS 10 H CYS 10 -1.608 -5.683 -5.268
88 HA CYS 10 HA CYS 10 0.743 -5.150 -3.650
89 1HB CYS 10 2HB CYS 10 -0.427 -3.576 -5.405
90 2HB CYS 10 1HB CYS 10 -1.458 -3.161 -4.041
91 H ALA 11 H ALA 11 -2.723 -4.443 -3.180
92 HA ALA 11 HA ALA 11 -2.547 -4.136 -0.397
93 1HB ALA 11 1HB ALA 11 -4.768 -3.713 -0.464
94 2HB ALA 11 2HB ALA 11 -5.113 -5.095 -1.504
95 3HB ALA 11 3HB ALA 11 -4.459 -3.612 -2.198
96 H ALA 12 H ALA 12 -3.475 -6.937 -2.369
97 HA ALA 12 HA ALA 12 -3.798 -8.608 -0.024
98 1HB ALA 12 1HB ALA 12 -4.881 -10.067 -1.365
99 2HB ALA 12 2HB ALA 12 -3.760 -9.839 -2.707
100 3HB ALA 12 3HB ALA 12 -5.026 -8.649 -2.402
101 H ALA 13 H ALA 13 -1.148 -7.526 -0.404
102 HA ALA 13 HA ALA 13 0.403 -9.883 -1.193
103 1HB ALA 13 1HB ALA 13 1.845 -7.428 -0.463
104 2HB ALA 13 2HB ALA 13 0.787 -7.295 -1.867
105 3HB ALA 13 3HB ALA 13 2.064 -8.511 -1.837
106 H ALA 14 H ALA 14 -0.938 -8.648 1.546
107 HA ALA 14 HA ALA 14 -0.599 -8.933 3.778
108 1HB ALA 14 1HB ALA 14 1.046 -10.976 4.231
109 2HB ALA 14 2HB ALA 14 0.715 -11.273 2.525
110 3HB ALA 14 3HB ALA 14 -0.614 -11.201 3.681
111 H ASN 15 H ASN 15 1.164 -7.111 2.318
112 HA ASN 15 HA ASN 15 3.279 -6.940 4.332
113 1HB ASN 15 2HB ASN 15 3.904 -7.926 1.889
114 2HB ASN 15 1HB ASN 15 4.116 -6.203 1.591
115 1HD2 ASN 15 1HD2 ASN 15 5.074 -5.312 3.971
116 2HD2 ASN 15 2HD2 ASN 15 6.613 -6.027 4.295
117 H VAL 16 H VAL 16 2.916 -5.063 5.305
118 HA VAL 16 HA VAL 16 1.538 -2.901 4.040
119 HB VAL 16 HB VAL 16 3.072 -2.798 6.637
120 1HG1 VAL 16 1HG1 VAL 16 0.578 -1.272 6.139
121 2HG1 VAL 16 2HG1 VAL 16 2.049 -0.726 5.332
122 3HG1 VAL 16 3HG1 VAL 16 2.000 -0.843 7.091
123 1HG2 VAL 16 1HG2 VAL 16 0.547 -4.139 5.942
124 2HG2 VAL 16 2HG2 VAL 16 0.493 -3.125 7.384
125 3HG2 VAL 16 3HG2 VAL 16 1.664 -4.439 7.273
126 H ALA 17 H ALA 17 4.879 -3.346 5.190
127 HA ALA 17 HA ALA 17 5.858 -0.850 4.383
128 1HB ALA 17 1HB ALA 17 7.046 -3.452 5.127
129 2HB ALA 17 2HB ALA 17 7.378 -1.831 5.742
130 3HB ALA 17 3HB ALA 17 8.070 -2.351 4.205
131 H ALA 18 H ALA 18 5.804 -3.964 2.676
132 HA ALA 18 HA ALA 18 7.195 -3.192 0.385
133 1HB ALA 18 1HB ALA 18 6.557 -5.196 -0.521
134 2HB ALA 18 2HB ALA 18 4.921 -5.096 0.131
135 3HB ALA 18 3HB ALA 18 6.267 -5.521 1.188
136 H HIS 19 H HIS 19 3.809 -2.802 1.253
137 HA HIS 19 HA HIS 19 3.006 -1.854 -1.326
138 1HB HIS 19 2HB HIS 19 1.178 -2.713 -0.230
139 2HB HIS 19 1HB HIS 19 1.729 -2.162 1.347
140 HD2 HIS 19 2HD HIS 19 0.555 0.095 2.252
141 HE1 HIS 19 1HE HIS 19 -1.269 1.216 -1.389
142 HE2 HIS 19 2HE HIS 19 -0.927 1.840 1.044
143 H MET 20 H MET 20 3.237 -0.212 1.838
144 HA MET 20 HA MET 20 2.820 2.372 1.058
145 1HB MET 20 2HB MET 20 3.214 1.474 3.402
146 2HB MET 20 1HB MET 20 4.935 1.621 3.073
147 1HG MET 20 2HG MET 20 4.604 4.032 2.641
148 2HG MET 20 1HG MET 20 2.912 3.848 3.098
149 1HE MET 20 1HE MET 20 3.377 5.770 5.666
150 2HE MET 20 2HE MET 20 4.226 5.926 4.128
151 3HE MET 20 3HE MET 20 5.138 5.861 5.637
152 H THR 21 H THR 21 5.922 0.635 0.970
153 HA THR 21 HA THR 21 7.545 2.753 0.174
154 HB THR 21 HB THR 21 8.382 0.539 0.892
155 HG1 THR 21 1HG THR 21 10.150 0.794 -0.247
156 1HG2 THR 21 1HG2 THR 21 8.600 -0.968 -1.361
157 2HG2 THR 21 2HG2 THR 21 6.948 -0.364 -1.483
158 3HG2 THR 21 3HG2 THR 21 7.456 -1.256 -0.050
159 H HIS 22 H HIS 22 5.206 0.951 -1.620
160 HA HIS 22 HA HIS 22 6.031 2.308 -4.078
161 1HB HIS 22 2HB HIS 22 6.077 0.263 -5.001
162 2HB HIS 22 1HB HIS 22 5.416 -0.458 -3.542
163 HD1 HIS 22 1HD HIS 22 4.735 -0.289 -6.975
164 HD2 HIS 22 2HD HIS 22 2.351 0.087 -3.580
165 HE1 HIS 22 1HE HIS 22 2.386 -0.738 -7.747
166 HE2 HIS 22 2HE HIS 22 0.957 -0.447 -5.694
167 H CYS 23 H CYS 23 3.904 2.607 -1.685
168 HA CYS 23 HA CYS 23 1.896 3.837 -3.408
169 1HB CYS 23 2HB CYS 23 1.562 1.523 -1.604
170 2HB CYS 23 1HB CYS 23 0.326 2.758 -1.478
171 H ALA 24 H ALA 24 4.022 4.895 -1.703
172 HA ALA 24 HA ALA 24 3.139 5.764 0.793
173 1HB ALA 24 1HB ALA 24 5.454 5.960 0.106
174 2HB ALA 24 2HB ALA 24 4.829 7.538 0.581
175 3HB ALA 24 3HB ALA 24 5.014 7.141 -1.127
176 H LYS 25 H LYS 25 2.077 7.586 1.517
177 HA LYS 25 HA LYS 25 0.038 8.628 -0.130
178 1HB LYS 25 2HB LYS 25 0.393 8.481 2.537
179 2HB LYS 25 1HB LYS 25 0.818 10.168 2.278
180 1HG LYS 25 2HG LYS 25 -1.661 9.247 0.976
181 2HG LYS 25 1HG LYS 25 -1.681 9.313 2.740
182 1HD LYS 25 2HD LYS 25 -0.506 11.687 2.135
183 2HD LYS 25 1HD LYS 25 -1.600 11.487 0.764
184 1HE LYS 25 2HE LYS 25 -2.290 11.546 3.693
185 2HE LYS 25 1HE LYS 25 -2.792 12.679 2.439
186 1HZ LYS 25 1HZ LYS 25 -4.579 11.172 2.991
187 2HZ LYS 25 2HZ LYS 25 -3.609 9.830 2.643
188 3HZ LYS 25 3HZ LYS 25 -4.064 10.889 1.404
Start of MODEL 14
1 1H ARG 1 1HT ARG 1 -1.503 1.205 8.747
2 2H ARG 1 2HT ARG 1 -0.750 -0.337 8.813
3 3H ARG 1 3HT ARG 1 -1.754 0.187 10.103
4 HA ARG 1 HA ARG 1 -2.847 -1.414 8.717
5 1HB ARG 1 2HB ARG 1 -3.891 0.703 9.862
6 2HB ARG 1 1HB ARG 1 -4.139 1.244 8.207
7 1HG ARG 1 2HG ARG 1 -6.102 0.184 8.435
8 2HG ARG 1 1HG ARG 1 -5.146 -1.247 8.043
9 1HD ARG 1 2HD ARG 1 -5.588 -0.287 10.860
10 2HD ARG 1 1HD ARG 1 -6.659 -1.437 10.060
11 HE ARG 1 HE ARG 1 -4.159 -2.502 9.772
12 1HH1 ARG 1 1HH1 ARG 1 -6.108 -1.482 12.481
13 2HH1 ARG 1 2HH1 ARG 1 -5.415 -2.632 13.575
14 1HH2 ARG 1 1HH2 ARG 1 -3.246 -4.017 11.208
15 2HH2 ARG 1 2HH2 ARG 1 -3.789 -4.071 12.852
16 H VAL 2 H VAL 2 -2.228 -2.292 6.829
17 HA VAL 2 HA VAL 2 -1.802 -0.614 4.490
18 HB VAL 2 HB VAL 2 -0.202 -2.415 4.948
19 1HG1 VAL 2 1HG1 VAL 2 -1.066 -4.274 5.849
20 2HG1 VAL 2 2HG1 VAL 2 -1.372 -4.760 4.182
21 3HG1 VAL 2 3HG1 VAL 2 -2.653 -4.002 5.129
22 1HG2 VAL 2 1HG2 VAL 2 -1.680 -2.101 2.461
23 2HG2 VAL 2 2HG2 VAL 2 -0.889 -3.672 2.592
24 3HG2 VAL 2 3HG2 VAL 2 0.058 -2.193 2.741
25 H ILE 3 H ILE 3 -4.363 -0.334 5.094
26 HA ILE 3 HA ILE 3 -5.789 -2.094 3.208
27 HB ILE 3 HB ILE 3 -6.548 -2.370 5.547
28 1HG1 ILE 3 2HG1 ILE 3 -8.862 -1.022 4.292
29 2HG1 ILE 3 1HG1 ILE 3 -8.056 -2.234 3.300
30 1HG2 ILE 3 1HG2 ILE 3 -6.134 0.234 5.895
31 2HG2 ILE 3 2HG2 ILE 3 -7.266 -0.685 6.885
32 3HG2 ILE 3 3HG2 ILE 3 -7.860 0.284 5.536
33 1HD1 ILE 3 1HD1 ILE 3 -9.267 -2.636 6.023
34 2HD1 ILE 3 2HD1 ILE 3 -8.339 -3.856 5.149
35 3HD1 ILE 3 3HD1 ILE 3 -9.861 -3.261 4.485
36 H ALA 4 H ALA 4 -4.357 0.283 2.495
37 HA ALA 4 HA ALA 4 -6.601 1.987 1.631
38 1HB ALA 4 1HB ALA 4 -3.967 2.712 2.778
39 2HB ALA 4 2HB ALA 4 -5.536 3.498 2.950
40 3HB ALA 4 3HB ALA 4 -4.591 3.728 1.479
41 H CYS 5 H CYS 5 -5.415 -0.340 0.303
42 HA CYS 5 HA CYS 5 -4.397 0.992 -2.120
43 1HB CYS 5 2HB CYS 5 -2.781 -0.540 -0.846
44 2HB CYS 5 1HB CYS 5 -3.797 -1.869 -1.390
45 H PHE 6 H PHE 6 -4.955 -0.047 -4.152
46 HA PHE 6 HA PHE 6 -7.454 -1.600 -3.993
47 1HB PHE 6 2HB PHE 6 -8.124 -0.412 -6.119
48 2HB PHE 6 1HB PHE 6 -8.087 0.598 -4.678
49 HD1 PHE 6 1HD PHE 6 -6.929 0.191 -8.015
50 HD2 PHE 6 2HD PHE 6 -5.998 2.014 -4.285
51 HE1 PHE 6 1HE PHE 6 -5.424 1.763 -9.163
52 HE2 PHE 6 2HE PHE 6 -4.492 3.590 -5.426
53 HZ PHE 6 HZ PHE 6 -4.204 3.466 -7.869
54 H LEU 7 H LEU 7 -4.799 -2.645 -4.237
55 HA LEU 7 HA LEU 7 -5.001 -3.853 -6.915
56 1HB LEU 7 2HB LEU 7 -2.610 -2.778 -5.480
57 2HB LEU 7 1HB LEU 7 -2.414 -4.133 -6.575
58 HG LEU 7 HG LEU 7 -3.686 -1.534 -7.413
59 1HD1 LEU 7 1HD1 LEU 7 -1.159 -1.595 -6.585
60 2HD1 LEU 7 2HD1 LEU 7 -1.679 -0.632 -7.968
61 3HD1 LEU 7 3HD1 LEU 7 -0.917 -2.203 -8.222
62 1HD2 LEU 7 1HD2 LEU 7 -2.804 -2.479 -9.660
63 2HD2 LEU 7 2HD2 LEU 7 -4.290 -3.134 -8.971
64 3HD2 LEU 7 3HD2 LEU 7 -2.773 -4.019 -8.803
65 H LYS 8 H LYS 8 -4.525 -6.046 -7.075
66 HA LYS 8 HA LYS 8 -5.039 -7.580 -4.723
67 1HB LYS 8 2HB LYS 8 -4.430 -8.260 -7.585
68 2HB LYS 8 1HB LYS 8 -4.491 -9.519 -6.358
69 1HG LYS 8 2HG LYS 8 -6.735 -9.407 -6.155
70 2HG LYS 8 1HG LYS 8 -6.785 -7.666 -6.444
71 1HD LYS 8 2HD LYS 8 -5.975 -9.377 -8.720
72 2HD LYS 8 1HD LYS 8 -7.665 -9.464 -8.221
73 1HE LYS 8 2HE LYS 8 -7.743 -6.966 -8.359
74 2HE LYS 8 1HE LYS 8 -6.127 -7.013 -9.063
75 1HZ LYS 8 1HZ LYS 8 -8.118 -8.721 -10.316
76 2HZ LYS 8 2HZ LYS 8 -6.905 -7.774 -11.019
