Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
15405 | 1y5c RC | 6462 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ARG 1 1HT ARG 1 -7.437 0.047 6.584
2 2H ARG 1 2HT ARG 1 -7.964 1.652 6.648
3 3H ARG 1 3HT ARG 1 -6.543 1.197 7.444
4 HA ARG 1 HA ARG 1 -5.670 2.160 5.589
5 1HB ARG 1 2HB ARG 1 -6.203 -0.713 4.806
6 2HB ARG 1 1HB ARG 1 -4.978 0.320 4.084
7 1HG ARG 1 2HG ARG 1 -3.842 0.487 6.235
8 2HG ARG 1 1HG ARG 1 -5.072 -0.546 6.966
9 1HD ARG 1 2HD ARG 1 -3.217 -1.324 4.718
10 2HD ARG 1 1HD ARG 1 -3.048 -1.805 6.405
11 HE ARG 1 HE ARG 1 -5.588 -2.573 5.517
12 1HH1 ARG 1 1HH1 ARG 1 -2.237 -3.350 4.965
13 2HH1 ARG 1 2HH1 ARG 1 -2.556 -4.996 4.531
14 1HH2 ARG 1 1HH2 ARG 1 -6.019 -4.738 4.949
15 2HH2 ARG 1 2HH2 ARG 1 -4.707 -5.785 4.523
16 H ARG 2 H ARG 2 -5.976 3.187 3.684
17 HA ARG 2 HA ARG 2 -8.569 3.548 2.684
18 1HB ARG 2 2HB ARG 2 -7.458 4.774 0.834
19 2HB ARG 2 1HB ARG 2 -6.892 5.265 2.424
20 1HG ARG 2 2HG ARG 2 -4.901 3.864 2.137
21 2HG ARG 2 1HG ARG 2 -5.464 3.412 0.527
22 1HD ARG 2 2HD ARG 2 -4.845 6.221 1.440
23 2HD ARG 2 1HD ARG 2 -3.781 5.208 0.465
24 HE ARG 2 HE ARG 2 -6.238 5.368 -0.842
25 1HH1 ARG 2 1HH1 ARG 2 -3.601 7.465 0.055
26 2HH1 ARG 2 2HH1 ARG 2 -3.833 8.539 -1.283
27 1HH2 ARG 2 1HH2 ARG 2 -6.549 6.780 -2.603
28 2HH2 ARG 2 2HH2 ARG 2 -5.507 8.150 -2.795
29 H TRP 3 H TRP 3 -6.330 1.066 2.133
30 HA TRP 3 HA TRP 3 -8.085 -0.245 0.292
31 1HB TRP 3 2HB TRP 3 -6.321 -0.523 -1.492
32 2HB TRP 3 1HB TRP 3 -7.003 1.090 -1.365
33 HD1 TRP 3 HD TRP 3 -4.536 0.638 1.349
34 HE1 TRP 3 1HE TRP 3 -2.322 1.788 0.725
35 HE3 TRP 3 3HE TRP 3 -5.407 1.428 -3.624
36 HZ2 TRP 3 2HZ TRP 3 -1.115 2.871 -1.568
37 HZ3 TRP 3 3HZ TRP 3 -3.658 2.519 -4.964
38 HH2 TRP 3 HH TRP 3 -1.554 3.231 -3.955
39 H GLN 4 H GLN 4 -5.265 -1.518 -0.592
40 HA GLN 4 HA GLN 4 -4.592 -2.994 1.799
41 1HB GLN 4 2HB GLN 4 -5.072 -5.200 0.748
42 2HB GLN 4 1HB GLN 4 -6.521 -4.260 1.085
43 1HG GLN 4 2HG GLN 4 -6.605 -3.565 -1.260
44 2HG GLN 4 1HG GLN 4 -5.174 -4.537 -1.590
45 1HE2 GLN 4 1HE2 GLN 4 -5.644 -6.363 -2.557
46 2HE2 GLN 4 2HE2 GLN 4 -7.046 -7.335 -2.288
47 H TRP 5 H TRP 5 -2.968 -1.340 0.517
48 HA TRP 5 HA TRP 5 -1.482 -2.290 -1.650
49 1HB TRP 5 2HB TRP 5 0.251 -0.705 -0.901
50 2HB TRP 5 1HB TRP 5 -1.353 0.019 -0.858
51 HD1 TRP 5 HD TRP 5 -2.526 -0.338 1.806
52 HE1 TRP 5 1HE TRP 5 -1.382 0.321 4.016
53 HE3 TRP 5 3HE TRP 5 2.339 -0.295 0.226
54 HZ2 TRP 5 2HZ TRP 5 1.232 0.799 4.963
55 HZ3 TRP 5 3HZ TRP 5 4.100 0.276 1.847
56 HH2 TRP 5 HH TRP 5 3.555 0.812 4.166
57 H ARG 6 H ARG 6 1.189 -2.187 -0.706
58 HA ARG 6 HA ARG 6 1.543 -4.326 1.215
59 1HB ARG 6 2HB ARG 6 2.370 -4.644 -1.677
60 2HB ARG 6 1HB ARG 6 2.936 -5.674 -0.371
61 1HG ARG 6 2HG ARG 6 0.636 -6.396 0.052
62 2HG ARG 6 1HG ARG 6 0.078 -5.368 -1.268
63 1HD ARG 6 2HD ARG 6 1.434 -6.645 -2.845
64 2HD ARG 6 1HD ARG 6 2.024 -7.658 -1.527
65 HE ARG 6 HE ARG 6 -0.770 -7.770 -1.540
66 1HH1 ARG 6 1HH1 ARG 6 1.926 -8.746 -3.522
67 2HH1 ARG 6 2HH1 ARG 6 1.099 -10.108 -4.201
68 1HH2 ARG 6 1HH2 ARG 6 -1.864 -9.563 -2.428
69 2HH2 ARG 6 2HH2 ARG 6 -1.054 -10.572 -3.581
70 H MET 7 H MET 7 3.156 -2.365 -1.286
71 HA MET 7 HA MET 7 4.855 -1.081 0.561
72 1HB MET 7 2HB MET 7 7.009 -2.020 -0.015
73 2HB MET 7 1HB MET 7 5.965 -3.289 0.605
74 1HG MET 7 2HG MET 7 6.477 -2.782 -2.316
75 2HG MET 7 1HG MET 7 7.349 -3.957 -1.337
76 1HE MET 7 1HE MET 7 6.512 -4.841 -3.726
77 2HE MET 7 2HE MET 7 5.014 -5.753 -3.913
78 3HE MET 7 3HE MET 7 6.319 -6.396 -2.916
79 H LYS 8 H LYS 8 3.135 -0.395 -1.591
80 HA LYS 8 HA LYS 8 4.771 0.398 -3.832
81 1HB LYS 8 2HB LYS 8 2.396 -0.228 -4.121
82 2HB LYS 8 1HB LYS 8 1.923 1.143 -3.128
83 1HG LYS 8 2HG LYS 8 2.893 2.667 -4.784
84 2HG LYS 8 1HG LYS 8 3.331 1.281 -5.787
85 1HD LYS 8 2HD LYS 8 0.947 0.665 -5.925
86 2HD LYS 8 1HD LYS 8 0.540 2.101 -4.984
87 1HE LYS 8 2HE LYS 8 0.201 2.528 -7.345
88 2HE LYS 8 1HE LYS 8 1.532 3.510 -6.735
89 1HZ LYS 8 1HZ LYS 8 2.054 2.512 -8.880
90 2HZ LYS 8 2HZ LYS 8 1.820 0.964 -8.241
91 3HZ LYS 8 3HZ LYS 8 3.091 1.927 -7.677
92 H LYS 9 H LYS 9 3.295 1.875 -1.010
93 HA LYS 9 HA LYS 9 3.865 4.565 -1.602
94 1HB LYS 9 2HB LYS 9 3.647 3.245 1.108
95 2HB LYS 9 1HB LYS 9 3.525 4.969 0.792
96 1HG LYS 9 2HG LYS 9 1.491 4.634 -0.466
97 2HG LYS 9 1HG LYS 9 1.635 2.884 -0.280
98 1HD LYS 9 2HD LYS 9 1.449 3.153 2.161
99 2HD LYS 9 1HD LYS 9 1.249 4.892 1.940
100 1HE LYS 9 2HE LYS 9 -0.789 4.515 0.667
101 2HE LYS 9 1HE LYS 9 -0.576 2.770 0.814
102 1HZ LYS 9 1HZ LYS 9 -0.505 3.955 3.373
103 2HZ LYS 9 2HZ LYS 9 -1.596 2.815 2.766
104 3HZ LYS 9 3HZ LYS 9 -1.901 4.467 2.565
105 H LEU 10 H LEU 10 5.672 2.138 0.231
106 HA LEU 10 HA LEU 10 7.799 3.795 1.022
107 1HB LEU 10 2HB LEU 10 7.355 1.618 2.039
108 2HB LEU 10 1HB LEU 10 7.760 0.816 0.533
109 HG LEU 10 HG LEU 10 10.083 1.631 0.739
110 1HD1 LEU 10 1HD1 LEU 10 10.618 2.400 3.186
111 2HD1 LEU 10 2HD1 LEU 10 8.944 2.955 3.152
112 3HD1 LEU 10 3HD1 LEU 10 10.100 3.566 1.969
113 1HD2 LEU 10 1HD2 LEU 10 8.781 -0.148 2.709
114 2HD2 LEU 10 2HD2 LEU 10 10.441 0.339 3.050
115 3HD2 LEU 10 3HD2 LEU 10 10.057 -0.487 1.540
116 H GLY 11 H GLY 11 9.671 4.404 0.065
117 1HA GLY 11 2HA GLY 11 10.866 3.148 -2.154
118 2HA GLY 11 1HA GLY 11 9.864 4.470 -2.731
Start of MODEL 2
1 1H ARG 1 1HT ARG 1 -8.322 0.596 6.317
2 2H ARG 1 2HT ARG 1 -6.847 0.109 6.986
3 3H ARG 1 3HT ARG 1 -7.688 -0.930 5.949
4 HA ARG 1 HA ARG 1 -6.145 1.488 5.317
5 1HB ARG 1 2HB ARG 1 -6.334 -1.324 4.229
6 2HB ARG 1 1HB ARG 1 -5.412 -0.056 3.437
7 1HG ARG 1 2HG ARG 1 -3.890 -1.343 4.711
8 2HG ARG 1 1HG ARG 1 -4.098 0.194 5.551
9 1HD ARG 1 2HD ARG 1 -5.746 -0.911 7.044
10 2HD ARG 1 1HD ARG 1 -5.380 -2.444 6.253
11 HE ARG 1 HE ARG 1 -3.551 -2.594 7.593
12 1HH1 ARG 1 1HH1 ARG 1 -4.375 0.781 7.273
13 2HH1 ARG 1 2HH1 ARG 1 -3.116 1.320 8.333
14 1HH2 ARG 1 1HH2 ARG 1 -1.890 -1.889 8.983
15 2HH2 ARG 1 2HH2 ARG 1 -1.703 -0.197 9.302
16 H ARG 2 H ARG 2 -6.568 2.729 3.549
17 HA ARG 2 HA ARG 2 -9.189 3.058 2.663
18 1HB ARG 2 2HB ARG 2 -8.262 4.544 0.965
19 2HB ARG 2 1HB ARG 2 -7.463 4.802 2.510
20 1HG ARG 2 2HG ARG 2 -5.571 3.442 1.751
21 2HG ARG 2 1HG ARG 2 -6.369 3.223 0.192
22 1HD ARG 2 2HD ARG 2 -6.313 5.632 -0.182
23 2HD ARG 2 1HD ARG 2 -5.542 5.866 1.386
24 HE ARG 2 HE ARG 2 -3.991 4.086 -0.129
25 1HH1 ARG 2 1HH1 ARG 2 -4.927 7.442 -0.075
26 2HH1 ARG 2 2HH1 ARG 2 -3.481 7.992 -0.851
27 1HH2 ARG 2 1HH2 ARG 2 -2.081 4.803 -1.151
28 2HH2 ARG 2 2HH2 ARG 2 -1.863 6.492 -1.462
29 H TRP 3 H TRP 3 -6.892 0.735 1.793
30 HA TRP 3 HA TRP 3 -8.671 -0.451 -0.126
31 1HB TRP 3 2HB TRP 3 -6.914 -0.595 -1.918
32 2HB TRP 3 1HB TRP 3 -7.552 1.019 -1.657
33 HD1 TRP 3 HD TRP 3 -5.118 0.336 1.026
34 HE1 TRP 3 1HE TRP 3 -2.860 1.438 0.478
35 HE3 TRP 3 3HE TRP 3 -5.916 1.415 -3.907
36 HZ2 TRP 3 2HZ TRP 3 -1.597 2.597 -1.743
37 HZ3 TRP 3 3HZ TRP 3 -4.116 2.514 -5.176
38 HH2 TRP 3 HH TRP 3 -1.997 3.095 -4.113
39 H GLN 4 H GLN 4 -5.812 -1.653 -1.046
40 HA GLN 4 HA GLN 4 -5.196 -3.285 1.250
41 1HB GLN 4 2HB GLN 4 -5.645 -5.423 0.055
42 2HB GLN 4 1HB GLN 4 -7.101 -4.509 0.424
43 1HG GLN 4 2HG GLN 4 -7.135 -3.666 -1.879
44 2HG GLN 4 1HG GLN 4 -5.708 -4.634 -2.239
45 1HE2 GLN 4 1HE2 GLN 4 -7.507 -6.351 -0.075
46 2HE2 GLN 4 2HE2 GLN 4 -8.416 -7.329 -1.170
47 H TRP 5 H TRP 5 -3.500 -1.603 0.236
48 HA TRP 5 HA TRP 5 -1.960 -2.362 -1.981
49 1HB TRP 5 2HB TRP 5 -0.243 -0.855 -1.035
50 2HB TRP 5 1HB TRP 5 -1.845 -0.128 -1.025
51 HD1 TRP 5 HD TRP 5 -3.148 -0.715 1.555
52 HE1 TRP 5 1HE TRP 5 -2.117 -0.197 3.859
53 HE3 TRP 5 3HE TRP 5 1.774 -0.450 0.207
54 HZ2 TRP 5 2HZ TRP 5 0.444 0.262 4.955
55 HZ3 TRP 5 3HZ TRP 5 3.451 0.034 1.938
56 HH2 TRP 5 HH TRP 5 2.797 0.384 4.264
57 H ARG 6 H ARG 6 0.648 -2.178 -0.394
58 HA ARG 6 HA ARG 6 0.900 -4.511 1.176
59 1HB ARG 6 2HB ARG 6 2.267 -5.848 -0.443
60 2HB ARG 6 1HB ARG 6 0.557 -5.752 -0.841
61 1HG ARG 6 2HG ARG 6 1.064 -3.991 -2.484
62 2HG ARG 6 1HG ARG 6 2.779 -4.167 -2.112
63 1HD ARG 6 2HD ARG 6 2.681 -6.511 -2.824
64 2HD ARG 6 1HD ARG 6 0.973 -6.317 -3.214
65 HE ARG 6 HE ARG 6 2.437 -4.377 -4.605
66 1HH1 ARG 6 1HH1 ARG 6 1.953 -7.828 -4.555
67 2HH1 ARG 6 2HH1 ARG 6 2.313 -8.031 -6.236
68 1HH2 ARG 6 1HH2 ARG 6 2.913 -4.638 -6.819
69 2HH2 ARG 6 2HH2 ARG 6 2.858 -6.219 -7.524
70 H MET 7 H MET 7 2.667 -2.535 -1.199
71 HA MET 7 HA MET 7 4.384 -1.396 0.720
72 1HB MET 7 2HB MET 7 6.506 -2.489 0.084
73 2HB MET 7 1HB MET 7 5.383 -3.609 0.842
74 1HG MET 7 2HG MET 7 4.762 -4.470 -1.365
75 2HG MET 7 1HG MET 7 5.912 -3.361 -2.111
76 1HE MET 7 1HE MET 7 9.311 -4.708 -0.618
77 2HE MET 7 2HE MET 7 8.273 -3.412 -0.024
78 3HE MET 7 3HE MET 7 8.602 -3.559 -1.752
79 H LYS 8 H LYS 8 2.813 -0.528 -1.460
80 HA LYS 8 HA LYS 8 4.541 0.114 -3.671
81 1HB LYS 8 2HB LYS 8 2.118 -0.236 -3.984
82 2HB LYS 8 1HB LYS 8 1.791 1.160 -2.967
83 1HG LYS 8 2HG LYS 8 2.937 2.597 -4.590
84 2HG LYS 8 1HG LYS 8 3.225 1.192 -5.615
85 1HD LYS 8 2HD LYS 8 0.494 2.167 -4.784
86 2HD LYS 8 1HD LYS 8 1.272 2.572 -6.312
87 1HE LYS 8 2HE LYS 8 -0.226 0.769 -6.729
88 2HE LYS 8 1HE LYS 8 1.411 0.120 -6.796
89 1HZ LYS 8 1HZ LYS 8 -0.491 -1.068 -5.447
90 2HZ LYS 8 2HZ LYS 8 0.005 0.000 -4.233
91 3HZ LYS 8 3HZ LYS 8 1.114 -1.084 -4.909
92 H LYS 9 H LYS 9 3.315 1.672 -0.792
93 HA LYS 9 HA LYS 9 4.025 4.317 -1.316
94 1HB LYS 9 2HB LYS 9 4.082 2.911 1.358
95 2HB LYS 9 1HB LYS 9 3.969 4.646 1.099
96 1HG LYS 9 2HG LYS 9 1.794 4.346 0.025
97 2HG LYS 9 1HG LYS 9 1.908 2.605 0.289
98 1HD LYS 9 2HD LYS 9 2.010 3.005 2.719
99 2HD LYS 9 1HD LYS 9 1.829 4.735 2.426
100 1HE LYS 9 2HE LYS 9 -0.159 2.586 1.699
101 2HE LYS 9 1HE LYS 9 -0.303 3.723 3.038
102 1HZ LYS 9 1HZ LYS 9 -0.946 5.371 1.677
103 2HZ LYS 9 2HZ LYS 9 -1.364 4.118 0.620
104 3HZ LYS 9 3HZ LYS 9 0.112 4.924 0.434
105 H LEU 10 H LEU 10 5.906 1.705 0.152
106 HA LEU 10 HA LEU 10 8.193 3.199 0.778
107 1HB LEU 10 2HB LEU 10 7.804 0.981 1.689
108 2HB LEU 10 1HB LEU 10 7.918 0.272 0.091
109 HG LEU 10 HG LEU 10 10.293 0.934 -0.023
110 1HD1 LEU 10 1HD1 LEU 10 9.903 1.808 2.836
111 2HD1 LEU 10 2HD1 LEU 10 10.170 2.880 1.461
112 3HD1 LEU 10 3HD1 LEU 10 11.431 1.753 1.959
113 1HD2 LEU 10 1HD2 LEU 10 9.372 -1.254 1.015
114 2HD2 LEU 10 2HD2 LEU 10 9.920 -0.560 2.541
115 3HD2 LEU 10 3HD2 LEU 10 11.072 -0.843 1.237
116 H GLY 11 H GLY 11 9.923 3.860 -0.362
117 1HA GLY 11 2HA GLY 11 10.851 2.748 -2.765
118 2HA GLY 11 1HA GLY 11 9.780 4.082 -3.163
Start of MODEL 3
1 1H ARG 1 1HT ARG 1 -8.994 -0.441 6.045