77 3HZ LYS 8 3HZ LYS 8 -8.349 -7.056 -10.509
78 H VAL 9 H VAL 9 -2.263 -7.582 -6.969
79 HA VAL 9 HA VAL 9 -0.589 -9.146 -5.355
80 HB VAL 9 HB VAL 9 -0.162 -8.764 -7.743
81 1HG1 VAL 9 1HG1 VAL 9 -0.701 -6.203 -7.387
82 2HG1 VAL 9 2HG1 VAL 9 0.362 -6.750 -8.684
83 3HG1 VAL 9 3HG1 VAL 9 1.050 -6.106 -7.193
84 1HG2 VAL 9 1HG2 VAL 9 2.298 -7.657 -6.561
85 2HG2 VAL 9 2HG2 VAL 9 2.054 -9.115 -7.522
86 3HG2 VAL 9 3HG2 VAL 9 1.674 -9.120 -5.799
87 H CYS 10 H CYS 10 -1.430 -5.799 -5.179
88 HA CYS 10 HA CYS 10 0.821 -5.178 -3.429
89 1HB CYS 10 2HB CYS 10 -0.277 -3.650 -5.299
90 2HB CYS 10 1HB CYS 10 -1.361 -3.217 -3.980
91 H ALA 11 H ALA 11 -2.695 -4.586 -3.268
92 HA ALA 11 HA ALA 11 -2.694 -4.330 -0.440
93 1HB ALA 11 1HB ALA 11 -4.413 -3.579 -2.362
94 2HB ALA 11 2HB ALA 11 -4.855 -3.711 -0.660
95 3HB ALA 11 3HB ALA 11 -5.231 -5.025 -1.774
96 H ALA 12 H ALA 12 -3.654 -6.945 -2.637
97 HA ALA 12 HA ALA 12 -4.303 -8.701 -0.425
98 1HB ALA 12 1HB ALA 12 -5.366 -10.005 -1.933
99 2HB ALA 12 2HB ALA 12 -4.118 -9.795 -3.162
100 3HB ALA 12 3HB ALA 12 -5.317 -8.529 -2.896
101 H ALA 13 H ALA 13 -1.558 -7.814 -0.517
102 HA ALA 13 HA ALA 13 -0.200 -10.366 -1.077
103 1HB ALA 13 1HB ALA 13 0.545 -7.592 -1.659
104 2HB ALA 13 2HB ALA 13 1.048 -9.093 -2.435
105 3HB ALA 13 3HB ALA 13 1.834 -8.565 -0.948
106 H ALA 14 H ALA 14 -1.385 -8.575 1.400
107 HA ALA 14 HA ALA 14 -1.027 -8.490 3.644
108 1HB ALA 14 1HB ALA 14 -0.244 -10.445 4.694
109 2HB ALA 14 2HB ALA 14 0.761 -10.882 3.313
110 3HB ALA 14 3HB ALA 14 -0.996 -10.991 3.195
111 H ASN 15 H ASN 15 0.809 -7.059 1.858
112 HA ASN 15 HA ASN 15 3.171 -6.935 3.617
113 1HB ASN 15 2HB ASN 15 2.907 -6.934 0.686
114 2HB ASN 15 1HB ASN 15 3.977 -5.685 1.318
115 1HD2 ASN 15 1HD2 ASN 15 5.650 -6.421 2.848
116 2HD2 ASN 15 2HD2 ASN 15 6.381 -7.962 2.573
117 H VAL 16 H VAL 16 3.207 -5.184 4.847
118 HA VAL 16 HA VAL 16 1.570 -2.884 4.182
119 HB VAL 16 HB VAL 16 3.372 -3.259 6.576
120 1HG1 VAL 16 1HG1 VAL 16 0.946 -1.608 6.751
121 2HG1 VAL 16 2HG1 VAL 16 2.216 -0.972 5.705
122 3HG1 VAL 16 3HG1 VAL 16 2.563 -1.327 7.398
123 1HG2 VAL 16 1HG2 VAL 16 0.475 -3.569 6.928
124 2HG2 VAL 16 2HG2 VAL 16 1.810 -4.489 7.623
125 3HG2 VAL 16 3HG2 VAL 16 1.244 -4.850 5.993
126 H ALA 17 H ALA 17 4.963 -3.255 5.232
127 HA ALA 17 HA ALA 17 5.790 -0.701 4.452
128 1HB ALA 17 1HB ALA 17 7.228 -3.260 5.014
129 2HB ALA 17 2HB ALA 17 7.247 -1.741 5.911
130 3HB ALA 17 3HB ALA 17 8.112 -1.871 4.380
131 H ALA 18 H ALA 18 5.895 -3.786 2.707
132 HA ALA 18 HA ALA 18 7.294 -2.923 0.448
133 1HB ALA 18 1HB ALA 18 6.257 -5.295 1.267
134 2HB ALA 18 2HB ALA 18 6.914 -4.992 -0.342
135 3HB ALA 18 3HB ALA 18 5.175 -4.890 -0.066
136 H HIS 19 H HIS 19 3.920 -2.600 1.327
137 HA HIS 19 HA HIS 19 3.049 -1.738 -1.260
138 1HB HIS 19 2HB HIS 19 1.268 -2.602 -0.084
139 2HB HIS 19 1HB HIS 19 1.830 -1.958 1.453
140 HD2 HIS 19 2HD HIS 19 0.594 0.296 2.268
141 HE1 HIS 19 1HE HIS 19 -1.260 1.225 -1.412
142 HE2 HIS 19 2HE HIS 19 -1.205 1.731 1.077
143 H MET 20 H MET 20 3.254 0.016 1.845
144 HA MET 20 HA MET 20 2.806 2.562 0.984
145 1HB MET 20 2HB MET 20 4.492 1.437 3.177
146 2HB MET 20 1HB MET 20 4.574 3.163 2.850
147 1HG MET 20 2HG MET 20 1.935 2.913 2.943
148 2HG MET 20 1HG MET 20 2.364 1.542 3.965
149 1HE MET 20 1HE MET 20 2.612 1.592 6.178
150 2HE MET 20 2HE MET 20 3.061 2.920 7.247
151 3HE MET 20 3HE MET 20 4.291 2.125 6.264
152 H THR 21 H THR 21 5.937 0.879 0.939
153 HA THR 21 HA THR 21 7.520 2.996 0.061
154 HB THR 21 HB THR 21 8.409 0.834 0.854
155 HG1 THR 21 1HG THR 21 9.852 2.037 -0.295
156 1HG2 THR 21 1HG2 THR 21 7.007 -0.192 -1.512
157 2HG2 THR 21 2HG2 THR 21 7.423 -0.989 0.006
158 3HG2 THR 21 3HG2 THR 21 8.638 -0.811 -1.260
159 H HIS 22 H HIS 22 5.224 1.063 -1.663
160 HA HIS 22 HA HIS 22 6.012 2.351 -4.170
161 1HB HIS 22 2HB HIS 22 6.094 0.278 -5.021
162 2HB HIS 22 1HB HIS 22 5.463 -0.402 -3.529
163 HD1 HIS 22 1HD HIS 22 4.753 -0.399 -6.955
164 HD2 HIS 22 2HD HIS 22 2.381 0.081 -3.563
165 HE1 HIS 22 1HE HIS 22 2.407 -0.928 -7.689
166 HE2 HIS 22 2HE HIS 22 0.987 -0.573 -5.641
167 H CYS 23 H CYS 23 3.887 2.712 -1.786
168 HA CYS 23 HA CYS 23 1.849 3.821 -3.556
169 1HB CYS 23 2HB CYS 23 1.572 1.583 -1.650
170 2HB CYS 23 1HB CYS 23 0.310 2.796 -1.569
171 H ALA 24 H ALA 24 3.965 4.980 -1.886
172 HA ALA 24 HA ALA 24 2.834 6.016 0.510
173 1HB ALA 24 1HB ALA 24 5.243 5.846 0.207
174 2HB ALA 24 2HB ALA 24 4.771 7.512 0.537
175 3HB ALA 24 3HB ALA 24 5.174 7.019 -1.108
176 H LYS 25 H LYS 25 2.943 8.568 0.738
177 HA LYS 25 HA LYS 25 1.086 9.605 -1.286
178 1HB LYS 25 2HB LYS 25 1.643 10.818 1.416
179 2HB LYS 25 1HB LYS 25 0.265 11.107 0.363
180 1HG LYS 25 2HG LYS 25 -0.218 8.588 0.713
181 2HG LYS 25 1HG LYS 25 0.849 8.755 2.109
182 1HD LYS 25 2HD LYS 25 -0.611 10.738 2.775
183 2HD LYS 25 1HD LYS 25 -1.757 10.154 1.568
184 1HE LYS 25 2HE LYS 25 -2.086 8.120 2.720
185 2HE LYS 25 1HE LYS 25 -0.681 8.390 3.751
186 1HZ LYS 25 1HZ LYS 25 -3.167 8.883 4.522
187 2HZ LYS 25 2HZ LYS 25 -2.778 10.400 3.884
188 3HZ LYS 25 3HZ LYS 25 -1.834 9.737 5.120
Start of MODEL 15
1 1H ARG 1 1HT ARG 1 -1.122 0.620 7.698
2 2H ARG 1 2HT ARG 1 -1.825 0.463 9.256
3 3H ARG 1 3HT ARG 1 -2.659 1.310 8.017
4 HA ARG 1 HA ARG 1 -2.078 -1.567 8.179
5 1HB ARG 1 2HB ARG 1 -4.001 -0.460 9.458
6 2HB ARG 1 1HB ARG 1 -4.712 -0.126 7.884
7 1HG ARG 1 2HG ARG 1 -5.749 -2.087 8.306
8 2HG ARG 1 1HG ARG 1 -4.276 -2.735 7.581
9 1HD ARG 1 2HD ARG 1 -4.696 -3.964 9.580
10 2HD ARG 1 1HD ARG 1 -3.317 -2.907 9.882
11 HE ARG 1 HE ARG 1 -4.558 -1.785 11.449
12 1HH1 ARG 1 1HH1 ARG 1 -6.685 -3.776 9.528
13 2HH1 ARG 1 2HH1 ARG 1 -8.060 -3.506 10.543
14 1HH2 ARG 1 1HH2 ARG 1 -6.367 -1.427 12.785
15 2HH2 ARG 1 2HH2 ARG 1 -7.881 -2.171 12.392
16 H VAL 2 H VAL 2 -1.955 -2.661 6.324
17 HA VAL 2 HA VAL 2 -2.072 -1.243 3.823
18 HB VAL 2 HB VAL 2 -0.358 -2.956 4.206
19 1HG1 VAL 2 1HG1 VAL 2 -0.761 -5.084 4.825
20 2HG1 VAL 2 2HG1 VAL 2 -2.211 -5.211 3.830
21 3HG1 VAL 2 3HG1 VAL 2 -2.288 -4.416 5.403
22 1HG2 VAL 2 1HG2 VAL 2 -0.445 -2.874 1.969
23 2HG2 VAL 2 2HG2 VAL 2 -2.205 -2.963 1.938
24 3HG2 VAL 2 3HG2 VAL 2 -1.250 -4.438 2.091
25 H ILE 3 H ILE 3 -4.486 -0.826 4.489
26 HA ILE 3 HA ILE 3 -6.089 -2.761 2.970
27 HB ILE 3 HB ILE 3 -6.476 -3.132 5.390
28 1HG1 ILE 3 2HG1 ILE 3 -9.024 -1.922 4.461
29 2HG1 ILE 3 1HG1 ILE 3 -8.288 -3.121 3.403
30 1HG2 ILE 3 1HG2 ILE 3 -7.500 -0.296 5.345
31 2HG2 ILE 3 2HG2 ILE 3 -6.080 -0.887 6.208
32 3HG2 ILE 3 3HG2 ILE 3 -7.689 -1.430 6.684
33 1HD1 ILE 3 1HD1 ILE 3 -9.554 -3.440 6.044
34 2HD1 ILE 3 2HD1 ILE 3 -8.136 -4.438 5.722
35 3HD1 ILE 3 3HD1 ILE 3 -9.534 -4.520 4.651
36 H ALA 4 H ALA 4 -4.884 -0.108 2.373
37 HA ALA 4 HA ALA 4 -7.351 1.411 1.835
38 1HB ALA 4 1HB ALA 4 -4.537 2.485 1.950
39 2HB ALA 4 2HB ALA 4 -5.694 2.554 3.280
40 3HB ALA 4 3HB ALA 4 -6.025 3.417 1.778
41 H CYS 5 H CYS 5 -4.453 0.026 0.461
42 HA CYS 5 HA CYS 5 -4.478 1.227 -2.057
43 1HB CYS 5 2HB CYS 5 -2.728 -0.350 -0.989
44 2HB CYS 5 1HB CYS 5 -3.709 -1.652 -1.651
45 H PHE 6 H PHE 6 -5.058 0.191 -4.134
46 HA PHE 6 HA PHE 6 -7.526 -1.402 -3.912
47 1HB PHE 6 2HB PHE 6 -8.454 -0.162 -5.804
48 2HB PHE 6 1HB PHE 6 -8.055 0.933 -4.485
49 HD1 PHE 6 1HD PHE 6 -7.754 0.342 -7.938
50 HD2 PHE 6 2HD PHE 6 -5.695 2.044 -4.625
51 HE1 PHE 6 1HE PHE 6 -6.397 1.695 -9.481
52 HE2 PHE 6 2HE PHE 6 -4.336 3.401 -6.163
53 HZ PHE 6 HZ PHE 6 -4.686 3.227 -8.594
54 H LEU 7 H LEU 7 -4.826 -2.339 -4.329
55 HA LEU 7 HA LEU 7 -5.064 -3.381 -7.076
56 1HB LEU 7 2HB LEU 7 -2.705 -2.536 -5.463
57 2HB LEU 7 1HB LEU 7 -2.502 -3.865 -6.589
58 HG LEU 7 HG LEU 7 -3.658 -1.239 -7.480
59 1HD1 LEU 7 1HD1 LEU 7 -1.228 -1.303 -6.336
60 2HD1 LEU 7 2HD1 LEU 7 -1.647 -0.242 -7.682
61 3HD1 LEU 7 3HD1 LEU 7 -0.802 -1.761 -7.984
62 1HD2 LEU 7 1HD2 LEU 7 -1.965 -2.932 -9.202
63 2HD2 LEU 7 2HD2 LEU 7 -3.441 -2.044 -9.579
64 3HD2 LEU 7 3HD2 LEU 7 -3.534 -3.599 -8.754
65 H LYS 8 H LYS 8 -4.396 -5.581 -7.421