2 2H ARG 1 2HT ARG 1 -8.911 1.069 6.801
3 3H ARG 1 3HT ARG 1 -7.906 -0.190 7.316
4 HA ARG 1 HA ARG 1 -6.722 1.458 5.970
5 1HB ARG 1 2HB ARG 1 -7.024 -1.309 4.782
6 2HB ARG 1 1HB ARG 1 -5.684 -0.216 4.461
7 1HG ARG 1 2HG ARG 1 -5.065 -0.279 6.822
8 2HG ARG 1 1HG ARG 1 -6.409 -1.376 7.144
9 1HD ARG 1 2HD ARG 1 -5.417 -3.021 5.619
10 2HD ARG 1 1HD ARG 1 -4.071 -1.923 5.318
11 HE ARG 1 HE ARG 1 -4.325 -3.697 7.491
12 1HH1 ARG 1 1HH1 ARG 1 -3.283 -0.451 6.757
13 2HH1 ARG 1 2HH1 ARG 1 -2.176 -0.370 8.088
14 1HH2 ARG 1 1HH2 ARG 1 -2.876 -3.596 9.244
15 2HH2 ARG 1 2HH2 ARG 1 -1.946 -2.158 9.502
16 H ARG 2 H ARG 2 -6.566 2.665 4.144
17 HA ARG 2 HA ARG 2 -8.826 3.351 2.717
18 1HB ARG 2 2HB ARG 2 -7.258 4.454 1.117
19 2HB ARG 2 1HB ARG 2 -6.960 4.843 2.806
20 1HG ARG 2 2HG ARG 2 -5.095 3.323 2.876
21 2HG ARG 2 1HG ARG 2 -5.434 2.784 1.231
22 1HD ARG 2 2HD ARG 2 -4.697 5.600 2.017
23 2HD ARG 2 1HD ARG 2 -3.579 4.411 1.349
24 HE ARG 2 HE ARG 2 -5.765 4.666 -0.387
25 1HH1 ARG 2 1HH1 ARG 2 -3.040 6.519 0.745
26 2HH1 ARG 2 2HH1 ARG 2 -2.892 7.435 -0.717
27 1HH2 ARG 2 1HH2 ARG 2 -5.576 5.865 -2.316
28 2HH2 ARG 2 2HH2 ARG 2 -4.335 7.065 -2.457
29 H TRP 3 H TRP 3 -6.414 0.898 1.965
30 HA TRP 3 HA TRP 3 -8.220 -0.344 0.113
31 1HB TRP 3 2HB TRP 3 -6.634 -0.290 -1.818
32 2HB TRP 3 1HB TRP 3 -7.308 1.281 -1.414
33 HD1 TRP 3 HD TRP 3 -4.602 0.502 0.983
34 HE1 TRP 3 1HE TRP 3 -2.424 1.685 0.290
35 HE3 TRP 3 3HE TRP 3 -5.905 1.891 -3.759
36 HZ2 TRP 3 2HZ TRP 3 -1.404 3.006 -1.968
37 HZ3 TRP 3 3HZ TRP 3 -4.259 3.107 -5.124
38 HH2 TRP 3 HH TRP 3 -2.050 3.659 -4.244
39 H GLN 4 H GLN 4 -5.768 -1.570 -1.241
40 HA GLN 4 HA GLN 4 -4.724 -3.197 0.952
41 1HB GLN 4 2HB GLN 4 -5.961 -4.349 -1.556
42 2HB GLN 4 1HB GLN 4 -5.187 -5.266 -0.269
43 1HG GLN 4 2HG GLN 4 -6.902 -4.529 1.294
44 2HG GLN 4 1HG GLN 4 -7.673 -3.598 0.014
45 1HE2 GLN 4 1HE2 GLN 4 -7.876 -6.370 1.700
46 2HE2 GLN 4 2HE2 GLN 4 -8.706 -7.365 0.558
47 H TRP 5 H TRP 5 -3.158 -1.382 -0.015
48 HA TRP 5 HA TRP 5 -1.770 -1.897 -2.404
49 1HB TRP 5 2HB TRP 5 -0.083 -0.362 -1.521
50 2HB TRP 5 1HB TRP 5 -1.701 0.258 -1.215
51 HD1 TRP 5 HD TRP 5 -2.582 -0.697 1.460
52 HE1 TRP 5 1HE TRP 5 -1.239 -0.343 3.632
53 HE3 TRP 5 3HE TRP 5 2.036 0.082 -0.562
54 HZ2 TRP 5 2HZ TRP 5 1.437 0.198 4.380
55 HZ3 TRP 5 3HZ TRP 5 3.937 0.511 0.936
56 HH2 TRP 5 HH TRP 5 3.644 0.568 3.357
57 H ARG 6 H ARG 6 0.943 -1.741 -0.991
58 HA ARG 6 HA ARG 6 1.339 -4.194 0.362
59 1HB ARG 6 2HB ARG 6 2.704 -5.307 -1.438
60 2HB ARG 6 1HB ARG 6 0.971 -5.277 -1.723
61 1HG ARG 6 2HG ARG 6 1.267 -3.366 -3.236
62 2HG ARG 6 1HG ARG 6 3.011 -3.450 -2.976
63 1HD ARG 6 2HD ARG 6 3.021 -5.731 -3.882
64 2HD ARG 6 1HD ARG 6 1.284 -5.620 -4.164
65 HE ARG 6 HE ARG 6 2.558 -3.475 -5.450
66 1HH1 ARG 6 1HH1 ARG 6 2.243 -6.936 -5.687
67 2HH1 ARG 6 2HH1 ARG 6 2.499 -6.971 -7.399
68 1HH2 ARG 6 1HH2 ARG 6 2.898 -3.512 -7.704
69 2HH2 ARG 6 2HH2 ARG 6 2.875 -5.026 -8.545
70 H MET 7 H MET 7 3.211 -2.308 -2.039
71 HA MET 7 HA MET 7 4.876 -1.160 0.006
72 1HB MET 7 2HB MET 7 6.074 -3.153 -1.936
73 2HB MET 7 1HB MET 7 7.002 -2.069 -0.913
74 1HG MET 7 2HG MET 7 6.119 -3.159 1.071
75 2HG MET 7 1HG MET 7 5.151 -4.231 0.061
76 1HE MET 7 1HE MET 7 6.203 -6.448 1.208
77 2HE MET 7 2HE MET 7 6.985 -5.300 2.295
78 3HE MET 7 3HE MET 7 7.931 -6.581 1.538
79 H LYS 8 H LYS 8 3.151 -0.223 -2.103
80 HA LYS 8 HA LYS 8 4.767 0.724 -4.270
81 1HB LYS 8 2HB LYS 8 2.001 1.574 -3.380
82 2HB LYS 8 1HB LYS 8 2.761 1.996 -4.910
83 1HG LYS 8 2HG LYS 8 2.786 -0.342 -5.566
84 2HG LYS 8 1HG LYS 8 2.074 -0.797 -4.017
85 1HD LYS 8 2HD LYS 8 0.081 0.529 -4.553
86 2HD LYS 8 1HD LYS 8 0.795 0.968 -6.106
87 1HE LYS 8 2HE LYS 8 -0.801 -0.857 -6.365
88 2HE LYS 8 1HE LYS 8 0.834 -1.387 -6.758
89 1HZ LYS 8 1HZ LYS 8 0.072 -1.770 -3.996
90 2HZ LYS 8 2HZ LYS 8 0.859 -2.826 -5.058
91 3HZ LYS 8 3HZ LYS 8 -0.827 -2.686 -5.099
92 H LYS 9 H LYS 9 3.476 2.017 -1.275
93 HA LYS 9 HA LYS 9 4.366 4.691 -1.703
94 1HB LYS 9 2HB LYS 9 3.693 3.301 0.896
95 2HB LYS 9 1HB LYS 9 3.836 5.039 0.661
96 1HG LYS 9 2HG LYS 9 1.946 4.973 -0.899
97 2HG LYS 9 1HG LYS 9 1.788 3.238 -0.615
98 1HD LYS 9 2HD LYS 9 1.396 3.692 1.776
99 2HD LYS 9 1HD LYS 9 1.488 5.424 1.444
100 1HE LYS 9 2HE LYS 9 -0.529 3.483 0.319
101 2HE LYS 9 1HE LYS 9 -0.829 4.702 1.556
102 1HZ LYS 9 1HZ LYS 9 -0.862 4.985 -1.259
103 2HZ LYS 9 2HZ LYS 9 0.285 6.037 -0.595
104 3HZ LYS 9 3HZ LYS 9 -1.322 6.100 -0.072
105 H LEU 10 H LEU 10 5.668 1.912 0.039
106 HA LEU 10 HA LEU 10 7.869 3.162 1.229
107 1HB LEU 10 2HB LEU 10 7.077 0.914 1.820
108 2HB LEU 10 1HB LEU 10 7.607 0.315 0.261
109 HG LEU 10 HG LEU 10 9.947 0.866 0.878
110 1HD1 LEU 10 1HD1 LEU 10 9.152 1.156 3.723
111 2HD1 LEU 10 2HD1 LEU 10 8.998 2.564 2.672
112 3HD1 LEU 10 3HD1 LEU 10 10.564 1.780 2.871
113 1HD2 LEU 10 1HD2 LEU 10 10.275 -1.022 2.281
114 2HD2 LEU 10 2HD2 LEU 10 8.886 -1.380 1.255
115 3HD2 LEU 10 3HD2 LEU 10 8.641 -0.901 2.934
116 H GLY 11 H GLY 11 9.907 3.637 0.560
117 1HA GLY 11 2HA GLY 11 11.150 2.604 -1.751
118 2HA GLY 11 1HA GLY 11 10.400 4.143 -2.149
Start of MODEL 4
1 1H ARG 1 1HT ARG 1 -7.172 0.333 6.996
2 2H ARG 1 2HT ARG 1 -7.898 -0.838 6.013
3 3H ARG 1 3HT ARG 1 -8.496 0.745 6.026