66 HA LYS 8 HA LYS 8 -5.257 -7.312 -5.291
67 1HB LYS 8 2HB LYS 8 -4.444 -7.695 -8.148
68 2HB LYS 8 1HB LYS 8 -4.531 -9.089 -7.080
69 1HG LYS 8 2HG LYS 8 -6.817 -8.921 -6.824
70 2HG LYS 8 1HG LYS 8 -6.845 -7.212 -7.266
71 1HD LYS 8 2HD LYS 8 -6.015 -8.071 -9.578
72 2HD LYS 8 1HD LYS 8 -6.648 -9.625 -9.027
73 1HE LYS 8 2HE LYS 8 -8.798 -8.956 -9.194
74 2HE LYS 8 1HE LYS 8 -8.439 -7.317 -8.653
75 1HZ LYS 8 1HZ LYS 8 -9.165 -7.715 -11.079
76 2HZ LYS 8 2HZ LYS 8 -7.566 -8.213 -11.319
77 3HZ LYS 8 3HZ LYS 8 -7.890 -6.645 -10.774
78 H VAL 9 H VAL 9 -2.222 -6.793 -7.065
79 HA VAL 9 HA VAL 9 -0.816 -8.497 -5.147
80 HB VAL 9 HB VAL 9 -0.380 -8.856 -7.550
81 1HG1 VAL 9 1HG1 VAL 9 0.840 -6.099 -7.487
82 2HG1 VAL 9 2HG1 VAL 9 -0.668 -6.533 -8.292
83 3HG1 VAL 9 3HG1 VAL 9 0.858 -7.219 -8.847
84 1HG2 VAL 9 1HG2 VAL 9 2.190 -7.776 -6.536
85 2HG2 VAL 9 2HG2 VAL 9 1.817 -9.353 -7.233
86 3HG2 VAL 9 3HG2 VAL 9 1.376 -9.001 -5.562
87 H CYS 10 H CYS 10 -1.789 -6.075 -4.132
88 HA CYS 10 HA CYS 10 0.725 -4.823 -3.347
89 1HB CYS 10 2HB CYS 10 -0.625 -3.581 -5.283
90 2HB CYS 10 1HB CYS 10 -1.527 -2.957 -3.906
91 H ALA 11 H ALA 11 -2.806 -4.528 -2.926
92 HA ALA 11 HA ALA 11 -2.560 -3.775 -0.175
93 1HB ALA 11 1HB ALA 11 -4.503 -3.446 -2.026
94 2HB ALA 11 2HB ALA 11 -4.753 -3.280 -0.289
95 3HB ALA 11 3HB ALA 11 -5.160 -4.794 -1.098
96 H ALA 12 H ALA 12 -3.690 -6.706 -1.845
97 HA ALA 12 HA ALA 12 -3.882 -8.157 0.655
98 1HB ALA 12 1HB ALA 12 -5.055 -9.747 -0.486
99 2HB ALA 12 2HB ALA 12 -4.127 -9.528 -1.970
100 3HB ALA 12 3HB ALA 12 -5.360 -8.351 -1.520
101 H ALA 13 H ALA 13 -1.233 -7.232 -0.027
102 HA ALA 13 HA ALA 13 0.181 -9.654 -0.831
103 1HB ALA 13 1HB ALA 13 1.565 -7.107 -0.116
104 2HB ALA 13 2HB ALA 13 0.687 -7.231 -1.641
105 3HB ALA 13 3HB ALA 13 2.016 -8.339 -1.295
106 H ALA 14 H ALA 14 -1.031 -8.488 1.983
107 HA ALA 14 HA ALA 14 -0.637 -8.875 4.188
108 1HB ALA 14 1HB ALA 14 1.368 -10.983 3.664
109 2HB ALA 14 2HB ALA 14 -0.232 -11.222 2.962
110 3HB ALA 14 3HB ALA 14 -0.056 -11.002 4.704
111 H ASN 15 H ASN 15 1.060 -6.973 2.760
112 HA ASN 15 HA ASN 15 3.103 -6.696 4.792
113 1HB ASN 15 2HB ASN 15 3.856 -7.988 2.500
114 2HB ASN 15 1HB ASN 15 4.243 -6.315 2.104
115 1HD2 ASN 15 1HD2 ASN 15 6.333 -6.039 2.380
116 2HD2 ASN 15 2HD2 ASN 15 7.257 -6.562 3.742
117 H VAL 16 H VAL 16 2.797 -4.687 5.468
118 HA VAL 16 HA VAL 16 1.581 -2.676 3.837
119 HB VAL 16 HB VAL 16 2.966 -2.244 6.483
120 1HG1 VAL 16 1HG1 VAL 16 0.899 -0.733 4.912
121 2HG1 VAL 16 2HG1 VAL 16 2.455 -0.168 5.519
122 3HG1 VAL 16 3HG1 VAL 16 1.131 -0.479 6.641
123 1HG2 VAL 16 1HG2 VAL 16 0.494 -3.687 5.852
124 2HG2 VAL 16 2HG2 VAL 16 0.311 -2.432 7.077
125 3HG2 VAL 16 3HG2 VAL 16 1.491 -3.722 7.306
126 H ALA 17 H ALA 17 4.856 -3.433 4.851
127 HA ALA 17 HA ALA 17 6.065 -1.004 4.078
128 1HB ALA 17 1HB ALA 17 7.069 -3.770 4.591
129 2HB ALA 17 2HB ALA 17 7.400 -2.276 5.466
130 3HB ALA 17 3HB ALA 17 8.146 -2.560 3.894
131 H ALA 18 H ALA 18 5.779 -4.119 2.370
132 HA ALA 18 HA ALA 18 7.104 -3.419 0.030
133 1HB ALA 18 1HB ALA 18 5.704 -5.196 -1.048
134 2HB ALA 18 2HB ALA 18 4.814 -5.325 0.468
135 3HB ALA 18 3HB ALA 18 6.536 -5.701 0.423
136 H HIS 19 H HIS 19 3.763 -2.854 0.992
137 HA HIS 19 HA HIS 19 2.962 -1.804 -1.549
138 1HB HIS 19 2HB HIS 19 1.117 -2.599 -0.429
139 2HB HIS 19 1HB HIS 19 1.722 -2.102 1.146
140 HD2 HIS 19 2HD HIS 19 0.647 0.172 2.114
141 HE1 HIS 19 1HE HIS 19 -1.141 1.474 -1.486
142 HE2 HIS 19 2HE HIS 19 -0.761 2.015 0.961
143 H MET 20 H MET 20 3.355 -0.259 1.648
144 HA MET 20 HA MET 20 3.057 2.364 0.933
145 1HB MET 20 2HB MET 20 4.675 1.004 3.044
146 2HB MET 20 1HB MET 20 4.876 2.735 2.810
147 1HG MET 20 2HG MET 20 2.218 2.646 2.912
148 2HG MET 20 1HG MET 20 2.577 1.212 3.874
149 1HE MET 20 1HE MET 20 4.619 1.457 5.886
150 2HE MET 20 2HE MET 20 5.189 3.046 6.395
151 3HE MET 20 3HE MET 20 5.553 2.457 4.773
152 H THR 21 H THR 21 6.055 0.462 0.753
153 HA THR 21 HA THR 21 7.787 2.501 -0.014
154 HB THR 21 HB THR 21 8.494 0.214 0.625
155 HG1 THR 21 1HG THR 21 10.206 0.154 -0.794
156 1HG2 THR 21 1HG2 THR 21 6.973 -0.523 -1.744
157 2HG2 THR 21 2HG2 THR 21 7.483 -1.499 -0.366
158 3HG2 THR 21 3HG2 THR 21 8.598 -1.207 -1.701
159 H HIS 22 H HIS 22 5.305 0.911 -1.811
160 HA HIS 22 HA HIS 22 6.171 2.292 -4.243
161 1HB HIS 22 2HB HIS 22 6.103 0.280 -5.233
162 2HB HIS 22 1HB HIS 22 5.432 -0.457 -3.787
163 HD1 HIS 22 1HD HIS 22 4.706 -0.154 -7.198
164 HD2 HIS 22 2HD HIS 22 2.394 0.240 -3.755
165 HE1 HIS 22 1HE HIS 22 2.326 -0.465 -7.944
166 HE2 HIS 22 2HE HIS 22 0.945 -0.153 -5.861
167 H CYS 23 H CYS 23 4.097 2.623 -1.808
168 HA CYS 23 HA CYS 23 2.128 4.000 -3.465
169 1HB CYS 23 2HB CYS 23 1.704 1.655 -1.720
170 2HB CYS 23 1HB CYS 23 0.534 2.945 -1.541
171 H ALA 24 H ALA 24 3.246 5.887 -2.662
172 HA ALA 24 HA ALA 24 3.393 6.438 0.139
173 1HB ALA 24 1HB ALA 24 4.672 7.444 -2.006
174 2HB ALA 24 2HB ALA 24 4.579 8.266 -0.448
175 3HB ALA 24 3HB ALA 24 3.467 8.705 -1.744
176 H LYS 25 H LYS 25 2.433 8.649 0.890
177 HA LYS 25 HA LYS 25 -0.344 8.902 -0.034
178 1HB LYS 25 2HB LYS 25 -0.286 7.491 2.000
179 2HB LYS 25 1HB LYS 25 0.510 8.799 2.864
180 1HG LYS 25 2HG LYS 25 -2.079 9.383 1.536
181 2HG LYS 25 1HG LYS 25 -2.095 8.410 3.009
182 1HD LYS 25 2HD LYS 25 -0.676 10.230 4.059
183 2HD LYS 25 1HD LYS 25 -1.054 11.210 2.640
184 1HE LYS 25 2HE LYS 25 -2.934 10.137 4.726
185 2HE LYS 25 1HE LYS 25 -2.631 11.817 4.288
186 1HZ LYS 25 1HZ LYS 25 -4.649 11.313 3.283
187 2HZ LYS 25 2HZ LYS 25 -4.150 9.773 2.794
188 3HZ LYS 25 3HZ LYS 25 -3.538 11.146 2.017
Start of MODEL 16
1 1H ARG 1 1HT ARG 1 -1.028 1.408 8.196
2 2H ARG 1 2HT ARG 1 0.060 0.104 8.435
3 3H ARG 1 3HT ARG 1 -1.046 0.538 9.672
4 HA ARG 1 HA ARG 1 -1.754 -1.423 8.545
5 1HB ARG 1 2HB ARG 1 -3.222 0.734 9.250
6 2HB ARG 1 1HB ARG 1 -3.655 0.622 7.549
7 1HG ARG 1 2HG ARG 1 -5.249 -0.755 8.318
8 2HG ARG 1 1HG ARG 1 -3.953 -1.952 8.280
9 1HD ARG 1 2HD ARG 1 -3.745 -1.999 10.541
10 2HD ARG 1 1HD ARG 1 -4.176 -0.299 10.724
11 HE ARG 1 HE ARG 1 -6.454 -1.669 9.890
12 1HH1 ARG 1 1HH1 ARG 1 -4.336 -1.554 12.659
13 2HH1 ARG 1 2HH1 ARG 1 -5.570 -2.017 13.781
14 1HH2 ARG 1 1HH2 ARG 1 -8.081 -2.278 11.363
15 2HH2 ARG 1 2HH2 ARG 1 -7.697 -2.429 13.046
16 H VAL 2 H VAL 2 -2.980 -2.150 6.544
17 HA VAL 2 HA VAL 2 -1.927 -0.937 4.090
18 HB VAL 2 HB VAL 2 -0.407 -2.776 4.655
19 1HG1 VAL 2 1HG1 VAL 2 -2.959 -4.279 4.921
20 2HG1 VAL 2 2HG1 VAL 2 -1.494 -4.352 5.900
21 3HG1 VAL 2 3HG1 VAL 2 -1.539 -5.136 4.320
22 1HG2 VAL 2 1HG2 VAL 2 -1.991 -2.617 2.226
23 2HG2 VAL 2 2HG2 VAL 2 -1.322 -4.228 2.486
24 3HG2 VAL 2 3HG2 VAL 2 -0.253 -2.827 2.431
25 H ILE 3 H ILE 3 -4.443 -0.466 4.837
26 HA ILE 3 HA ILE 3 -6.037 -2.234 3.099
27 HB ILE 3 HB ILE 3 -6.636 -2.548 5.475
28 1HG1 ILE 3 2HG1 ILE 3 -9.014 -1.133 4.429
29 2HG1 ILE 3 1HG1 ILE 3 -8.302 -2.328 3.349
30 1HG2 ILE 3 1HG2 ILE 3 -6.584 0.340 5.461
31 2HG2 ILE 3 2HG2 ILE 3 -6.578 -0.781 6.821
32 3HG2 ILE 3 3HG2 ILE 3 -8.106 -0.275 6.104
33 1HD1 ILE 3 1HD1 ILE 3 -9.918 -2.699 5.709
34 2HD1 ILE 3 2HD1 ILE 3 -8.407 -3.604 5.803
35 3HD1 ILE 3 3HD1 ILE 3 -9.495 -3.844 4.436
36 H ALA 4 H ALA 4 -4.636 0.141 2.321
37 HA ALA 4 HA ALA 4 -6.929 1.817 1.553
38 1HB ALA 4 1HB ALA 4 -4.232 2.697 2.533
39 2HB ALA 4 2HB ALA 4 -5.828 3.164 3.121
40 3HB ALA 4 3HB ALA 4 -5.259 3.749 1.558
41 H CYS 5 H CYS 5 -5.619 -0.401 0.163
42 HA CYS 5 HA CYS 5 -4.629 1.067 -2.194
43 1HB CYS 5 2HB CYS 5 -2.944 -0.409 -0.962
44 2HB CYS 5 1HB CYS 5 -3.889 -1.780 -1.531
45 H PHE 6 H PHE 6 -5.085 0.047 -4.270
46 HA PHE 6 HA PHE 6 -7.497 -1.642 -4.209
47 1HB PHE 6 2HB PHE 6 -8.370 -0.415 -6.137
48 2HB PHE 6 1HB PHE 6 -8.096 0.675 -4.781
49 HD1 PHE 6 1HD PHE 6 -7.573 0.156 -8.218
50 HD2 PHE 6 2HD PHE 6 -5.785 1.890 -4.768
51 HE1 PHE 6 1HE PHE 6 -6.192 1.594 -9.661
52 HE2 PHE 6 2HE PHE 6 -4.402 3.331 -6.204
53 HZ PHE 6 HZ PHE 6 -4.604 3.184 -8.654
54 H LEU 7 H LEU 7 -4.779 -2.507 -4.466
55 HA LEU 7 HA LEU 7 -4.818 -3.518 -7.234
56 1HB LEU 7 2HB LEU 7 -2.574 -2.556 -5.524
57 2HB LEU 7 1HB LEU 7 -2.257 -3.858 -6.655
58 HG LEU 7 HG LEU 7 -3.502 -1.266 -7.537
59 1HD1 LEU 7 1HD1 LEU 7 -1.145 -1.182 -6.347
60 2HD1 LEU 7 2HD1 LEU 7 -1.483 -0.245 -7.802
61 3HD1 LEU 7 3HD1 LEU 7 -0.601 -1.767 -7.919
62 1HD2 LEU 7 1HD2 LEU 7 -2.965 -1.946 -9.697
63 2HD2 LEU 7 2HD2 LEU 7 -3.515 -3.433 -8.925
64 3HD2 LEU 7 3HD2 LEU 7 -1.789 -3.134 -9.135
65 H LYS 8 H LYS 8 -4.586 -5.683 -7.550
66 HA LYS 8 HA LYS 8 -5.218 -7.432 -5.427
67 1HB LYS 8 2HB LYS 8 -4.510 -7.730 -8.300
68 2HB LYS 8 1HB LYS 8 -4.349 -9.153 -7.281
69 1HG LYS 8 2HG LYS 8 -6.578 -9.393 -7.023
70 2HG LYS 8 1HG LYS 8 -6.876 -7.653 -7.031
71 1HD LYS 8 2HD LYS 8 -5.913 -8.770 -9.577
72 2HD LYS 8 1HD LYS 8 -7.509 -9.329 -9.069
73 1HE LYS 8 2HE LYS 8 -8.459 -7.305 -9.372
74 2HE LYS 8 1HE LYS 8 -7.034 -6.436 -8.804
75 1HZ LYS 8 1HZ LYS 8 -6.846 -7.809 -11.378
76 2HZ LYS 8 2HZ LYS 8 -6.143 -6.355 -10.875
77 3HZ LYS 8 3HZ LYS 8 -7.776 -6.396 -11.316
78 H VAL 9 H VAL 9 -2.193 -6.897 -7.218
79 HA VAL 9 HA VAL 9 -0.759 -8.581 -5.311
80 HB VAL 9 HB VAL 9 -0.297 -8.882 -7.713
81 1HG1 VAL 9 1HG1 VAL 9 -0.463 -6.182 -7.913
82 2HG1 VAL 9 2HG1 VAL 9 0.261 -7.231 -9.132
83 3HG1 VAL 9 3HG1 VAL 9 1.284 -6.419 -7.947
84 1HG2 VAL 9 1HG2 VAL 9 2.253 -7.756 -6.737
85 2HG2 VAL 9 2HG2 VAL 9 1.884 -9.365 -7.358
86 3HG2 VAL 9 3HG2 VAL 9 1.472 -8.944 -5.695
87 H CYS 10 H CYS 10 -1.729 -6.331 -4.107
88 HA CYS 10 HA CYS 10 0.730 -5.018 -3.310
89 1HB CYS 10 2HB CYS 10 -0.554 -3.731 -5.245
90 2HB CYS 10 1HB CYS 10 -1.537 -3.168 -3.897
91 H ALA 11 H ALA 11 -2.809 -4.699 -2.955
92 HA ALA 11 HA ALA 11 -2.609 -4.051 -0.174
93 1HB ALA 11 1HB ALA 11 -4.793 -3.518 -0.312
94 2HB ALA 11 2HB ALA 11 -5.204 -4.987 -1.198
95 3HB ALA 11 3HB ALA 11 -4.501 -3.611 -2.049
96 H ALA 12 H ALA 12 -3.773 -6.895 -1.970
97 HA ALA 12 HA ALA 12 -4.032 -8.431 0.473
98 1HB ALA 12 1HB ALA 12 -5.252 -9.925 -0.730
99 2HB ALA 12 2HB ALA 12 -4.266 -9.732 -2.181
100 3HB ALA 12 3HB ALA 12 -5.462 -8.507 -1.759
101 H ALA 13 H ALA 13 -1.355 -7.544 -0.140
102 HA ALA 13 HA ALA 13 -0.010 -10.030 -0.913
103 1HB ALA 13 1HB ALA 13 2.033 -8.359 -0.747
104 2HB ALA 13 2HB ALA 13 0.756 -7.163 -0.968
105 3HB ALA 13 3HB ALA 13 1.000 -8.425 -2.175
106 H ALA 14 H ALA 14 -1.097 -8.634 1.848
107 HA ALA 14 HA ALA 14 -0.630 -8.867 4.061
108 1HB ALA 14 1HB ALA 14 0.853 -10.903 4.615
109 2HB ALA 14 2HB ALA 14 0.779 -11.235 2.885
110 3HB ALA 14 3HB ALA 14 -0.705 -11.179 3.837
111 H ASN 15 H ASN 15 1.049 -7.111 2.439
112 HA ASN 15 HA ASN 15 3.295 -6.904 4.301
113 1HB ASN 15 2HB ASN 15 3.747 -7.967 1.853
114 2HB ASN 15 1HB ASN 15 3.950 -6.256 1.488
115 1HD2 ASN 15 1HD2 ASN 15 5.567 -8.943 2.309
116 2HD2 ASN 15 2HD2 ASN 15 6.928 -8.251 3.115
117 H VAL 16 H VAL 16 2.805 -5.037 5.274
118 HA VAL 16 HA VAL 16 1.468 -2.882 3.974
119 HB VAL 16 HB VAL 16 3.002 -2.746 6.569
120 1HG1 VAL 16 1HG1 VAL 16 0.918 -1.052 5.254
121 2HG1 VAL 16 2HG1 VAL 16 2.436 -0.571 6.011
122 3HG1 VAL 16 3HG1 VAL 16 1.072 -1.073 7.010
123 1HG2 VAL 16 1HG2 VAL 16 0.413 -3.054 7.310
124 2HG2 VAL 16 2HG2 VAL 16 1.591 -4.365 7.243
125 3HG2 VAL 16 3HG2 VAL 16 0.485 -4.103 5.894
126 H ALA 17 H ALA 17 4.811 -3.343 5.108
127 HA ALA 17 HA ALA 17 5.807 -0.859 4.294
128 1HB ALA 17 1HB ALA 17 7.111 -3.523 4.747
129 2HB ALA 17 2HB ALA 17 7.160 -2.080 5.760
130 3HB ALA 17 3HB ALA 17 8.037 -2.114 4.231
131 H ALA 18 H ALA 18 5.722 -3.970 2.578
132 HA ALA 18 HA ALA 18 7.092 -3.202 0.276
133 1HB ALA 18 1HB ALA 18 6.207 -5.527 1.051
134 2HB ALA 18 2HB ALA 18 6.374 -5.178 -0.670
135 3HB ALA 18 3HB ALA 18 4.788 -5.093 0.098
136 H HIS 19 H HIS 19 3.714 -2.790 1.169
137 HA HIS 19 HA HIS 19 2.904 -1.814 -1.396
138 1HB HIS 19 2HB HIS 19 1.078 -2.673 -0.293
139 2HB HIS 19 1HB HIS 19 1.640 -2.132 1.283
140 HD2 HIS 19 2HD HIS 19 0.473 0.121 2.205
141 HE1 HIS 19 1HE HIS 19 -1.345 1.280 -1.427
142 HE2 HIS 19 2HE HIS 19 -1.001 1.882 1.010
143 H MET 20 H MET 20 3.158 -0.201 1.780
144 HA MET 20 HA MET 20 2.759 2.392 1.023
145 1HB MET 20 2HB MET 20 3.040 1.664 3.352
146 2HB MET 20 1HB MET 20 4.759 1.423 3.071
147 1HG MET 20 2HG MET 20 4.505 3.988 2.298
148 2HG MET 20 1HG MET 20 3.239 3.899 3.520
149 1HE MET 20 1HE MET 20 4.733 1.417 5.076
150 2HE MET 20 2HE MET 20 3.935 2.640 6.065
151 3HE MET 20 3HE MET 20 5.618 2.213 6.378
152 H THR 21 H THR 21 5.846 0.634 0.915
153 HA THR 21 HA THR 21 7.487 2.744 0.134
154 HB THR 21 HB THR 21 8.300 0.510 0.828
155 HG1 THR 21 1HG THR 21 9.641 1.947 -0.396
156 1HG2 THR 21 1HG2 THR 21 8.506 -0.957 -1.458
157 2HG2 THR 21 2HG2 THR 21 6.853 -0.351 -1.548
158 3HG2 THR 21 3HG2 THR 21 7.380 -1.270 -0.139
159 H HIS 22 H HIS 22 5.122 0.987 -1.670
160 HA HIS 22 HA HIS 22 5.956 2.361 -4.116
161 1HB HIS 22 2HB HIS 22 5.991 0.328 -5.063
162 2HB HIS 22 1HB HIS 22 5.334 -0.408 -3.609
163 HD1 HIS 22 1HD HIS 22 4.641 -0.209 -7.035
164 HD2 HIS 22 2HD HIS 22 2.267 0.151 -3.630
165 HE1 HIS 22 1HE HIS 22 2.287 -0.644 -7.803
166 HE2 HIS 22 2HE HIS 22 0.866 -0.355 -5.744
167 H CYS 23 H CYS 23 3.834 2.651 -1.718
168 HA CYS 23 HA CYS 23 1.829 3.901 -3.430
169 1HB CYS 23 2HB CYS 23 1.489 1.577 -1.641
170 2HB CYS 23 1HB CYS 23 0.258 2.816 -1.503
171 H ALA 24 H ALA 24 3.971 4.917 -1.698
172 HA ALA 24 HA ALA 24 3.038 5.794 0.789
173 1HB ALA 24 1HB ALA 24 5.296 6.094 0.583
174 2HB ALA 24 2HB ALA 24 4.741 7.737 0.263
175 3HB ALA 24 3HB ALA 24 5.180 6.677 -1.076
176 H LYS 25 H LYS 25 2.954 8.339 1.169
177 HA LYS 25 HA LYS 25 1.046 9.482 -0.760
178 1HB LYS 25 2HB LYS 25 -0.165 8.629 1.205
179 2HB LYS 25 1HB LYS 25 0.843 9.615 2.254
180 1HG LYS 25 2HG LYS 25 -0.093 11.521 0.618
181 2HG LYS 25 1HG LYS 25 -1.434 10.376 0.544
182 1HD LYS 25 2HD LYS 25 -0.230 11.520 3.064
183 2HD LYS 25 1HD LYS 25 -1.749 12.031 2.326
184 1HE LYS 25 2HE LYS 25 -1.254 9.183 3.146
185 2HE LYS 25 1HE LYS 25 -1.878 10.385 4.276
186 1HZ LYS 25 1HZ LYS 25 -3.654 9.116 3.223
187 2HZ LYS 25 2HZ LYS 25 -3.147 9.637 1.696
188 3HZ LYS 25 3HZ LYS 25 -3.752 10.755 2.812
Start of MODEL 17
1 1H ARG 1 1HT ARG 1 -1.577 1.896 6.586
2 2H ARG 1 2HT ARG 1 -0.374 0.787 7.102
3 3H ARG 1 3HT ARG 1 -1.520 1.396 8.224
4 HA ARG 1 HA ARG 1 -1.951 -0.873 7.500
5 1HB ARG 1 2HB ARG 1 -3.633 1.143 8.084
6 2HB ARG 1 1HB ARG 1 -4.193 0.774 6.459
7 1HG ARG 1 2HG ARG 1 -5.525 -0.673 7.541
8 2HG ARG 1 1HG ARG 1 -4.096 -1.707 7.489
9 1HD ARG 1 2HD ARG 1 -3.651 -1.437 9.708
10 2HD ARG 1 1HD ARG 1 -4.329 0.189 9.756
11 HE ARG 1 HE ARG 1 -6.333 -1.798 9.332
12 1HH1 ARG 1 1HH1 ARG 1 -4.368 -0.277 11.784
13 2HH1 ARG 1 2HH1 ARG 1 -5.489 -0.604 13.062
14 1HH2 ARG 1 1HH2 ARG 1 -7.808 -2.228 11.012
15 2HH2 ARG 1 2HH2 ARG 1 -7.442 -1.713 12.625
16 H VAL 2 H VAL 2 -2.458 -2.306 5.862
17 HA VAL 2 HA VAL 2 -1.807 -1.373 3.164
18 HB VAL 2 HB VAL 2 -0.539 -3.293 4.050
19 1HG1 VAL 2 1HG1 VAL 2 -1.639 -4.755 5.321
20 2HG1 VAL 2 2HG1 VAL 2 -2.248 -5.452 3.821
21 3HG1 VAL 2 3HG1 VAL 2 -3.205 -4.250 4.686
22 1HG2 VAL 2 1HG2 VAL 2 -1.961 -3.185 1.552
23 2HG2 VAL 2 2HG2 VAL 2 -1.684 -4.860 2.030
24 3HG2 VAL 2 3HG2 VAL 2 -0.323 -3.747 1.885
25 H ILE 3 H ILE 3 -4.342 -0.669 4.161
26 HA ILE 3 HA ILE 3 -6.147 -2.425 2.633
27 HB ILE 3 HB ILE 3 -6.742 -2.186 5.006
28 1HG1 ILE 3 2HG1 ILE 3 -8.798 -0.635 3.461
29 2HG1 ILE 3 1HG1 ILE 3 -8.440 -2.304 3.031
30 1HG2 ILE 3 1HG2 ILE 3 -5.835 0.000 5.460
31 2HG2 ILE 3 2HG2 ILE 3 -7.558 -0.008 5.841
32 3HG2 ILE 3 3HG2 ILE 3 -6.987 0.745 4.352
33 1HD1 ILE 3 1HD1 ILE 3 -9.633 -1.227 5.553
34 2HD1 ILE 3 2HD1 ILE 3 -8.886 -2.823 5.498
35 3HD1 ILE 3 3HD1 ILE 3 -10.263 -2.458 4.458
36 H ALA 4 H ALA 4 -4.966 0.835 3.013
37 HA ALA 4 HA ALA 4 -6.855 2.243 1.521
38 1HB ALA 4 1HB ALA 4 -5.165 3.368 2.841
39 2HB ALA 4 2HB ALA 4 -5.074 3.905 1.163
40 3HB ALA 4 3HB ALA 4 -3.895 2.750 1.786
41 H CYS 5 H CYS 5 -4.334 0.083 0.505
42 HA CYS 5 HA CYS 5 -3.941 0.904 -2.126
43 1HB CYS 5 2HB CYS 5 -2.764 -0.959 -0.746