4 HA ARG 1 HA ARG 1 -6.066 1.322 5.305
5 1HB ARG 1 2HB ARG 1 -6.514 -1.526 4.393
6 2HB ARG 1 1HB ARG 1 -5.278 -0.470 3.731
7 1HG ARG 1 2HG ARG 1 -4.232 -1.889 5.313
8 2HG ARG 1 1HG ARG 1 -4.318 -0.283 6.033
9 1HD ARG 1 2HD ARG 1 -6.274 -0.961 7.327
10 2HD ARG 1 1HD ARG 1 -6.220 -2.558 6.583
11 HE ARG 1 HE ARG 1 -3.742 -2.072 7.774
12 1HH1 ARG 1 1HH1 ARG 1 -7.065 -2.560 8.709
13 2HH1 ARG 1 2HH1 ARG 1 -6.663 -3.249 10.247
14 1HH2 ARG 1 1HH2 ARG 1 -3.207 -2.977 9.794
15 2HH2 ARG 1 2HH2 ARG 1 -4.471 -3.485 10.864
16 H ARG 2 H ARG 2 -6.181 2.478 3.445
17 HA ARG 2 HA ARG 2 -8.652 2.881 2.200
18 1HB ARG 2 2HB ARG 2 -7.375 4.188 0.515
19 2HB ARG 2 1HB ARG 2 -6.994 4.622 2.175
20 1HG ARG 2 2HG ARG 2 -4.949 3.289 2.054
21 2HG ARG 2 1HG ARG 2 -5.331 2.861 0.384
22 1HD ARG 2 2HD ARG 2 -5.234 5.216 -0.247
23 2HD ARG 2 1HD ARG 2 -4.885 5.658 1.422
24 HE ARG 2 HE ARG 2 -2.967 3.805 0.533
25 1HH1 ARG 2 1HH1 ARG 2 -3.945 7.114 0.052
26 2HH1 ARG 2 2HH1 ARG 2 -2.361 7.654 -0.392
27 1HH2 ARG 2 1HH2 ARG 2 -0.876 4.507 -0.053
28 2HH2 ARG 2 2HH2 ARG 2 -0.616 6.172 -0.454
29 H TRP 3 H TRP 3 -6.234 0.515 1.638
30 HA TRP 3 HA TRP 3 -7.863 -0.805 -0.306
31 1HB TRP 3 2HB TRP 3 -6.097 -0.830 -2.096
32 2HB TRP 3 1HB TRP 3 -6.862 0.733 -1.850
33 HD1 TRP 3 HD TRP 3 -4.354 0.159 0.816
34 HE1 TRP 3 1HE TRP 3 -2.172 1.407 0.270
35 HE3 TRP 3 3HE TRP 3 -5.290 1.326 -4.070
36 HZ2 TRP 3 2HZ TRP 3 -1.012 2.690 -1.938
37 HZ3 TRP 3 3HZ TRP 3 -3.579 2.562 -5.333
38 HH2 TRP 3 HH TRP 3 -1.480 3.235 -4.286
39 H GLN 4 H GLN 4 -5.276 -2.049 -1.396
40 HA GLN 4 HA GLN 4 -4.396 -3.557 0.947
41 1HB GLN 4 2HB GLN 4 -5.398 -4.853 -1.598
42 2HB GLN 4 1HB GLN 4 -4.721 -5.691 -0.207
43 1HG GLN 4 2HG GLN 4 -6.578 -4.902 1.167
44 2HG GLN 4 1HG GLN 4 -7.260 -4.081 -0.233
45 1HE2 GLN 4 1HE2 GLN 4 -8.865 -5.139 -1.130
46 2HE2 GLN 4 2HE2 GLN 4 -9.047 -6.855 -1.208
47 H TRP 5 H TRP 5 -2.818 -1.739 0.005
48 HA TRP 5 HA TRP 5 -1.231 -2.291 -2.235
49 1HB TRP 5 2HB TRP 5 0.353 -0.697 -1.250
50 2HB TRP 5 1HB TRP 5 -1.300 -0.108 -1.120
51 HD1 TRP 5 HD TRP 5 -2.448 -0.864 1.456
52 HE1 TRP 5 1HE TRP 5 -1.341 -0.482 3.750
53 HE3 TRP 5 3HE TRP 5 2.412 -0.375 -0.056
54 HZ2 TRP 5 2HZ TRP 5 1.253 -0.033 4.778
55 HZ3 TRP 5 3HZ TRP 5 4.144 0.030 1.643
56 HH2 TRP 5 HH TRP 5 3.574 0.200 4.011
57 H ARG 6 H ARG 6 1.387 -2.053 -0.859
58 HA ARG 6 HA ARG 6 1.826 -4.384 0.705
59 1HB ARG 6 2HB ARG 6 3.171 -5.653 -0.916
60 2HB ARG 6 1HB ARG 6 1.488 -5.545 -1.406
61 1HG ARG 6 2HG ARG 6 3.676 -3.785 -2.490
62 2HG ARG 6 1HG ARG 6 3.145 -5.286 -3.247
63 1HD ARG 6 2HD ARG 6 1.442 -2.851 -2.731
64 2HD ARG 6 1HD ARG 6 2.091 -3.353 -4.292
65 HE ARG 6 HE ARG 6 0.589 -5.464 -3.229
66 1HH1 ARG 6 1HH1 ARG 6 0.129 -2.251 -4.500
67 2HH1 ARG 6 2HH1 ARG 6 -1.476 -2.568 -5.068
68 1HH2 ARG 6 1HH2 ARG 6 -1.518 -5.889 -3.972
69 2HH2 ARG 6 2HH2 ARG 6 -2.413 -4.638 -4.769
70 H MET 7 H MET 7 3.387 -2.264 -1.682
71 HA MET 7 HA MET 7 5.057 -1.007 0.205
72 1HB MET 7 2HB MET 7 7.237 -1.936 -0.475
73 2HB MET 7 1HB MET 7 6.215 -3.146 0.287
74 1HG MET 7 2HG MET 7 5.637 -4.054 -1.894
75 2HG MET 7 1HG MET 7 6.625 -2.823 -2.678
76 1HE MET 7 1HE MET 7 8.090 -4.743 -4.021
77 2HE MET 7 2HE MET 7 6.864 -5.804 -3.325
78 3HE MET 7 3HE MET 7 8.571 -6.223 -3.191
79 H LYS 8 H LYS 8 3.365 -0.367 -2.056
80 HA LYS 8 HA LYS 8 5.184 0.571 -4.124
81 1HB LYS 8 2HB LYS 8 2.185 0.866 -3.851
82 2HB LYS 8 1HB LYS 8 3.131 1.368 -5.246
83 1HG LYS 8 2HG LYS 8 3.789 -0.956 -5.635
84 2HG LYS 8 1HG LYS 8 2.831 -1.455 -4.240
85 1HD LYS 8 2HD LYS 8 1.586 -1.849 -6.284
86 2HD LYS 8 1HD LYS 8 0.810 -0.573 -5.344
87 1HE LYS 8 2HE LYS 8 0.875 -0.006 -7.717
88 2HE LYS 8 1HE LYS 8 1.847 1.117 -6.766
89 1HZ LYS 8 1HZ LYS 8 3.533 0.654 -8.105
90 2HZ LYS 8 2HZ LYS 8 2.650 -0.543 -8.910
91 3HZ LYS 8 3HZ LYS 8 3.541 -0.936 -7.526
92 H LYS 9 H LYS 9 2.962 1.902 -1.720
93 HA LYS 9 HA LYS 9 3.450 4.621 -2.301
94 1HB LYS 9 2HB LYS 9 2.372 5.065 -0.138
95 2HB LYS 9 1HB LYS 9 1.467 3.891 -1.085
96 1HG LYS 9 2HG LYS 9 2.566 2.087 0.249
97 2HG LYS 9 1HG LYS 9 3.250 3.348 1.277
98 1HD LYS 9 2HD LYS 9 0.307 2.883 0.794
99 2HD LYS 9 1HD LYS 9 1.201 2.387 2.232
100 1HE LYS 9 2HE LYS 9 0.809 5.219 1.268
101 2HE LYS 9 1HE LYS 9 -0.025 4.457 2.622
102 1HZ LYS 9 1HZ LYS 9 1.635 5.111 3.915
103 2HZ LYS 9 2HZ LYS 9 2.489 5.732 2.594
104 3HZ LYS 9 3HZ LYS 9 2.697 4.116 3.052
105 H LEU 10 H LEU 10 4.918 2.363 -0.025
106 HA LEU 10 HA LEU 10 6.500 4.179 1.402
107 1HB LEU 10 2HB LEU 10 6.128 1.869 2.116
108 2HB LEU 10 1HB LEU 10 7.046 1.284 0.743
109 HG LEU 10 HG LEU 10 9.067 2.400 1.658
110 1HD1 LEU 10 1HD1 LEU 10 9.120 3.497 3.680
111 2HD1 LEU 10 2HD1 LEU 10 7.638 2.734 4.256
112 3HD1 LEU 10 3HD1 LEU 10 7.557 4.012 3.043
113 1HD2 LEU 10 1HD2 LEU 10 9.130 0.862 3.771
114 2HD2 LEU 10 2HD2 LEU 10 9.057 0.156 2.156
115 3HD2 LEU 10 3HD2 LEU 10 7.595 0.268 3.136
116 H GLY 11 H GLY 11 7.291 2.220 -1.463
117 1HA GLY 11 2HA GLY 11 9.925 3.235 -1.751
118 2HA GLY 11 1HA GLY 11 9.004 2.390 -2.987
Start of MODEL 5
1 1H ARG 1 1HT ARG 1 -8.265 -0.757 7.308
2 2H ARG 1 2HT ARG 1 -9.267 0.063 6.221
3 3H ARG 1 3HT ARG 1 -8.795 0.811 7.662
4 HA ARG 1 HA ARG 1 -6.910 1.549 6.814
5 1HB ARG 1 2HB ARG 1 -6.076 -0.792 7.101