44 2HB CYS 5 1HB CYS 5 -4.027 -2.006 -1.381
45 H PHE 6 H PHE 6 -5.128 0.823 -3.929
46 HA PHE 6 HA PHE 6 -7.778 -0.411 -3.772
47 1HB PHE 6 2HB PHE 6 -8.268 0.945 -5.801
48 2HB PHE 6 1HB PHE 6 -7.779 1.921 -4.420
49 HD1 PHE 6 1HD PHE 6 -6.865 0.746 -7.749
50 HD2 PHE 6 2HD PHE 6 -5.642 3.063 -4.397
51 HE1 PHE 6 1HE PHE 6 -5.107 1.788 -9.118
52 HE2 PHE 6 2HE PHE 6 -3.881 4.111 -5.760
53 HZ PHE 6 HZ PHE 6 -3.611 3.474 -8.123
54 H LEU 7 H LEU 7 -5.474 -2.074 -4.104
55 HA LEU 7 HA LEU 7 -6.065 -3.188 -6.764
56 1HB LEU 7 2HB LEU 7 -3.358 -3.444 -5.496
57 2HB LEU 7 1HB LEU 7 -3.809 -3.684 -7.172
58 HG LEU 7 HG LEU 7 -3.901 -0.979 -5.853
59 1HD1 LEU 7 1HD1 LEU 7 -1.639 -1.577 -5.645
60 2HD1 LEU 7 2HD1 LEU 7 -1.730 -0.617 -7.122
61 3HD1 LEU 7 3HD1 LEU 7 -1.618 -2.374 -7.218
62 1HD2 LEU 7 1HD2 LEU 7 -3.733 -0.225 -8.214
63 2HD2 LEU 7 2HD2 LEU 7 -5.206 -1.131 -7.863
64 3HD2 LEU 7 3HD2 LEU 7 -3.874 -1.910 -8.720
65 H LYS 8 H LYS 8 -4.416 -5.476 -6.454
66 HA LYS 8 HA LYS 8 -5.565 -6.828 -4.114
67 1HB LYS 8 2HB LYS 8 -5.483 -8.123 -6.835
68 2HB LYS 8 1HB LYS 8 -6.310 -8.688 -5.391
69 1HG LYS 8 2HG LYS 8 -7.885 -6.847 -5.542
70 2HG LYS 8 1HG LYS 8 -7.031 -6.217 -6.953
71 1HD LYS 8 2HD LYS 8 -7.505 -8.779 -7.724
72 2HD LYS 8 1HD LYS 8 -8.925 -8.454 -6.728
73 1HE LYS 8 2HE LYS 8 -9.749 -6.907 -8.167
74 2HE LYS 8 1HE LYS 8 -8.149 -6.344 -8.646
75 1HZ LYS 8 1HZ LYS 8 -9.108 -9.006 -9.477
76 2HZ LYS 8 2HZ LYS 8 -7.929 -8.028 -10.195
77 3HZ LYS 8 3HZ LYS 8 -9.564 -7.623 -10.340
78 H VAL 9 H VAL 9 -3.254 -7.047 -6.804
79 HA VAL 9 HA VAL 9 -1.700 -9.123 -5.664
80 HB VAL 9 HB VAL 9 -1.627 -8.603 -8.063
81 1HG1 VAL 9 1HG1 VAL 9 0.145 -6.263 -7.596
82 2HG1 VAL 9 2HG1 VAL 9 -1.599 -6.032 -7.460
83 3HG1 VAL 9 3HG1 VAL 9 -0.904 -6.635 -8.965
84 1HG2 VAL 9 1HG2 VAL 9 1.166 -8.061 -7.291
85 2HG2 VAL 9 2HG2 VAL 9 0.491 -9.350 -8.288
86 3HG2 VAL 9 3HG2 VAL 9 0.414 -9.463 -6.530
87 H CYS 10 H CYS 10 -1.720 -5.658 -5.297
88 HA CYS 10 HA CYS 10 0.824 -5.645 -3.886
89 1HB CYS 10 2HB CYS 10 0.237 -3.794 -5.428
90 2HB CYS 10 1HB CYS 10 -1.119 -3.379 -4.384
91 H ALA 11 H ALA 11 -2.564 -4.789 -3.189
92 HA ALA 11 HA ALA 11 -2.191 -4.323 -0.438
93 1HB ALA 11 1HB ALA 11 -4.404 -3.887 -0.386
94 2HB ALA 11 2HB ALA 11 -4.823 -5.341 -1.291
95 3HB ALA 11 3HB ALA 11 -4.232 -3.913 -2.141
96 H ALA 12 H ALA 12 -3.195 -7.218 -2.220
97 HA ALA 12 HA ALA 12 -3.375 -8.782 0.212
98 1HB ALA 12 1HB ALA 12 -4.516 -10.305 -1.000
99 2HB ALA 12 2HB ALA 12 -3.453 -10.150 -2.399
100 3HB ALA 12 3HB ALA 12 -4.710 -8.947 -2.110
101 H ALA 13 H ALA 13 -0.765 -7.687 -0.351
102 HA ALA 13 HA ALA 13 0.795 -10.020 -1.174
103 1HB ALA 13 1HB ALA 13 2.169 -7.516 -0.424
104 2HB ALA 13 2HB ALA 13 1.131 -7.451 -1.847
105 3HB ALA 13 3HB ALA 13 2.457 -8.611 -1.776
106 H ALA 14 H ALA 14 -0.517 -8.925 1.623
107 HA ALA 14 HA ALA 14 -0.130 -9.294 3.833
108 1HB ALA 14 1HB ALA 14 1.637 -11.226 4.213
109 2HB ALA 14 2HB ALA 14 1.375 -11.472 2.487
110 3HB ALA 14 3HB ALA 14 0.015 -11.558 3.606
111 H ASN 15 H ASN 15 1.348 -7.203 2.590
112 HA ASN 15 HA ASN 15 3.483 -6.949 4.542
113 1HB ASN 15 2HB ASN 15 4.208 -7.867 2.093
114 2HB ASN 15 1HB ASN 15 4.323 -6.129 1.828
115 1HD2 ASN 15 1HD2 ASN 15 6.158 -8.631 2.442
116 2HD2 ASN 15 2HD2 ASN 15 7.352 -7.940 3.482
117 H VAL 16 H VAL 16 2.891 -5.130 5.524
118 HA VAL 16 HA VAL 16 1.439 -3.048 4.206
119 HB VAL 16 HB VAL 16 2.798 -2.890 6.895
120 1HG1 VAL 16 1HG1 VAL 16 0.240 -1.527 6.324
121 2HG1 VAL 16 2HG1 VAL 16 1.674 -0.884 5.523
122 3HG1 VAL 16 3HG1 VAL 16 1.621 -0.996 7.282
123 1HG2 VAL 16 1HG2 VAL 16 0.153 -4.081 6.110
124 2HG2 VAL 16 2HG2 VAL 16 0.483 -3.516 7.748
125 3HG2 VAL 16 3HG2 VAL 16 1.452 -4.813 7.051
126 H ALA 17 H ALA 17 4.758 -3.385 5.417
127 HA ALA 17 HA ALA 17 5.601 -0.775 4.752
128 1HB ALA 17 1HB ALA 17 6.921 -3.310 5.517
129 2HB ALA 17 2HB ALA 17 7.097 -1.689 6.190
130 3HB ALA 17 3HB ALA 17 7.916 -2.113 4.686
131 H ALA 18 H ALA 18 5.890 -3.864 3.015
132 HA ALA 18 HA ALA 18 7.325 -2.935 0.808
133 1HB ALA 18 1HB ALA 18 6.923 -4.977 -0.151
134 2HB ALA 18 2HB ALA 18 5.261 -5.049 0.433
135 3HB ALA 18 3HB ALA 18 6.599 -5.351 1.541
136 H HIS 19 H HIS 19 3.926 -2.726 1.583
137 HA HIS 19 HA HIS 19 3.089 -1.949 -1.042
138 1HB HIS 19 2HB HIS 19 1.308 -2.844 0.110
139 2HB HIS 19 1HB HIS 19 1.815 -2.155 1.647
140 HD2 HIS 19 2HD HIS 19 0.493 0.074 2.391
141 HE1 HIS 19 1HE HIS 19 -1.309 0.875 -1.346
142 HE2 HIS 19 2HE HIS 19 -1.053 1.662 1.050
143 H MET 20 H MET 20 3.172 -0.127 2.029
144 HA MET 20 HA MET 20 2.661 2.386 1.106
145 1HB MET 20 2HB MET 20 2.941 1.803 3.483
146 2HB MET 20 1HB MET 20 4.677 1.671 3.242
147 1HG MET 20 2HG MET 20 4.269 4.160 2.316
148 2HG MET 20 1HG MET 20 2.975 4.056 3.509
149 1HE MET 20 1HE MET 20 4.306 6.218 4.501
150 2HE MET 20 2HE MET 20 5.716 6.025 3.460
151 3HE MET 20 3HE MET 20 5.919 6.121 5.209
152 H THR 21 H THR 21 5.843 0.801 1.167
153 HA THR 21 HA THR 21 7.380 2.948 0.281
154 HB THR 21 HB THR 21 8.321 0.836 1.138
155 HG1 THR 21 1HG THR 21 10.040 0.764 -0.309
156 1HG2 THR 21 1HG2 THR 21 7.070 -0.281 -1.294
157 2HG2 THR 21 2HG2 THR 21 7.314 -1.002 0.297
158 3HG2 THR 21 3HG2 THR 21 8.659 -0.894 -0.839
159 H HIS 22 H HIS 22 5.175 0.923 -1.450
160 HA HIS 22 HA HIS 22 5.981 2.182 -3.966
161 1HB HIS 22 2HB HIS 22 6.148 0.095 -4.771
162 2HB HIS 22 1HB HIS 22 5.501 -0.576 -3.283
163 HD1 HIS 22 1HD HIS 22 4.872 -0.652 -6.725
164 HD2 HIS 22 2HD HIS 22 2.410 -0.193 -3.396
165 HE1 HIS 22 1HE HIS 22 2.564 -1.269 -7.503
166 HE2 HIS 22 2HE HIS 22 1.085 -0.920 -5.496
167 H CYS 23 H CYS 23 3.794 2.515 -1.635
168 HA CYS 23 HA CYS 23 1.762 3.532 -3.465
169 1HB CYS 23 2HB CYS 23 1.511 1.319 -1.526
170 2HB CYS 23 1HB CYS 23 0.210 2.491 -1.498
171 H ALA 24 H ALA 24 3.727 4.928 -1.951
172 HA ALA 24 HA ALA 24 2.879 5.859 0.538
173 1HB ALA 24 1HB ALA 24 5.119 6.229 -0.578
174 2HB ALA 24 2HB ALA 24 4.445 7.610 0.286
175 3HB ALA 24 3HB ALA 24 4.353 7.541 -1.474
176 H LYS 25 H LYS 25 2.125 8.101 1.022
177 HA LYS 25 HA LYS 25 0.116 9.001 -0.936
178 1HB LYS 25 2HB LYS 25 -0.974 7.817 0.914
179 2HB LYS 25 1HB LYS 25 -0.185 8.881 2.070
180 1HG LYS 25 2HG LYS 25 -1.787 10.203 -0.021
181 2HG LYS 25 1HG LYS 25 -2.680 9.252 1.168
182 1HD LYS 25 2HD LYS 25 -0.946 10.620 2.760
183 2HD LYS 25 1HD LYS 25 -1.239 11.792 1.474
184 1HE LYS 25 2HE LYS 25 -3.350 10.400 3.119
185 2HE LYS 25 1HE LYS 25 -2.822 12.070 3.317
186 1HZ LYS 25 1HZ LYS 25 -4.928 11.509 1.921
187 2HZ LYS 25 2HZ LYS 25 -3.807 11.192 0.694
188 3HZ LYS 25 3HZ LYS 25 -3.870 12.725 1.407
Start of MODEL 18
1 1H ARG 1 1HT ARG 1 -0.609 -0.030 7.456
2 2H ARG 1 2HT ARG 1 -1.458 0.137 8.937
3 3H ARG 1 3HT ARG 1 -1.734 1.248 7.658
4 HA ARG 1 HA ARG 1 -2.472 -1.589 7.815
5 1HB ARG 1 2HB ARG 1 -3.774 0.621 8.668
6 2HB ARG 1 1HB ARG 1 -4.325 0.575 6.999
7 1HG ARG 1 2HG ARG 1 -5.931 -0.748 7.827
8 2HG ARG 1 1HG ARG 1 -4.697 -2.003 7.709
9 1HD ARG 1 2HD ARG 1 -4.038 -1.181 10.096
10 2HD ARG 1 1HD ARG 1 -5.672 -0.519 10.112
11 HE ARG 1 HE ARG 1 -6.499 -2.645 10.316
12 1HH1 ARG 1 1HH1 ARG 1 -3.149 -2.819 9.352
13 2HH1 ARG 1 2HH1 ARG 1 -3.046 -4.534 9.569
14 1HH2 ARG 1 1HH2 ARG 1 -6.364 -4.901 10.602
15 2HH2 ARG 1 2HH2 ARG 1 -4.871 -5.716 10.278
16 H VAL 2 H VAL 2 -2.354 -2.706 5.987
17 HA VAL 2 HA VAL 2 -1.953 -1.288 3.465
18 HB VAL 2 HB VAL 2 -0.382 -3.094 4.042
19 1HG1 VAL 2 1HG1 VAL 2 -2.860 -4.553 4.509
20 2HG1 VAL 2 2HG1 VAL 2 -1.231 -4.859 5.111
21 3HG1 VAL 2 3HG1 VAL 2 -1.706 -5.445 3.518
22 1HG2 VAL 2 1HG2 VAL 2 -1.265 -4.522 1.828
23 2HG2 VAL 2 2HG2 VAL 2 -0.184 -3.128 1.824
24 3HG2 VAL 2 3HG2 VAL 2 -1.917 -2.900 1.595
25 H ILE 3 H ILE 3 -4.514 -1.010 4.392
26 HA ILE 3 HA ILE 3 -6.084 -2.864 2.726
27 HB ILE 3 HB ILE 3 -6.714 -2.885 5.100
28 1HG1 ILE 3 2HG1 ILE 3 -8.946 -1.476 3.671
29 2HG1 ILE 3 1HG1 ILE 3 -8.379 -3.039 3.092
30 1HG2 ILE 3 1HG2 ILE 3 -7.322 0.037 4.674
31 2HG2 ILE 3 2HG2 ILE 3 -6.080 -0.641 5.725
32 3HG2 ILE 3 3HG2 ILE 3 -7.785 -0.897 6.097
33 1HD1 ILE 3 1HD1 ILE 3 -9.595 -2.391 5.758
34 2HD1 ILE 3 2HD1 ILE 3 -8.791 -3.920 5.406
35 3HD1 ILE 3 3HD1 ILE 3 -10.229 -3.448 4.498
36 H ALA 4 H ALA 4 -5.316 0.478 3.356
37 HA ALA 4 HA ALA 4 -7.366 1.746 1.952
38 1HB ALA 4 1HB ALA 4 -4.640 2.904 1.790
39 2HB ALA 4 2HB ALA 4 -5.326 2.649 3.395
40 3HB ALA 4 3HB ALA 4 -6.171 3.663 2.225
41 H CYS 5 H CYS 5 -4.537 0.062 0.813
42 HA CYS 5 HA CYS 5 -4.320 1.119 -1.761
43 1HB CYS 5 2HB CYS 5 -2.735 -0.491 -0.581
44 2HB CYS 5 1HB CYS 5 -3.830 -1.777 -1.075
45 H PHE 6 H PHE 6 -4.930 0.112 -3.810
46 HA PHE 6 HA PHE 6 -7.430 -1.426 -3.673
47 1HB PHE 6 2HB PHE 6 -8.153 -0.010 -5.710
48 2HB PHE 6 1HB PHE 6 -8.278 0.713 -4.110
49 HD1 PHE 6 1HD PHE 6 -5.658 0.360 -6.752
50 HD2 PHE 6 2HD PHE 6 -7.653 2.906 -3.986
51 HE1 PHE 6 1HE PHE 6 -4.275 2.251 -7.502
52 HE2 PHE 6 2HE PHE 6 -6.275 4.803 -4.733
53 HZ PHE 6 HZ PHE 6 -4.583 4.477 -6.494
54 H LEU 7 H LEU 7 -4.751 -2.323 -4.188
55 HA LEU 7 HA LEU 7 -5.021 -3.153 -7.004
56 1HB LEU 7 2HB LEU 7 -2.568 -2.548 -5.374
57 2HB LEU 7 1HB LEU 7 -2.486 -3.541 -6.817
58 HG LEU 7 HG LEU 7 -3.764 -0.853 -7.015
59 1HD1 LEU 7 1HD1 LEU 7 -1.790 -0.257 -5.847
60 2HD1 LEU 7 2HD1 LEU 7 -1.486 0.069 -7.552
61 3HD1 LEU 7 3HD1 LEU 7 -0.809 -1.373 -6.796
62 1HD2 LEU 7 1HD2 LEU 7 -1.868 -1.906 -9.014
63 2HD2 LEU 7 2HD2 LEU 7 -3.422 -1.104 -9.233
64 3HD2 LEU 7 3HD2 LEU 7 -3.364 -2.814 -8.807
65 H LYS 8 H LYS 8 -4.556 -5.307 -7.519
66 HA LYS 8 HA LYS 8 -5.285 -7.208 -5.557
67 1HB LYS 8 2HB LYS 8 -4.406 -7.301 -8.399
68 2HB LYS 8 1HB LYS 8 -4.294 -8.788 -7.467
69 1HG LYS 8 2HG LYS 8 -6.671 -8.647 -6.941
70 2HG LYS 8 1HG LYS 8 -6.787 -7.143 -7.857
71 1HD LYS 8 2HD LYS 8 -5.670 -9.551 -9.208
72 2HD LYS 8 1HD LYS 8 -7.413 -9.468 -8.942
73 1HE LYS 8 2HE LYS 8 -6.059 -7.086 -10.094
74 2HE LYS 8 1HE LYS 8 -6.275 -8.496 -11.131
75 1HZ LYS 8 1HZ LYS 8 -8.153 -7.115 -11.423
76 2HZ LYS 8 2HZ LYS 8 -8.382 -6.928 -9.758
77 3HZ LYS 8 3HZ LYS 8 -8.674 -8.426 -10.488
78 H VAL 9 H VAL 9 -2.214 -6.882 -7.347
79 HA VAL 9 HA VAL 9 -0.855 -8.500 -5.361
80 HB VAL 9 HB VAL 9 -0.327 -8.810 -7.740
81 1HG1 VAL 9 1HG1 VAL 9 0.059 -5.913 -7.617
82 2HG1 VAL 9 2HG1 VAL 9 -0.338 -6.949 -8.986
83 3HG1 VAL 9 3HG1 VAL 9 1.339 -6.774 -8.470
84 1HG2 VAL 9 1HG2 VAL 9 2.280 -8.111 -7.329
85 2HG2 VAL 9 2HG2 VAL 9 1.518 -9.585 -6.729
86 3HG2 VAL 9 3HG2 VAL 9 1.654 -8.174 -5.681
87 H CYS 10 H CYS 10 -1.674 -6.464 -3.949
88 HA CYS 10 HA CYS 10 0.747 -5.132 -3.170
89 1HB CYS 10 2HB CYS 10 -0.482 -3.766 -5.082
90 2HB CYS 10 1HB CYS 10 -1.484 -3.230 -3.736
91 H ALA 11 H ALA 11 -2.784 -4.716 -2.845
92 HA ALA 11 HA ALA 11 -2.596 -4.182 -0.038
93 1HB ALA 11 1HB ALA 11 -4.426 -3.532 -1.866
94 2HB ALA 11 2HB ALA 11 -4.794 -3.633 -0.144
95 3HB ALA 11 3HB ALA 11 -5.194 -4.979 -1.212
96 H ALA 12 H ALA 12 -3.663 -6.943 -1.993
97 HA ALA 12 HA ALA 12 -4.152 -8.556 0.363
98 1HB ALA 12 1HB ALA 12 -4.938 -10.240 -1.142
99 2HB ALA 12 2HB ALA 12 -4.222 -9.411 -2.523
100 3HB ALA 12 3HB ALA 12 -5.584 -8.686 -1.669
101 H ALA 13 H ALA 13 -1.430 -7.653 0.038
102 HA ALA 13 HA ALA 13 -0.036 -10.154 -0.616
103 1HB ALA 13 1HB ALA 13 1.395 -7.577 -0.145
104 2HB ALA 13 2HB ALA 13 0.556 -7.848 -1.673
105 3HB ALA 13 3HB ALA 13 1.844 -8.943 -1.168
106 H ALA 14 H ALA 14 -1.296 -8.664 2.017
107 HA ALA 14 HA ALA 14 -0.976 -8.832 4.262
108 1HB ALA 14 1HB ALA 14 -0.454 -10.898 5.002
109 2HB ALA 14 2HB ALA 14 1.035 -10.978 4.060
110 3HB ALA 14 3HB ALA 14 -0.517 -11.296 3.285
111 H ASN 15 H ASN 15 0.792 -7.112 2.671
112 HA ASN 15 HA ASN 15 2.996 -6.909 4.608
113 1HB ASN 15 2HB ASN 15 3.165 -7.262 1.723
114 2HB ASN 15 1HB ASN 15 4.002 -5.809 2.257
115 1HD2 ASN 15 1HD2 ASN 15 4.710 -8.695 1.357
116 2HD2 ASN 15 2HD2 ASN 15 5.946 -9.146 2.476
117 H VAL 16 H VAL 16 3.827 -4.761 4.921
118 HA VAL 16 HA VAL 16 1.886 -2.665 4.188
119 HB VAL 16 HB VAL 16 3.601 -2.713 6.674
120 1HG1 VAL 16 1HG1 VAL 16 1.194 -1.002 6.115
121 2HG1 VAL 16 2HG1 VAL 16 2.830 -0.498 5.694
122 3HG1 VAL 16 3HG1 VAL 16 2.410 -0.808 7.378
123 1HG2 VAL 16 1HG2 VAL 16 0.684 -2.983 6.934
124 2HG2 VAL 16 2HG2 VAL 16 1.983 -3.762 7.837
125 3HG2 VAL 16 3HG2 VAL 16 1.512 -4.384 6.255
126 H ALA 17 H ALA 17 5.294 -3.246 5.032
127 HA ALA 17 HA ALA 17 6.244 -0.724 4.208
128 1HB ALA 17 1HB ALA 17 8.438 -2.229 3.934
129 2HB ALA 17 2HB ALA 17 7.456 -3.332 4.897
130 3HB ALA 17 3HB ALA 17 7.817 -1.716 5.502
131 H ALA 18 H ALA 18 6.115 -3.855 2.530
132 HA ALA 18 HA ALA 18 7.375 -3.083 0.162
133 1HB ALA 18 1HB ALA 18 6.291 -5.010 -0.861
134 2HB ALA 18 2HB ALA 18 5.180 -5.123 0.503
135 3HB ALA 18 3HB ALA 18 6.902 -5.414 0.744
136 H HIS 19 H HIS 19 4.053 -2.699 1.229
137 HA HIS 19 HA HIS 19 3.073 -1.814 -1.312
138 1HB HIS 19 2HB HIS 19 1.333 -2.660 -0.068
139 2HB HIS 19 1HB HIS 19 1.980 -2.054 1.451
140 HD2 HIS 19 2HD HIS 19 0.826 0.205 2.366
141 HE1 HIS 19 1HE HIS 19 -1.207 1.223 -1.194
142 HE2 HIS 19 2HE HIS 19 -1.013 1.684 1.296
143 H MET 20 H MET 20 3.499 -0.096 1.791
144 HA MET 20 HA MET 20 3.020 2.467 0.977
145 1HB MET 20 2HB MET 20 3.448 1.823 3.307
146 2HB MET 20 1HB MET 20 5.150 1.585 2.934
147 1HG MET 20 2HG MET 20 5.552 3.852 2.706
148 2HG MET 20 1HG MET 20 3.850 4.228 2.439
149 1HE MET 20 1HE MET 20 2.007 3.605 4.883
150 2HE MET 20 2HE MET 20 2.380 5.030 3.913
151 3HE MET 20 3HE MET 20 2.462 5.115 5.672
152 H THR 21 H THR 21 6.118 0.738 0.736
153 HA THR 21 HA THR 21 7.683 2.841 -0.205
154 HB THR 21 HB THR 21 8.574 0.650 0.503
155 HG1 THR 21 1HG THR 21 10.157 0.529 -1.128
156 1HG2 THR 21 1HG2 THR 21 8.657 -0.944 -1.673
157 2HG2 THR 21 2HG2 THR 21 7.014 -0.311 -1.782
158 3HG2 THR 21 3HG2 THR 21 7.542 -1.152 -0.324
159 H HIS 22 H HIS 22 5.243 0.994 -1.812
160 HA HIS 22 HA HIS 22 5.907 2.305 -4.343
161 1HB HIS 22 2HB HIS 22 5.914 0.243 -5.226
162 2HB HIS 22 1HB HIS 22 5.345 -0.453 -3.717
163 HD1 HIS 22 1HD HIS 22 4.463 -0.366 -7.103
164 HD2 HIS 22 2HD HIS 22 2.279 0.078 -3.583
165 HE1 HIS 22 1HE HIS 22 2.075 -0.844 -7.726
166 HE2 HIS 22 2HE HIS 22 0.768 -0.511 -5.599
167 H CYS 23 H CYS 23 3.928 2.640 -1.830
168 HA CYS 23 HA CYS 23 1.809 3.822 -3.453
169 1HB CYS 23 2HB CYS 23 1.604 1.546 -1.581
170 2HB CYS 23 1HB CYS 23 0.369 2.776 -1.406
171 H ALA 24 H ALA 24 4.047 4.888 -1.858
172 HA ALA 24 HA ALA 24 3.185 5.845 0.640
173 1HB ALA 24 1HB ALA 24 5.519 5.867 0.059
174 2HB ALA 24 2HB ALA 24 4.995 7.521 0.381
175 3HB ALA 24 3HB ALA 24 5.217 6.973 -1.280
176 H LYS 25 H LYS 25 3.055 8.322 1.037
177 HA LYS 25 HA LYS 25 0.850 9.297 -0.608
178 1HB LYS 25 2HB LYS 25 1.947 10.237 2.047
179 2HB LYS 25 1HB LYS 25 0.594 10.990 1.214
180 1HG LYS 25 2HG LYS 25 0.383 8.084 1.666
181 2HG LYS 25 1HG LYS 25 0.316 9.110 3.101
182 1HD LYS 25 2HD LYS 25 -1.347 10.453 1.439
183 2HD LYS 25 1HD LYS 25 -1.616 8.795 0.901
184 1HE LYS 25 2HE LYS 25 -2.356 8.108 3.015
185 2HE LYS 25 1HE LYS 25 -1.677 9.528 3.809
186 1HZ LYS 25 1HZ LYS 25 -4.173 9.253 2.307
187 2HZ LYS 25 2HZ LYS 25 -3.372 10.741 2.236
188 3HZ LYS 25 3HZ LYS 25 -3.858 10.113 3.730
Start of MODEL 19
1 1H ARG 1 1HT ARG 1 -2.906 1.846 6.683
2 2H ARG 1 2HT ARG 1 -1.263 1.610 7.122
3 3H ARG 1 3HT ARG 1 -2.494 1.516 8.314
4 HA ARG 1 HA ARG 1 -1.596 -0.628 7.573
5 1HB ARG 1 2HB ARG 1 -4.052 0.104 8.386
6 2HB ARG 1 1HB ARG 1 -4.466 -0.558 6.810
7 1HG ARG 1 2HG ARG 1 -3.894 -2.691 7.398
8 2HG ARG 1 1HG ARG 1 -2.727 -2.162 8.612
9 1HD ARG 1 2HD ARG 1 -4.789 -1.264 9.874
10 2HD ARG 1 1HD ARG 1 -5.714 -2.317 8.805
11 HE ARG 1 HE ARG 1 -3.816 -3.963 9.811
12 1HH1 ARG 1 1HH1 ARG 1 -6.128 -1.800 11.278
13 2HH1 ARG 1 2HH1 ARG 1 -6.286 -2.746 12.719
14 1HH2 ARG 1 1HH2 ARG 1 -4.023 -5.209 11.705
15 2HH2 ARG 1 2HH2 ARG 1 -5.091 -4.681 12.962
16 H VAL 2 H VAL 2 -2.500 -2.371 5.923
17 HA VAL 2 HA VAL 2 -1.805 -1.345 3.273
18 HB VAL 2 HB VAL 2 -0.525 -3.268 4.133
19 1HG1 VAL 2 1HG1 VAL 2 -1.637 -4.775 5.341
20 2HG1 VAL 2 2HG1 VAL 2 -2.174 -5.452 3.805
21 3HG1 VAL 2 3HG1 VAL 2 -3.192 -4.295 4.662
22 1HG2 VAL 2 1HG2 VAL 2 -1.902 -3.124 1.605