6 2HB ARG 1 1HB ARG 1 -6.574 -1.130 5.450
7 1HG ARG 1 2HG ARG 1 -4.987 0.449 4.589
8 2HG ARG 1 1HG ARG 1 -4.574 0.981 6.220
9 1HD ARG 1 2HD ARG 1 -3.785 -1.321 6.712
10 2HD ARG 1 1HD ARG 1 -4.090 -1.748 5.029
11 HE ARG 1 HE ARG 1 -2.067 -0.841 4.549
12 1HH1 ARG 1 1HH1 ARG 1 -3.304 0.757 7.392
13 2HH1 ARG 1 2HH1 ARG 1 -1.915 1.774 7.581
14 1HH2 ARG 1 1HH2 ARG 1 -0.234 0.494 4.797
15 2HH2 ARG 1 2HH2 ARG 1 -0.171 1.622 6.108
16 H ARG 2 H ARG 2 -6.117 2.543 4.897
17 HA ARG 2 HA ARG 2 -7.947 3.492 3.129
18 1HB ARG 2 2HB ARG 2 -5.743 4.468 3.326
19 2HB ARG 2 1HB ARG 2 -5.002 3.025 2.647
20 1HG ARG 2 2HG ARG 2 -6.133 3.457 0.515
21 2HG ARG 2 1HG ARG 2 -6.846 4.917 1.200
22 1HD ARG 2 2HD ARG 2 -4.622 5.855 1.547
23 2HD ARG 2 1HD ARG 2 -3.891 4.383 0.908
24 HE ARG 2 HE ARG 2 -5.653 5.410 -1.012
25 1HH1 ARG 2 1HH1 ARG 2 -2.628 6.217 0.517
26 2HH1 ARG 2 2HH1 ARG 2 -2.026 7.098 -0.846
27 1HH2 ARG 2 1HH2 ARG 2 -4.866 6.566 -2.814
28 2HH2 ARG 2 2HH2 ARG 2 -3.297 7.296 -2.739
29 H TRP 3 H TRP 3 -5.974 0.576 2.700
30 HA TRP 3 HA TRP 3 -7.911 -0.639 1.030
31 1HB TRP 3 2HB TRP 3 -6.497 -0.749 -1.047
32 2HB TRP 3 1HB TRP 3 -7.149 0.843 -0.692
33 HD1 TRP 3 HD TRP 3 -4.213 0.175 1.482
34 HE1 TRP 3 1HE TRP 3 -2.150 1.408 0.565
35 HE3 TRP 3 3HE TRP 3 -6.013 1.452 -3.126
36 HZ2 TRP 3 2HZ TRP 3 -1.398 2.736 -1.793
37 HZ3 TRP 3 3HZ TRP 3 -4.548 2.697 -4.657
38 HH2 TRP 3 HH TRP 3 -2.283 3.330 -4.003
39 H GLN 4 H GLN 4 -5.468 -1.871 -0.480
40 HA GLN 4 HA GLN 4 -4.299 -3.464 1.661
41 1HB GLN 4 2HB GLN 4 -4.856 -5.572 0.467
42 2HB GLN 4 1HB GLN 4 -6.275 -4.735 1.084
43 1HG GLN 4 2HG GLN 4 -6.693 -3.822 -1.149
44 2HG GLN 4 1HG GLN 4 -5.292 -4.697 -1.759
45 1HE2 GLN 4 1HE2 GLN 4 -6.595 -6.630 0.542
46 2HE2 GLN 4 2HE2 GLN 4 -7.632 -7.599 -0.441
47 H TRP 5 H TRP 5 -2.894 -1.647 0.433
48 HA TRP 5 HA TRP 5 -1.716 -2.186 -2.035
49 1HB TRP 5 2HB TRP 5 0.108 -0.709 -1.248
50 2HB TRP 5 1HB TRP 5 -1.486 -0.042 -0.906
51 HD1 TRP 5 HD TRP 5 -2.349 -0.818 1.772
52 HE1 TRP 5 1HE TRP 5 -0.963 -0.523 3.921
53 HE3 TRP 5 3HE TRP 5 2.316 -0.494 -0.302
54 HZ2 TRP 5 2HZ TRP 5 1.742 -0.193 4.641
55 HZ3 TRP 5 3HZ TRP 5 4.249 -0.187 1.190
56 HH2 TRP 5 HH TRP 5 3.965 -0.041 3.610
57 H ARG 6 H ARG 6 1.090 -2.122 -1.315
58 HA ARG 6 HA ARG 6 1.619 -4.657 0.006
59 1HB ARG 6 2HB ARG 6 2.432 -4.172 -2.870
60 2HB ARG 6 1HB ARG 6 2.893 -5.559 -1.894
61 1HG ARG 6 2HG ARG 6 0.575 -6.268 -1.764
62 2HG ARG 6 1HG ARG 6 0.076 -4.848 -2.686
63 1HD ARG 6 2HD ARG 6 1.474 -5.636 -4.571
64 2HD ARG 6 1HD ARG 6 1.847 -7.092 -3.649
65 HE ARG 6 HE ARG 6 -0.936 -6.824 -3.802
66 1HH1 ARG 6 1HH1 ARG 6 1.789 -7.484 -5.870
67 2HH1 ARG 6 2HH1 ARG 6 0.869 -8.422 -6.999
68 1HH2 ARG 6 1HH2 ARG 6 -2.156 -8.055 -5.285
69 2HH2 ARG 6 2HH2 ARG 6 -1.373 -8.746 -6.667
70 H MET 7 H MET 7 3.254 -2.341 -2.166
71 HA MET 7 HA MET 7 4.857 -1.177 -0.180
72 1HB MET 7 2HB MET 7 7.056 -2.171 -0.793
73 2HB MET 7 1HB MET 7 5.970 -3.307 -0.004
74 1HG MET 7 2HG MET 7 5.400 -4.271 -2.172
75 2HG MET 7 1HG MET 7 6.486 -3.131 -2.964
76 1HE MET 7 1HE MET 7 7.182 -6.760 -0.506
77 2HE MET 7 2HE MET 7 6.154 -5.392 -0.082
78 3HE MET 7 3HE MET 7 7.826 -5.446 0.478
79 H LYS 8 H LYS 8 3.374 -0.174 -2.271
80 HA LYS 8 HA LYS 8 5.258 0.564 -4.376
81 1HB LYS 8 2HB LYS 8 2.313 1.161 -4.059
82 2HB LYS 8 1HB LYS 8 3.291 1.621 -5.445
83 1HG LYS 8 2HG LYS 8 3.703 -0.730 -5.945
84 2HG LYS 8 1HG LYS 8 2.738 -1.199 -4.544
85 1HD LYS 8 2HD LYS 8 1.417 -1.381 -6.575
86 2HD LYS 8 1HD LYS 8 0.781 -0.096 -5.546
87 1HE LYS 8 2HE LYS 8 1.942 1.570 -6.908
88 2HE LYS 8 1HE LYS 8 2.590 0.287 -7.931
89 1HZ LYS 8 1HZ LYS 8 0.528 1.507 -8.740
90 2HZ LYS 8 2HZ LYS 8 -0.321 0.644 -7.560
91 3HZ LYS 8 3HZ LYS 8 0.489 -0.184 -8.791
92 H LYS 9 H LYS 9 3.114 2.155 -2.025
93 HA LYS 9 HA LYS 9 4.111 4.760 -2.573
94 1HB LYS 9 2HB LYS 9 2.890 5.418 -0.510
95 2HB LYS 9 1HB LYS 9 1.902 4.532 -1.663
96 1HG LYS 9 2HG LYS 9 2.146 2.507 -0.338
97 2HG LYS 9 1HG LYS 9 3.177 3.370 0.806
98 1HD LYS 9 2HD LYS 9 1.347 4.850 1.384
99 2HD LYS 9 1HD LYS 9 0.313 4.085 0.176
100 1HE LYS 9 2HE LYS 9 0.468 1.970 1.399
101 2HE LYS 9 1HE LYS 9 1.489 2.745 2.609
102 1HZ LYS 9 1HZ LYS 9 -1.124 2.515 2.884
103 2HZ LYS 9 2HZ LYS 9 -1.087 3.994 2.065
104 3HZ LYS 9 3HZ LYS 9 -0.258 3.820 3.528
105 H LEU 10 H LEU 10 4.842 2.351 -0.096
106 HA LEU 10 HA LEU 10 6.536 3.936 1.483
107 1HB LEU 10 2HB LEU 10 5.669 1.792 2.246
108 2HB LEU 10 1HB LEU 10 6.581 0.956 1.004
109 HG LEU 10 HG LEU 10 8.685 1.674 2.082
110 1HD1 LEU 10 1HD1 LEU 10 7.642 2.379 4.646
111 2HD1 LEU 10 2HD1 LEU 10 6.993 3.477 3.428
112 3HD1 LEU 10 3HD1 LEU 10 8.738 3.285 3.601
113 1HD2 LEU 10 1HD2 LEU 10 8.682 -0.084 3.506
114 2HD2 LEU 10 2HD2 LEU 10 7.125 -0.398 2.740
115 3HD2 LEU 10 3HD2 LEU 10 7.190 0.420 4.301
116 H GLY 11 H GLY 11 8.628 4.525 1.325
117 1HA GLY 11 2HA GLY 11 10.620 3.223 -0.149
118 2HA GLY 11 1HA GLY 11 9.924 4.467 -1.178
Start of MODEL 6
1 1H ARG 1 1HT ARG 1 -9.263 0.641 6.546
2 2H ARG 1 2HT ARG 1 -8.118 1.031 7.727
3 3H ARG 1 3HT ARG 1 -8.119 -0.509 7.027
4 HA ARG 1 HA ARG 1 -6.805 1.834 6.173
5 1HB ARG 1 2HB ARG 1 -6.914 -1.008 5.143
6 2HB ARG 1 1HB ARG 1 -5.731 0.189 4.637
7 1HG ARG 1 2HG ARG 1 -4.951 0.352 6.975