23 2HG2 VAL 2 2HG2 VAL 2 -1.573 -4.800 2.045
24 3HG2 VAL 2 3HG2 VAL 2 -0.252 -3.636 1.957
25 H ILE 3 H ILE 3 -4.367 -0.691 4.190
26 HA ILE 3 HA ILE 3 -6.104 -2.442 2.579
27 HB ILE 3 HB ILE 3 -6.779 -2.293 4.928
28 1HG1 ILE 3 2HG1 ILE 3 -8.894 -0.662 3.661
29 2HG1 ILE 3 1HG1 ILE 3 -8.396 -2.088 2.756
30 1HG2 ILE 3 1HG2 ILE 3 -6.423 0.582 4.433
31 2HG2 ILE 3 2HG2 ILE 3 -6.245 -0.348 5.919
32 3HG2 ILE 3 3HG2 ILE 3 -7.848 0.150 5.378
33 1HD1 ILE 3 1HD1 ILE 3 -10.136 -1.913 4.987
34 2HD1 ILE 3 2HD1 ILE 3 -8.726 -2.865 5.452
35 3HD1 ILE 3 3HD1 ILE 3 -9.682 -3.334 4.046
36 H ALA 4 H ALA 4 -4.884 0.780 2.972
37 HA ALA 4 HA ALA 4 -6.786 2.241 1.536
38 1HB ALA 4 1HB ALA 4 -3.901 2.619 2.169
39 2HB ALA 4 2HB ALA 4 -5.295 3.599 2.624
40 3HB ALA 4 3HB ALA 4 -4.657 3.680 0.981
41 H CYS 5 H CYS 5 -4.280 0.081 0.459
42 HA CYS 5 HA CYS 5 -3.947 0.924 -2.175
43 1HB CYS 5 2HB CYS 5 -2.740 -0.948 -0.814
44 2HB CYS 5 1HB CYS 5 -3.992 -1.995 -1.474
45 H PHE 6 H PHE 6 -5.148 0.809 -3.970
46 HA PHE 6 HA PHE 6 -7.799 -0.417 -3.758
47 1HB PHE 6 2HB PHE 6 -8.384 0.940 -5.709
48 2HB PHE 6 1HB PHE 6 -7.700 1.944 -4.435
49 HD1 PHE 6 1HD PHE 6 -7.288 0.673 -7.808
50 HD2 PHE 6 2HD PHE 6 -5.438 2.867 -4.666
51 HE1 PHE 6 1HE PHE 6 -5.633 1.555 -9.402
52 HE2 PHE 6 2HE PHE 6 -3.781 3.753 -6.254
53 HZ PHE 6 HZ PHE 6 -3.878 3.098 -8.626
54 H LEU 7 H LEU 7 -5.503 -2.090 -4.107
55 HA LEU 7 HA LEU 7 -6.152 -3.247 -6.732
56 1HB LEU 7 2HB LEU 7 -3.404 -3.424 -5.532
57 2HB LEU 7 1HB LEU 7 -3.897 -3.752 -7.182
58 HG LEU 7 HG LEU 7 -4.028 -0.987 -6.003
59 1HD1 LEU 7 1HD1 LEU 7 -1.730 -2.310 -7.433
60 2HD1 LEU 7 2HD1 LEU 7 -1.736 -1.667 -5.790
61 3HD1 LEU 7 3HD1 LEU 7 -1.876 -0.573 -7.166
62 1HD2 LEU 7 1HD2 LEU 7 -4.202 -0.254 -8.233
63 2HD2 LEU 7 2HD2 LEU 7 -5.298 -1.630 -8.105
64 3HD2 LEU 7 3HD2 LEU 7 -3.723 -1.827 -8.872
65 H LYS 8 H LYS 8 -4.458 -5.512 -6.422
66 HA LYS 8 HA LYS 8 -5.535 -6.832 -4.032
67 1HB LYS 8 2HB LYS 8 -5.500 -8.171 -6.733
68 2HB LYS 8 1HB LYS 8 -6.278 -8.729 -5.258
69 1HG LYS 8 2HG LYS 8 -8.110 -7.923 -6.300
70 2HG LYS 8 1HG LYS 8 -7.572 -6.416 -5.558
71 1HD LYS 8 2HD LYS 8 -6.926 -5.515 -7.537
72 2HD LYS 8 1HD LYS 8 -6.418 -7.070 -8.200
73 1HE LYS 8 2HE LYS 8 -9.029 -7.530 -8.113
74 2HE LYS 8 1HE LYS 8 -9.090 -5.770 -8.215
75 1HZ LYS 8 1HZ LYS 8 -8.266 -7.717 -10.208
76 2HZ LYS 8 2HZ LYS 8 -7.339 -6.304 -10.136
77 3HZ LYS 8 3HZ LYS 8 -9.005 -6.207 -10.408
78 H VAL 9 H VAL 9 -3.275 -7.057 -6.760
79 HA VAL 9 HA VAL 9 -1.674 -9.101 -5.631
80 HB VAL 9 HB VAL 9 -1.649 -8.597 -8.035
81 1HG1 VAL 9 1HG1 VAL 9 0.098 -6.228 -7.605
82 2HG1 VAL 9 2HG1 VAL 9 -1.648 -6.023 -7.458
83 3HG1 VAL 9 3HG1 VAL 9 -0.954 -6.626 -8.963
84 1HG2 VAL 9 1HG2 VAL 9 0.609 -9.057 -8.385
85 2HG2 VAL 9 2HG2 VAL 9 0.324 -9.623 -6.739
86 3HG2 VAL 9 3HG2 VAL 9 1.121 -8.075 -7.013
87 H CYS 10 H CYS 10 -1.737 -5.635 -5.282
88 HA CYS 10 HA CYS 10 0.826 -5.594 -3.899
89 1HB CYS 10 2HB CYS 10 0.222 -3.770 -5.477
90 2HB CYS 10 1HB CYS 10 -1.116 -3.331 -4.419
91 H ALA 11 H ALA 11 -2.581 -4.836 -3.214
92 HA ALA 11 HA ALA 11 -2.193 -4.279 -0.468
93 1HB ALA 11 1HB ALA 11 -4.407 -3.850 -0.417
94 2HB ALA 11 2HB ALA 11 -4.823 -5.325 -1.290
95 3HB ALA 11 3HB ALA 11 -4.244 -3.912 -2.172
96 H ALA 12 H ALA 12 -3.184 -7.207 -2.203
97 HA ALA 12 HA ALA 12 -3.349 -8.736 0.252
98 1HB ALA 12 1HB ALA 12 -4.463 -10.302 -0.940
99 2HB ALA 12 2HB ALA 12 -3.427 -10.121 -2.355
100 3HB ALA 12 3HB ALA 12 -4.704 -8.946 -2.043
101 H ALA 13 H ALA 13 -0.748 -7.633 -0.332
102 HA ALA 13 HA ALA 13 0.831 -9.952 -1.143
103 1HB ALA 13 1HB ALA 13 1.411 -7.039 -0.846
104 2HB ALA 13 2HB ALA 13 1.679 -8.104 -2.227
105 3HB ALA 13 3HB ALA 13 2.733 -8.205 -0.816
106 H ALA 14 H ALA 14 -0.499 -8.873 1.656
107 HA ALA 14 HA ALA 14 -0.119 -9.246 3.866
108 1HB ALA 14 1HB ALA 14 2.009 -11.236 3.331
109 2HB ALA 14 2HB ALA 14 0.409 -11.561 2.663
110 3HB ALA 14 3HB ALA 14 0.609 -11.331 4.400
111 H ASN 15 H ASN 15 1.485 -7.241 2.475
112 HA ASN 15 HA ASN 15 3.579 -6.972 4.491
113 1HB ASN 15 2HB ASN 15 4.297 -7.914 2.053
114 2HB ASN 15 1HB ASN 15 4.422 -6.180 1.768
115 1HD2 ASN 15 1HD2 ASN 15 5.252 -5.308 4.240
116 2HD2 ASN 15 2HD2 ASN 15 6.836 -5.921 4.561
117 H VAL 16 H VAL 16 2.821 -5.192 5.471
118 HA VAL 16 HA VAL 16 1.458 -3.088 4.141
119 HB VAL 16 HB VAL 16 2.807 -2.957 6.840
120 1HG1 VAL 16 1HG1 VAL 16 0.868 -1.342 7.240
121 2HG1 VAL 16 2HG1 VAL 16 0.686 -1.319 5.486
122 3HG1 VAL 16 3HG1 VAL 16 2.195 -0.781 6.222
123 1HG2 VAL 16 1HG2 VAL 16 -0.083 -3.461 6.723
124 2HG2 VAL 16 2HG2 VAL 16 1.147 -4.143 7.786
125 3HG2 VAL 16 3HG2 VAL 16 0.924 -4.795 6.162
126 H ALA 17 H ALA 17 4.778 -3.453 5.334
127 HA ALA 17 HA ALA 17 5.641 -0.846 4.689
128 1HB ALA 17 1HB ALA 17 7.516 -3.172 4.662
129 2HB ALA 17 2HB ALA 17 6.745 -2.678 6.170
130 3HB ALA 17 3HB ALA 17 7.761 -1.540 5.283
131 H ALA 18 H ALA 18 5.908 -3.921 2.922
132 HA ALA 18 HA ALA 18 7.331 -2.983 0.715
133 1HB ALA 18 1HB ALA 18 6.905 -5.011 -0.263
134 2HB ALA 18 2HB ALA 18 5.243 -5.069 0.324
135 3HB ALA 18 3HB ALA 18 6.580 -5.399 1.427
136 H HIS 19 H HIS 19 3.932 -2.765 1.500
137 HA HIS 19 HA HIS 19 3.100 -1.936 -1.110
138 1HB HIS 19 2HB HIS 19 1.317 -2.847 0.027
139 2HB HIS 19 1HB HIS 19 1.823 -2.181 1.575
140 HD2 HIS 19 2HD HIS 19 0.501 0.039 2.349
141 HE1 HIS 19 1HE HIS 19 -1.281 0.906 -1.382
142 HE2 HIS 19 2HE HIS 19 -1.305 1.421 1.106
143 H MET 20 H MET 20 3.185 -0.170 1.994
144 HA MET 20 HA MET 20 2.689 2.361 1.112
145 1HB MET 20 2HB MET 20 3.232 1.403 3.500
146 2HB MET 20 1HB MET 20 4.851 1.990 3.144
147 1HG MET 20 2HG MET 20 3.579 4.195 2.530
148 2HG MET 20 1HG MET 20 2.332 3.510 3.572
149 1HE MET 20 1HE MET 20 2.847 3.273 6.508
150 2HE MET 20 2HE MET 20 2.037 4.456 5.482
151 3HE MET 20 3HE MET 20 3.186 4.992 6.708
152 H THR 21 H THR 21 5.862 0.759 1.153
153 HA THR 21 HA THR 21 7.412 2.915 0.309
154 HB THR 21 HB THR 21 8.343 0.786 1.132
155 HG1 THR 21 1HG THR 21 10.031 0.663 -0.421
156 1HG2 THR 21 1HG2 THR 21 8.672 -0.915 -0.874
157 2HG2 THR 21 2HG2 THR 21 7.082 -0.289 -1.313
158 3HG2 THR 21 3HG2 THR 21 7.333 -1.037 0.265
159 H HIS 22 H HIS 22 5.207 0.924 -1.462
160 HA HIS 22 HA HIS 22 6.025 2.222 -3.954
161 1HB HIS 22 2HB HIS 22 6.186 0.149 -4.793
162 2HB HIS 22 1HB HIS 22 5.531 -0.544 -3.317
163 HD1 HIS 22 1HD HIS 22 4.915 -0.559 -6.764
164 HD2 HIS 22 2HD HIS 22 2.442 -0.149 -3.435
165 HE1 HIS 22 1HE HIS 22 2.606 -1.154 -7.560
166 HE2 HIS 22 2HE HIS 22 1.121 -0.834 -5.552
167 H CYS 23 H CYS 23 3.834 2.533 -1.625
168 HA CYS 23 HA CYS 23 1.811 3.584 -3.447
169 1HB CYS 23 2HB CYS 23 1.545 1.343 -1.542
170 2HB CYS 23 1HB CYS 23 0.249 2.521 -1.501
171 H ALA 24 H ALA 24 3.533 5.231 -2.250
172 HA ALA 24 HA ALA 24 2.998 6.058 0.366
173 1HB ALA 24 1HB ALA 24 4.950 6.937 -0.486
174 2HB ALA 24 2HB ALA 24 3.871 8.328 -0.573
175 3HB ALA 24 3HB ALA 24 4.207 7.380 -2.022
176 H LYS 25 H LYS 25 2.270 8.555 0.606
177 HA LYS 25 HA LYS 25 -0.361 8.795 -0.696
178 1HB LYS 25 2HB LYS 25 -0.624 8.044 1.627
179 2HB LYS 25 1HB LYS 25 0.311 9.425 2.184
180 1HG LYS 25 2HG LYS 25 -1.591 10.711 0.805
181 2HG LYS 25 1HG LYS 25 -2.491 9.269 1.278
182 1HD LYS 25 2HD LYS 25 -1.265 9.897 3.612
183 2HD LYS 25 1HD LYS 25 -1.488 11.501 2.914
184 1HE LYS 25 2HE LYS 25 -3.710 9.482 3.101
185 2HE LYS 25 1HE LYS 25 -3.361 10.634 4.389
186 1HZ LYS 25 1HZ LYS 25 -4.065 12.390 3.136
187 2HZ LYS 25 2HZ LYS 25 -5.089 11.187 2.532
188 3HZ LYS 25 3HZ LYS 25 -3.715 11.644 1.658
Start of MODEL 20
1 1H ARG 1 1HT ARG 1 -0.654 0.772 7.547
2 2H ARG 1 2HT ARG 1 -0.215 -0.802 8.072
3 3H ARG 1 3HT ARG 1 -1.017 0.271 9.145
4 HA ARG 1 HA ARG 1 -2.373 -1.532 8.122
5 1HB ARG 1 2HB ARG 1 -2.974 0.892 9.081
6 2HB ARG 1 1HB ARG 1 -3.520 1.126 7.426
7 1HG ARG 1 2HG ARG 1 -5.450 0.316 8.236
8 2HG ARG 1 1HG ARG 1 -4.671 -1.244 7.963
9 1HD ARG 1 2HD ARG 1 -4.093 0.052 10.548
10 2HD ARG 1 1HD ARG 1 -5.755 -0.488 10.316
11 HE ARG 1 HE ARG 1 -3.430 -2.137 10.678
12 1HH1 ARG 1 1HH1 ARG 1 -6.666 -2.006 9.379
13 2HH1 ARG 1 2HH1 ARG 1 -6.903 -3.719 9.464
14 1HH2 ARG 1 1HH2 ARG 1 -3.739 -4.389 10.789
15 2HH2 ARG 1 2HH2 ARG 1 -5.242 -5.073 10.265
16 H VAL 2 H VAL 2 -2.245 -2.656 6.284
17 HA VAL 2 HA VAL 2 -1.828 -1.300 3.745
18 HB VAL 2 HB VAL 2 -0.545 -3.336 4.218
19 1HG1 VAL 2 1HG1 VAL 2 -3.216 -4.399 4.800
20 2HG1 VAL 2 2HG1 VAL 2 -1.638 -4.887 5.418
21 3HG1 VAL 2 3HG1 VAL 2 -2.188 -5.468 3.847
22 1HG2 VAL 2 1HG2 VAL 2 -2.254 -2.960 1.887
23 2HG2 VAL 2 2HG2 VAL 2 -1.728 -4.629 2.098
24 3HG2 VAL 2 3HG2 VAL 2 -0.535 -3.336 1.982
25 H ILE 3 H ILE 3 -4.188 -0.462 4.586
26 HA ILE 3 HA ILE 3 -6.130 -2.024 3.012
27 HB ILE 3 HB ILE 3 -6.620 -2.120 5.439
28 1HG1 ILE 3 2HG1 ILE 3 -8.826 -0.434 4.419
29 2HG1 ILE 3 1HG1 ILE 3 -8.357 -1.782 3.386
30 1HG2 ILE 3 1HG2 ILE 3 -6.939 -0.296 6.774
31 2HG2 ILE 3 2HG2 ILE 3 -7.435 0.738 5.434
32 3HG2 ILE 3 3HG2 ILE 3 -5.730 0.353 5.666
33 1HD1 ILE 3 1HD1 ILE 3 -10.125 -2.505 4.800
34 2HD1 ILE 3 2HD1 ILE 3 -9.295 -1.909 6.237
35 3HD1 ILE 3 3HD1 ILE 3 -8.641 -3.286 5.350
36 H ALA 4 H ALA 4 -4.381 0.138 2.142
37 HA ALA 4 HA ALA 4 -6.459 2.030 1.272
38 1HB ALA 4 1HB ALA 4 -3.716 3.093 1.587
39 2HB ALA 4 2HB ALA 4 -4.629 2.791 3.064
40 3HB ALA 4 3HB ALA 4 -5.275 3.879 1.836
41 H CYS 5 H CYS 5 -5.329 -0.341 -0.010
42 HA CYS 5 HA CYS 5 -3.880 0.878 -2.260
43 1HB CYS 5 2HB CYS 5 -2.886 -1.113 -1.009
44 2HB CYS 5 1HB CYS 5 -4.170 -2.077 -1.727
45 H PHE 6 H PHE 6 -4.682 0.800 -4.306
46 HA PHE 6 HA PHE 6 -7.463 -0.077 -4.570
47 1HB PHE 6 2HB PHE 6 -7.332 1.235 -6.745
48 2HB PHE 6 1HB PHE 6 -7.182 2.175 -5.264
49 HD1 PHE 6 1HD PHE 6 -5.318 0.743 -8.101
50 HD2 PHE 6 2HD PHE 6 -5.214 3.392 -4.774
51 HE1 PHE 6 1HE PHE 6 -3.192 1.677 -8.916
52 HE2 PHE 6 2HE PHE 6 -3.089 4.333 -5.583
53 HZ PHE 6 HZ PHE 6 -2.076 3.475 -7.657
54 H LEU 7 H LEU 7 -5.379 -2.037 -4.517
55 HA LEU 7 HA LEU 7 -5.797 -3.210 -7.171
56 1HB LEU 7 2HB LEU 7 -3.171 -3.507 -5.743
57 2HB LEU 7 1HB LEU 7 -3.549 -3.866 -7.417
58 HG LEU 7 HG LEU 7 -3.634 -1.051 -6.369
59 1HD1 LEU 7 1HD1 LEU 7 -1.284 -2.731 -7.012
60 2HD1 LEU 7 2HD1 LEU 7 -1.438 -1.365 -5.908
61 3HD1 LEU 7 3HD1 LEU 7 -1.294 -1.084 -7.643
62 1HD2 LEU 7 1HD2 LEU 7 -4.700 -1.621 -8.546
63 2HD2 LEU 7 2HD2 LEU 7 -3.119 -2.138 -9.132
64 3HD2 LEU 7 3HD2 LEU 7 -3.383 -0.455 -8.675
65 H LYS 8 H LYS 8 -4.267 -5.557 -6.630
66 HA LYS 8 HA LYS 8 -5.628 -6.714 -4.300
67 1HB LYS 8 2HB LYS 8 -5.564 -7.884 -7.087
68 2HB LYS 8 1HB LYS 8 -6.087 -8.763 -5.657
69 1HG LYS 8 2HG LYS 8 -8.065 -7.667 -5.531
70 2HG LYS 8 1HG LYS 8 -7.404 -6.170 -6.191
71 1HD LYS 8 2HD LYS 8 -7.491 -8.488 -8.022
72 2HD LYS 8 1HD LYS 8 -9.047 -7.792 -7.563
73 1HE LYS 8 2HE LYS 8 -8.564 -5.745 -8.531
74 2HE LYS 8 1HE LYS 8 -6.822 -6.012 -8.463
75 1HZ LYS 8 1HZ LYS 8 -7.893 -6.168 -10.722
76 2HZ LYS 8 2HZ LYS 8 -8.604 -7.612 -10.205
77 3HZ LYS 8 3HZ LYS 8 -6.920 -7.479 -10.277
78 H VAL 9 H VAL 9 -3.161 -7.192 -6.811
79 HA VAL 9 HA VAL 9 -1.776 -9.241 -5.403
80 HB VAL 9 HB VAL 9 -1.576 -8.976 -7.837
81 1HG1 VAL 9 1HG1 VAL 9 -0.221 -6.393 -7.101
82 2HG1 VAL 9 2HG1 VAL 9 -1.620 -6.632 -8.148
83 3HG1 VAL 9 3HG1 VAL 9 -0.024 -7.167 -8.673
84 1HG2 VAL 9 1HG2 VAL 9 1.164 -8.505 -6.731
85 2HG2 VAL 9 2HG2 VAL 9 0.641 -9.634 -7.981
86 3HG2 VAL 9 3HG2 VAL 9 0.259 -9.953 -6.289
87 H CYS 10 H CYS 10 -1.658 -5.761 -5.385
88 HA CYS 10 HA CYS 10 0.845 -5.663 -3.929
89 1HB CYS 10 2HB CYS 10 0.263 -3.912 -5.581
90 2HB CYS 10 1HB CYS 10 -1.106 -3.444 -4.578
91 H ALA 11 H ALA 11 -2.592 -5.099 -3.299
92 HA ALA 11 HA ALA 11 -2.195 -4.388 -0.556
93 1HB ALA 11 1HB ALA 11 -4.223 -3.998 -2.285
94 2HB ALA 11 2HB ALA 11 -4.394 -3.893 -0.534
95 3HB ALA 11 3HB ALA 11 -4.846 -5.374 -1.377
96 H ALA 12 H ALA 12 -3.161 -7.325 -2.272
97 HA ALA 12 HA ALA 12 -3.462 -8.814 0.195
98 1HB ALA 12 1HB ALA 12 -4.520 -10.397 -1.029
99 2HB ALA 12 2HB ALA 12 -3.420 -10.231 -2.399
100 3HB ALA 12 3HB ALA 12 -4.708 -9.051 -2.154
101 H ALA 13 H ALA 13 -0.826 -7.739 -0.275
102 HA ALA 13 HA ALA 13 0.758 -10.115 -0.919
103 1HB ALA 13 1HB ALA 13 1.318 -7.195 -0.874
104 2HB ALA 13 2HB ALA 13 1.716 -8.404 -2.094
105 3HB ALA 13 3HB ALA 13 2.654 -8.314 -0.603
106 H ALA 14 H ALA 14 -0.641 -8.821 1.753
107 HA ALA 14 HA ALA 14 -0.330 -9.032 3.996
108 1HB ALA 14 1HB ALA 14 1.748 -11.126 3.547
109 2HB ALA 14 2HB ALA 14 0.081 -11.437 3.062
110 3HB ALA 14 3HB ALA 14 0.454 -11.062 4.745
111 H ASN 15 H ASN 15 1.359 -7.169 2.510
112 HA ASN 15 HA ASN 15 3.434 -6.832 4.544
113 1HB ASN 15 2HB ASN 15 4.157 -7.873 2.162
114 2HB ASN 15 1HB ASN 15 4.258 -6.157 1.777
115 1HD2 ASN 15 1HD2 ASN 15 5.840 -8.780 3.108
116 2HD2 ASN 15 2HD2 ASN 15 7.144 -7.941 3.870
117 H VAL 16 H VAL 16 2.792 -4.990 5.466
118 HA VAL 16 HA VAL 16 1.402 -2.926 4.084
119 HB VAL 16 HB VAL 16 2.806 -2.688 6.745
120 1HG1 VAL 16 1HG1 VAL 16 0.274 -1.292 6.047
121 2HG1 VAL 16 2HG1 VAL 16 1.786 -0.681 5.375
122 3HG1 VAL 16 3HG1 VAL 16 1.580 -0.795 7.123
123 1HG2 VAL 16 1HG2 VAL 16 0.243 -3.131 7.414
124 2HG2 VAL 16 2HG2 VAL 16 1.452 -4.410 7.310
125 3HG2 VAL 16 3HG2 VAL 16 0.350 -4.127 5.963
126 H ALA 17 H ALA 17 4.712 -3.169 5.376
127 HA ALA 17 HA ALA 17 5.588 -0.636 4.568
128 1HB ALA 17 1HB ALA 17 6.897 -3.168 5.369
129 2HB ALA 17 2HB ALA 17 7.084 -1.538 6.017
130 3HB ALA 17 3HB ALA 17 7.886 -1.987 4.511
131 H ALA 18 H ALA 18 5.846 -3.778 2.919
132 HA ALA 18 HA ALA 18 7.247 -2.929 0.666
133 1HB ALA 18 1HB ALA 18 6.512 -5.313 1.467
134 2HB ALA 18 2HB ALA 18 6.787 -4.987 -0.244
135 3HB ALA 18 3HB ALA 18 5.144 -5.024 0.393
136 H HIS 19 H HIS 19 3.822 -2.774 1.420
137 HA HIS 19 HA HIS 19 3.022 -1.960 -1.205
138 1HB HIS 19 2HB HIS 19 1.239 -2.927 -0.119
139 2HB HIS 19 1HB HIS 19 1.697 -2.272 1.447
140 HD2 HIS 19 2HD HIS 19 0.305 -0.099 2.230
141 HE1 HIS 19 1HE HIS 19 -1.452 0.762 -1.515
142 HE2 HIS 19 2HE HIS 19 -1.526 1.242 0.978
143 H MET 20 H MET 20 3.030 -0.215 1.912
144 HA MET 20 HA MET 20 2.455 2.308 1.038
145 1HB MET 20 2HB MET 20 4.132 1.281 3.289
146 2HB MET 20 1HB MET 20 4.100 3.010 2.972
147 1HG MET 20 2HG MET 20 1.471 1.703 3.081
148 2HG MET 20 1HG MET 20 2.375 1.720 4.594
149 1HE MET 20 1HE MET 20 2.197 3.460 6.203
150 2HE MET 20 2HE MET 20 2.174 5.192 5.873
151 3HE MET 20 3HE MET 20 3.576 4.226 5.414
152 H THR 21 H THR 21 5.676 0.804 1.109
153 HA THR 21 HA THR 21 7.172 3.008 0.301
154 HB THR 21 HB THR 21 8.141 0.885 1.110
155 HG1 THR 21 1HG THR 21 9.085 1.535 -1.479
156 1HG2 THR 21 1HG2 THR 21 6.857 -0.189 -1.284
157 2HG2 THR 21 2HG2 THR 21 7.352 -0.994 0.206
158 3HG2 THR 21 3HG2 THR 21 8.535 -0.684 -1.065
159 H HIS 22 H HIS 22 5.027 0.997 -1.513
160 HA HIS 22 HA HIS 22 5.837 2.347 -3.980
161 1HB HIS 22 2HB HIS 22 6.073 0.293 -4.849
162 2HB HIS 22 1HB HIS 22 5.431 -0.443 -3.389
163 HD1 HIS 22 1HD HIS 22 4.844 -0.434 -6.839
164 HD2 HIS 22 2HD HIS 22 2.331 -0.145 -3.529
165 HE1 HIS 22 1HE HIS 22 2.564 -1.094 -7.663
166 HE2 HIS 22 2HE HIS 22 1.051 -0.845 -5.666
167 H CYS 23 H CYS 23 3.612 2.552 -1.672
168 HA CYS 23 HA CYS 23 1.577 3.565 -3.500
169 1HB CYS 23 2HB CYS 23 1.359 1.290 -1.630
170 2HB CYS 23 1HB CYS 23 0.026 2.424 -1.591
171 H ALA 24 H ALA 24 3.260 5.224 -2.228
172 HA ALA 24 HA ALA 24 2.641 5.997 0.385
173 1HB ALA 24 1HB ALA 24 4.626 6.843 -0.563
174 2HB ALA 24 2HB ALA 24 3.572 8.240 -0.341
175 3HB ALA 24 3HB ALA 24 3.767 7.529 -1.943
176 H LYS 25 H LYS 25 1.834 8.442 0.690
177 HA LYS 25 HA LYS 25 -0.724 8.718 -0.739
178 1HB LYS 25 2HB LYS 25 -0.899 7.757 1.624
179 2HB LYS 25 1HB LYS 25 -0.393 9.343 2.190
180 1HG LYS 25 2HG LYS 25 -2.659 9.277 0.296
181 2HG LYS 25 1HG LYS 25 -2.950 8.634 1.913
182 1HD LYS 25 2HD LYS 25 -1.627 10.927 2.501
183 2HD LYS 25 1HD LYS 25 -2.478 11.401 1.029
184 1HE LYS 25 2HE LYS 25 -4.575 11.005 1.971
185 2HE LYS 25 1HE LYS 25 -3.911 9.995 3.254
186 1HZ LYS 25 1HZ LYS 25 -3.127 11.847 4.402
187 2HZ LYS 25 2HZ LYS 25 -4.652 12.336 3.858
188 3HZ LYS 25 3HZ LYS 25 -3.258 12.871 3.062