8 2HG ARG 1 1HG ARG 1 -6.080 -0.933 7.409
9 1HD ARG 1 2HD ARG 1 -4.957 -2.455 5.877
10 2HD ARG 1 1HD ARG 1 -3.852 -1.171 5.389
11 HE ARG 1 HE ARG 1 -3.692 -1.482 8.169
12 1HH1 ARG 1 1HH1 ARG 1 -2.901 -3.209 5.246
13 2HH1 ARG 1 2HH1 ARG 1 -1.574 -4.065 5.959
14 1HH2 ARG 1 1HH2 ARG 1 -1.944 -2.605 9.114
15 2HH2 ARG 1 2HH2 ARG 1 -1.032 -3.723 8.156
16 H ARG 2 H ARG 2 -6.861 2.947 4.281
17 HA ARG 2 HA ARG 2 -9.279 3.317 2.966
18 1HB ARG 2 2HB ARG 2 -7.977 4.593 1.296
19 2HB ARG 2 1HB ARG 2 -7.562 5.018 2.951
20 1HG ARG 2 2HG ARG 2 -5.570 3.592 2.803
21 2HG ARG 2 1HG ARG 2 -5.980 3.219 1.127
22 1HD ARG 2 2HD ARG 2 -5.380 5.957 2.240
23 2HD ARG 2 1HD ARG 2 -4.290 4.978 1.261
24 HE ARG 2 HE ARG 2 -6.670 5.302 -0.159
25 1HH1 ARG 2 1HH1 ARG 2 -4.004 7.229 0.994
26 2HH1 ARG 2 2HH1 ARG 2 -4.137 8.400 -0.275
27 1HH2 ARG 2 1HH2 ARG 2 -6.851 6.843 -1.831
28 2HH2 ARG 2 2HH2 ARG 2 -5.753 8.181 -1.878
29 H TRP 3 H TRP 3 -6.628 1.138 2.220
30 HA TRP 3 HA TRP 3 -8.341 -0.269 0.364
31 1HB TRP 3 2HB TRP 3 -6.626 -0.260 -1.455
32 2HB TRP 3 1HB TRP 3 -7.367 1.305 -1.168
33 HD1 TRP 3 HD TRP 3 -4.779 0.659 1.417
34 HE1 TRP 3 1HE TRP 3 -2.634 1.964 0.845
35 HE3 TRP 3 3HE TRP 3 -5.892 1.981 -3.391
36 HZ2 TRP 3 2HZ TRP 3 -1.568 3.353 -1.353
37 HZ3 TRP 3 3HZ TRP 3 -4.246 3.291 -4.664
38 HH2 TRP 3 HH TRP 3 -2.124 3.966 -3.663
39 H GLN 4 H GLN 4 -5.559 -1.318 -0.691
40 HA GLN 4 HA GLN 4 -4.587 -2.834 1.556
41 1HB GLN 4 2HB GLN 4 -5.101 -5.033 0.477
42 2HB GLN 4 1HB GLN 4 -6.521 -4.168 1.055
43 1HG GLN 4 2HG GLN 4 -6.939 -3.370 -1.227
44 2HG GLN 4 1HG GLN 4 -5.549 -4.297 -1.788
45 1HE2 GLN 4 1HE2 GLN 4 -6.092 -6.120 -2.728
46 2HE2 GLN 4 2HE2 GLN 4 -7.438 -7.124 -2.318
47 H TRP 5 H TRP 5 -3.104 -1.152 0.275
48 HA TRP 5 HA TRP 5 -1.855 -1.841 -2.119
49 1HB TRP 5 2HB TRP 5 -0.027 -0.367 -1.339
50 2HB TRP 5 1HB TRP 5 -1.613 0.349 -1.062
51 HD1 TRP 5 HD TRP 5 -2.569 -0.290 1.607
52 HE1 TRP 5 1HE TRP 5 -1.233 0.014 3.790
53 HE3 TRP 5 3HE TRP 5 2.163 -0.206 -0.334
54 HZ2 TRP 5 2HZ TRP 5 1.466 0.255 4.583
55 HZ3 TRP 5 3HZ TRP 5 4.065 0.065 1.204
56 HH2 TRP 5 HH TRP 5 3.722 0.291 3.610
57 H ARG 6 H ARG 6 0.921 -1.820 -1.325
58 HA ARG 6 HA ARG 6 1.372 -4.253 0.188
59 1HB ARG 6 2HB ARG 6 2.160 -4.049 -2.727
60 2HB ARG 6 1HB ARG 6 2.671 -5.325 -1.632
61 1HG ARG 6 2HG ARG 6 0.337 -6.017 -1.362
62 2HG ARG 6 1HG ARG 6 -0.158 -4.748 -2.484
63 1HD ARG 6 2HD ARG 6 1.230 -5.786 -4.232
64 2HD ARG 6 1HD ARG 6 1.656 -7.076 -3.108
65 HE ARG 6 HE ARG 6 -1.143 -6.894 -3.289
66 1HH1 ARG 6 1HH1 ARG 6 1.616 -7.876 -5.184
67 2HH1 ARG 6 2HH1 ARG 6 0.718 -9.014 -6.131
68 1HH2 ARG 6 1HH2 ARG 6 -2.327 -8.388 -4.532
69 2HH2 ARG 6 2HH2 ARG 6 -1.522 -9.306 -5.762
70 H MET 7 H MET 7 3.012 -2.109 -2.145
71 HA MET 7 HA MET 7 4.684 -0.881 -0.252
72 1HB MET 7 2HB MET 7 6.846 -1.931 -0.860
73 2HB MET 7 1HB MET 7 5.759 -3.041 -0.036
74 1HG MET 7 2HG MET 7 5.145 -4.028 -2.193
75 2HG MET 7 1HG MET 7 6.261 -2.929 -3.003
76 1HE MET 7 1HE MET 7 7.730 -5.769 0.250
77 2HE MET 7 2HE MET 7 6.275 -6.326 -0.577
78 3HE MET 7 3HE MET 7 6.275 -4.773 0.261
79 H LYS 8 H LYS 8 3.129 -0.002 -2.375
80 HA LYS 8 HA LYS 8 4.940 0.624 -4.568
81 1HB LYS 8 2HB LYS 8 2.034 1.343 -4.152
82 2HB LYS 8 1HB LYS 8 2.961 1.667 -5.607
83 1HG LYS 8 2HG LYS 8 2.578 -1.117 -4.556
84 2HG LYS 8 1HG LYS 8 1.404 -0.346 -5.619
85 1HD LYS 8 2HD LYS 8 2.794 -1.609 -7.039
86 2HD LYS 8 1HD LYS 8 3.345 0.056 -7.217
87 1HE LYS 8 2HE LYS 8 5.189 -0.378 -5.686
88 2HE LYS 8 1HE LYS 8 4.620 -2.030 -5.449
89 1HZ LYS 8 1HZ LYS 8 6.437 -1.936 -7.037
90 2HZ LYS 8 2HZ LYS 8 5.561 -0.875 -8.021
91 3HZ LYS 8 3HZ LYS 8 5.018 -2.461 -7.795
92 H LYS 9 H LYS 9 3.009 2.339 -2.132
93 HA LYS 9 HA LYS 9 3.942 4.920 -2.847
94 1HB LYS 9 2HB LYS 9 2.936 5.667 -0.745
95 2HB LYS 9 1HB LYS 9 1.849 4.610 -1.633
96 1HG LYS 9 2HG LYS 9 2.482 2.746 -0.167
97 2HG LYS 9 1HG LYS 9 3.534 3.837 0.741
98 1HD LYS 9 2HD LYS 9 1.570 5.234 1.278
99 2HD LYS 9 1HD LYS 9 0.542 4.079 0.428
100 1HE LYS 9 2HE LYS 9 0.464 3.682 2.820
101 2HE LYS 9 1HE LYS 9 1.230 2.324 1.995
102 1HZ LYS 9 1HZ LYS 9 2.304 3.239 4.119
103 2HZ LYS 9 2HZ LYS 9 2.860 4.501 3.140
104 3HZ LYS 9 3HZ LYS 9 3.307 2.907 2.797
105 H LEU 10 H LEU 10 5.050 2.507 -0.547
106 HA LEU 10 HA LEU 10 6.830 4.037 0.945
107 1HB LEU 10 2HB LEU 10 6.238 1.739 1.514
108 2HB LEU 10 1HB LEU 10 7.076 1.153 0.090
109 HG LEU 10 HG LEU 10 9.211 1.972 1.034
110 1HD1 LEU 10 1HD1 LEU 10 8.384 3.766 2.428
111 2HD1 LEU 10 2HD1 LEU 10 9.286 2.611 3.409
112 3HD1 LEU 10 3HD1 LEU 10 7.522 2.613 3.447
113 1HD2 LEU 10 1HD2 LEU 10 9.548 0.113 2.340
114 2HD2 LEU 10 2HD2 LEU 10 8.081 -0.346 1.476
115 3HD2 LEU 10 3HD2 LEU 10 7.980 0.250 3.132
116 H GLY 11 H GLY 11 8.862 4.794 0.647
117 1HA GLY 11 2HA GLY 11 10.697 3.862 -1.271
118 2HA GLY 11 1HA GLY 11 9.827 5.230 -1.950
Start of MODEL 7
1 1H ARG 1 1HT ARG 1 -8.851 1.565 6.691
2 2H ARG 1 2HT ARG 1 -7.850 0.962 7.913
3 3H ARG 1 3HT ARG 1 -8.478 -0.084 6.742
4 HA ARG 1 HA ARG 1 -6.250 1.786 6.575
5 1HB ARG 1 2HB ARG 1 -6.863 -0.876 5.276
6 2HB ARG 1 1HB ARG 1 -5.319 -0.038 5.217
7 1HG ARG 1 2HG ARG 1 -5.151 -0.245 7.670
8 2HG ARG 1 1HG ARG 1 -6.654 -1.169 7.668
9 1HD ARG 1 2HD ARG 1 -4.752 -2.668 7.740
10 2HD ARG 1 1HD ARG 1 -5.606 -2.843 6.208
11 HE ARG 1 HE ARG 1 -3.665 -2.272 5.174
12 1HH1 ARG 1 1HH1 ARG 1 -3.628 -0.875 8.371
13 2HH1 ARG 1 2HH1 ARG 1 -2.050 -0.186 8.188
14 1HH2 ARG 1 1HH2 ARG 1 -1.589 -1.368 4.932
15 2HH2 ARG 1 2HH2 ARG 1 -0.892 -0.466 6.236
16 H ARG 2 H ARG 2 -5.591 2.756 4.658
17 HA ARG 2 HA ARG 2 -7.485 3.967 3.071
18 1HB ARG 2 2HB ARG 2 -5.145 4.705 3.241
19 2HB ARG 2 1HB ARG 2 -4.635 3.302 2.314
20 1HG ARG 2 2HG ARG 2 -5.923 4.115 0.394
21 2HG ARG 2 1HG ARG 2 -6.396 5.537 1.327
22 1HD ARG 2 2HD ARG 2 -4.036 6.163 1.549
23 2HD ARG 2 1HD ARG 2 -3.574 4.749 0.604
24 HE ARG 2 HE ARG 2 -4.015 5.965 -1.265
25 1HH1 ARG 2 1HH1 ARG 2 -5.887 7.300 1.357
26 2HH1 ARG 2 2HH1 ARG 2 -6.557 8.576 0.397
27 1HH2 ARG 2 1HH2 ARG 2 -4.892 7.644 -2.532
28 2HH2 ARG 2 2HH2 ARG 2 -5.992 8.771 -1.812
29 H TRP 3 H TRP 3 -5.760 0.942 2.501
30 HA TRP 3 HA TRP 3 -7.823 -0.135 0.904
31 1HB TRP 3 2HB TRP 3 -6.498 -0.312 -1.238
32 2HB TRP 3 1HB TRP 3 -7.079 1.301 -0.856
33 HD1 TRP 3 HD TRP 3 -4.145 0.735 1.260
34 HE1 TRP 3 1HE TRP 3 -2.036 1.750 0.195
35 HE3 TRP 3 3HE TRP 3 -5.922 1.528 -3.465
36 HZ2 TRP 3 2HZ TRP 3 -1.240 2.733 -2.311
37 HZ3 TRP 3 3HZ TRP 3 -4.411 2.505 -5.142
38 HH2 TRP 3 HH TRP 3 -2.113 3.100 -4.574
39 H GLN 4 H GLN 4 -5.543 -1.545 -0.711
40 HA GLN 4 HA GLN 4 -4.485 -3.214 1.450
41 1HB GLN 4 2HB GLN 4 -5.875 -4.286 -1.012
42 2HB GLN 4 1HB GLN 4 -5.085 -5.255 0.225
43 1HG GLN 4 2HG GLN 4 -6.690 -4.408 1.880
44 2HG GLN 4 1HG GLN 4 -7.500 -3.502 0.606
45 1HE2 GLN 4 1HE2 GLN 4 -6.438 -6.247 -0.823
46 2HE2 GLN 4 2HE2 GLN 4 -7.835 -7.243 -0.630
47 H TRP 5 H TRP 5 -2.914 -1.419 0.346
48 HA TRP 5 HA TRP 5 -1.605 -2.080 -2.050
49 1HB TRP 5 2HB TRP 5 0.180 -0.579 -1.242
50 2HB TRP 5 1HB TRP 5 -1.419 0.125 -1.021
51 HD1 TRP 5 HD TRP 5 -2.423 -0.446 1.654
52 HE1 TRP 5 1HE TRP 5 -1.134 -0.062 3.847
53 HE3 TRP 5 3HE TRP 5 2.340 -0.376 -0.204
54 HZ2 TRP 5 2HZ TRP 5 1.546 0.237 4.680
55 HZ3 TRP 5 3HZ TRP 5 4.210 -0.032 1.359
56 HH2 TRP 5 HH TRP 5 3.818 0.268 3.750
57 H ARG 6 H ARG 6 1.143 -2.049 -1.206
58 HA ARG 6 HA ARG 6 1.551 -4.470 0.346
59 1HB ARG 6 2HB ARG 6 2.456 -4.277 -2.536
60 2HB ARG 6 1HB ARG 6 2.894 -5.558 -1.417
61 1HG ARG 6 2HG ARG 6 0.504 -6.168 -1.243
62 2HG ARG 6 1HG ARG 6 0.139 -4.946 -2.463
63 1HD ARG 6 2HD ARG 6 1.912 -7.361 -2.815
64 2HD ARG 6 1HD ARG 6 0.295 -7.145 -3.481
65 HE ARG 6 HE ARG 6 1.872 -5.023 -4.365
66 1HH1 ARG 6 1HH1 ARG 6 1.683 -8.483 -4.728
67 2HH1 ARG 6 2HH1 ARG 6 2.362 -8.483 -6.322
68 1HH2 ARG 6 1HH2 ARG 6 2.767 -5.013 -6.465
69 2HH2 ARG 6 2HH2 ARG 6 2.978 -6.512 -7.308
70 H MET 7 H MET 7 3.219 -2.259 -1.901
71 HA MET 7 HA MET 7 4.845 -1.088 0.058
72 1HB MET 7 2HB MET 7 7.049 -2.099 -0.760
73 2HB MET 7 1HB MET 7 6.064 -3.070 0.323
74 1HG MET 7 2HG MET 7 6.932 -4.471 -1.403
75 2HG MET 7 1HG MET 7 5.193 -4.303 -1.628
76 1HE MET 7 1HE MET 7 6.581 -4.647 -5.288
77 2HE MET 7 2HE MET 7 5.523 -5.339 -4.059
78 3HE MET 7 3HE MET 7 7.273 -5.410 -3.857
79 H LYS 8 H LYS 8 3.292 -0.287 -2.182
80 HA LYS 8 HA LYS 8 5.149 0.528 -4.253
81 1HB LYS 8 2HB LYS 8 2.223 1.174 -3.849
82 2HB LYS 8 1HB LYS 8 3.169 1.613 -5.264
83 1HG LYS 8 2HG LYS 8 3.510 -0.741 -5.783
84 2HG LYS 8 1HG LYS 8 2.594 -1.196 -4.347
85 1HD LYS 8 2HD LYS 8 0.610 -0.097 -5.256
86 2HD LYS 8 1HD LYS 8 1.527 0.387 -6.685
87 1HE LYS 8 2HE LYS 8 0.976 -2.448 -5.814
88 2HE LYS 8 1HE LYS 8 0.151 -1.593 -7.117
89 1HZ LYS 8 1HZ LYS 8 3.036 -2.293 -7.022
90 2HZ LYS 8 2HZ LYS 8 2.306 -1.385 -8.247
91 3HZ LYS 8 3HZ LYS 8 1.863 -3.001 -8.016
92 H LYS 9 H LYS 9 3.136 2.051 -1.776
93 HA LYS 9 HA LYS 9 4.104 4.689 -2.276
94 1HB LYS 9 2HB LYS 9 2.945 5.276 -0.177
95 2HB LYS 9 1HB LYS 9 1.919 4.363 -1.274
96 1HG LYS 9 2HG LYS 9 2.359 2.331 0.029
97 2HG LYS 9 1HG LYS 9 3.348 3.275 1.142
98 1HD LYS 9 2HD LYS 9 1.203 3.042 2.144
99 2HD LYS 9 1HD LYS 9 1.325 4.704 1.571
100 1HE LYS 9 2HE LYS 9 -0.044 2.471 0.075
101 2HE LYS 9 1HE LYS 9 -0.871 3.637 1.104
102 1HZ LYS 9 1HZ LYS 9 -1.108 4.624 -0.919
103 2HZ LYS 9 2HZ LYS 9 0.350 4.023 -1.530
104 3HZ LYS 9 3HZ LYS 9 0.360 5.326 -0.452
105 H LEU 10 H LEU 10 4.986 2.098 -0.088
106 HA LEU 10 HA LEU 10 6.640 3.462 1.678
107 1HB LEU 10 2HB LEU 10 5.976 1.133 1.984
108 2HB LEU 10 1HB LEU 10 6.932 0.660 0.591
109 HG LEU 10 HG LEU 10 8.981 1.376 1.799
110 1HD1 LEU 10 1HD1 LEU 10 8.984 2.318 3.843
111 2HD1 LEU 10 2HD1 LEU 10 7.589 1.389 4.393
112 3HD1 LEU 10 3HD1 LEU 10 7.356 2.819 3.387
113 1HD2 LEU 10 1HD2 LEU 10 7.358 -0.907 2.251
114 2HD2 LEU 10 2HD2 LEU 10 8.128 -0.470 3.776
115 3HD2 LEU 10 3HD2 LEU 10 9.113 -0.767 2.344
116 H GLY 11 H GLY 11 8.653 4.282 1.587
117 1HA GLY 11 2HA GLY 11 10.691 3.475 -0.162
118 2HA GLY 11 1HA GLY 11 9.859 4.842 -0.889
Start of MODEL 8
1 1H ARG 1 1HT ARG 1 -5.390 2.318 7.709
2 2H ARG 1 2HT ARG 1 -6.685 3.278 7.202
3 3H ARG 1 3HT ARG 1 -5.098 3.740 6.841
4 HA ARG 1 HA ARG 1 -4.963 2.442 5.057
5 1HB ARG 1 2HB ARG 1 -6.611 0.385 6.545
6 2HB ARG 1 1HB ARG 1 -5.714 0.114 5.058
7 1HG ARG 1 2HG ARG 1 -4.563 0.745 7.767
8 2HG ARG 1 1HG ARG 1 -4.499 -0.800 6.920
9 1HD ARG 1 2HD ARG 1 -3.150 0.217 5.154
10 2HD ARG 1 1HD ARG 1 -3.234 1.773 5.980
11 HE ARG 1 HE ARG 1 -2.185 -0.149 7.741
12 1HH1 ARG 1 1HH1 ARG 1 -1.326 1.609 4.858
13 2HH1 ARG 1 2HH1 ARG 1 0.374 1.560 5.180
14 1HH2 ARG 1 1HH2 ARG 1 0.050 -0.216 8.176
15 2HH2 ARG 1 2HH2 ARG 1 1.157 0.525 7.069
16 H ARG 2 H ARG 2 -6.159 2.267 3.159
17 HA ARG 2 HA ARG 2 -9.059 2.478 3.315
18 1HB ARG 2 2HB ARG 2 -8.897 4.398 1.587
19 2HB ARG 2 1HB ARG 2 -8.668 4.766 3.289
20 1HG ARG 2 2HG ARG 2 -7.027 5.955 2.031
21 2HG ARG 2 1HG ARG 2 -6.214 4.672 2.924
22 1HD ARG 2 2HD ARG 2 -5.329 4.799 0.679
23 2HD ARG 2 1HD ARG 2 -6.209 3.287 0.889
24 HE ARG 2 HE ARG 2 -7.520 3.936 -0.845
25 1HH1 ARG 2 1HH1 ARG 2 -6.298 6.813 0.703
26 2HH1 ARG 2 2HH1 ARG 2 -7.086 7.892 -0.397
27 1HH2 ARG 2 1HH2 ARG 2 -8.557 5.353 -2.296
28 2HH2 ARG 2 2HH2 ARG 2 -8.369 7.064 -2.100
29 H TRP 3 H TRP 3 -7.155 0.464 2.378
30 HA TRP 3 HA TRP 3 -8.482 -0.324 0.043
31 1HB TRP 3 2HB TRP 3 -6.544 -0.188 -1.566
32 2HB TRP 3 1HB TRP 3 -7.300 1.349 -1.175
33 HD1 TRP 3 HD TRP 3 -5.040 0.315 1.586
34 HE1 TRP 3 1HE TRP 3 -2.839 1.642 1.442
35 HE3 TRP 3 3HE TRP 3 -5.577 2.267 -3.102
36 HZ2 TRP 3 2HZ TRP 3 -1.514 3.281 -0.421
37 HZ3 TRP 3 3HZ TRP 3 -3.787 3.694 -3.997
38 HH2 TRP 3 HH TRP 3 -1.796 4.195 -2.680
39 H GLN 4 H GLN 4 -5.582 -1.340 -0.832
40 HA GLN 4 HA GLN 4 -4.893 -3.203 1.214
41 1HB GLN 4 2HB GLN 4 -5.494 -5.240 -0.093
42 2HB GLN 4 1HB GLN 4 -6.891 -4.337 0.479
43 1HG GLN 4 2HG GLN 4 -7.147 -3.328 -1.725
44 2HG GLN 4 1HG GLN 4 -5.750 -4.232 -2.301
45 1HE2 GLN 4 1HE2 GLN 4 -6.274 -5.933 -3.457
46 2HE2 GLN 4 2HE2 GLN 4 -7.668 -6.930 -3.241
47 H TRP 5 H TRP 5 -3.291 -1.448 0.114
48 HA TRP 5 HA TRP 5 -1.977 -2.037 -2.274
49 1HB TRP 5 2HB TRP 5 -0.120 -0.693 -1.340
50 2HB TRP 5 1HB TRP 5 -1.687 0.078 -1.107
51 HD1 TRP 5 HD TRP 5 -2.793 -0.609 1.485
52 HE1 TRP 5 1HE TRP 5 -1.554 -0.443 3.735
53 HE3 TRP 5 3HE TRP 5 2.019 -0.708 -0.234
54 HZ2 TRP 5 2HZ TRP 5 1.118 -0.369 4.659
55 HZ3 TRP 5 3HZ TRP 5 3.859 -0.588 1.395
56 HH2 TRP 5 HH TRP 5 3.414 -0.422 3.790
57 H ARG 6 H ARG 6 0.766 -2.180 -1.416
58 HA ARG 6 HA ARG 6 1.084 -4.688 -0.001
59 1HB ARG 6 2HB ARG 6 1.851 -4.418 -2.914
60 2HB ARG 6 1HB ARG 6 2.396 -5.718 -1.865
61 1HG ARG 6 2HG ARG 6 0.070 -6.422 -1.545
62 2HG ARG 6 1HG ARG 6 -0.458 -5.133 -2.630
63 1HD ARG 6 2HD ARG 6 -0.334 -7.277 -3.794
64 2HD ARG 6 1HD ARG 6 0.828 -6.124 -4.449
65 HE ARG 6 HE ARG 6 2.124 -7.629 -2.492
66 1HH1 ARG 6 1HH1 ARG 6 0.672 -8.093 -5.625
67 2HH1 ARG 6 2HH1 ARG 6 1.711 -9.411 -6.054
68 1HH2 ARG 6 1HH2 ARG 6 3.498 -9.358 -3.050
69 2HH2 ARG 6 2HH2 ARG 6 3.319 -10.128 -4.592
70 H MET 7 H MET 7 2.763 -2.378 -2.139
71 HA MET 7 HA MET 7 4.537 -1.481 -0.148
72 1HB MET 7 2HB MET 7 6.636 -2.497 -0.988
73 2HB MET 7 1HB MET 7 5.536 -3.679 -0.294
74 1HG MET 7 2HG MET 7 4.807 -4.309 -2.550
75 2HG MET 7 1HG MET 7 5.948 -3.148 -3.228
76 1HE MET 7 1HE MET 7 8.403 -3.143 -2.727
77 2HE MET 7 2HE MET 7 9.382 -4.586 -2.467
78 3HE MET 7 3HE MET 7 8.610 -3.785 -1.099
79 H LYS 8 H LYS 8 2.941 -0.274 -2.098
80 HA LYS 8 HA LYS 8 4.700 0.618 -4.233
81 1HB LYS 8 2HB LYS 8 1.857 1.391 -3.552
82 2HB LYS 8 1HB LYS 8 2.737 1.931 -4.975
83 1HG LYS 8 2HG LYS 8 2.048 -0.927 -4.327
84 2HG LYS 8 1HG LYS 8 1.201 0.100 -5.483
85 1HD LYS 8 2HD LYS 8 4.113 -0.678 -5.652
86 2HD LYS 8 1HD LYS 8 2.806 -1.428 -6.570
87 1HE LYS 8 2HE LYS 8 2.310 0.745 -7.605
88 2HE LYS 8 1HE LYS 8 3.643 1.468 -6.705
89 1HZ LYS 8 1HZ LYS 8 3.732 0.130 -9.165
90 2HZ LYS 8 2HZ LYS 8 4.619 -0.782 -8.050
91 3HZ LYS 8 3HZ LYS 8 5.009 0.843 -8.314
92 H LYS 9 H LYS 9 3.021 1.972 -1.434
93 HA LYS 9 HA LYS 9 4.065 4.600 -1.733
94 1HB LYS 9 2HB LYS 9 3.220 4.962 0.552
95 2HB LYS 9 1HB LYS 9 2.020 4.190 -0.477
96 1HG LYS 9 2HG LYS 9 2.629 2.009 0.521
97 2HG LYS 9 1HG LYS 9 3.728 2.854 1.613
98 1HD LYS 9 2HD LYS 9 1.641 2.428 2.749
99 2HD LYS 9 1HD LYS 9 1.809 4.162 2.468
100 1HE LYS 9 2HE LYS 9 0.347 3.986 0.514
101 2HE LYS 9 1HE LYS 9 0.180 2.253 0.793
102 1HZ LYS 9 1HZ LYS 9 -0.983 2.642 2.796
103 2HZ LYS 9 2HZ LYS 9 -1.676 3.677 1.651
104 3HZ LYS 9 3HZ LYS 9 -0.599 4.290 2.800
105 H LEU 10 H LEU 10 5.062 1.755 0.080
106 HA LEU 10 HA LEU 10 7.054 2.891 1.667
107 1HB LEU 10 2HB LEU 10 6.193 0.595 1.924
108 2HB LEU 10 1HB LEU 10 6.993 0.135 0.433
109 HG LEU 10 HG LEU 10 9.183 0.653 1.496
110 1HD1 LEU 10 1HD1 LEU 10 8.299 2.251 3.171
111 2HD1 LEU 10 2HD1 LEU 10 9.330 1.003 3.870
112 3HD1 LEU 10 3HD1 LEU 10 7.577 0.894 4.035
113 1HD2 LEU 10 1HD2 LEU 10 8.199 -1.258 3.422
114 2HD2 LEU 10 2HD2 LEU 10 9.288 -1.496 2.055
115 3HD2 LEU 10 3HD2 LEU 10 7.542 -1.571 1.815
116 H GLY 11 H GLY 11 9.093 3.565 1.304
117 1HA GLY 11 2HA GLY 11 10.827 2.676 -0.689
118 2HA GLY 11 1HA GLY 11 9.972 4.067 -1.340
Start of MODEL 9
1 1H ARG 1 1HT ARG 1 -7.040 0.596 7.225
2 2H ARG 1 2HT ARG 1 -6.527 -1.010 7.088
3 3H ARG 1 3HT ARG 1 -7.959 -0.514 6.338
4 HA ARG 1 HA ARG 1 -5.411 0.771 5.634
5 1HB ARG 1 2HB ARG 1 -6.501 -1.783 4.433
6 2HB ARG 1 1HB ARG 1 -5.083 -0.907 3.880
7 1HG ARG 1 2HG ARG 1 -5.368 -2.209 6.581
8 2HG ARG 1 1HG ARG 1 -4.527 -2.907 5.197
9 1HD ARG 1 2HD ARG 1 -2.858 -1.944 6.562
10 2HD ARG 1 1HD ARG 1 -3.070 -0.844 5.202
11 HE ARG 1 HE ARG 1 -4.725 -0.016 7.312
12 1HH1 ARG 1 1HH1 ARG 1 -1.343 -0.217 6.485
13 2HH1 ARG 1 2HH1 ARG 1 -0.892 1.127 7.480
14 1HH2 ARG 1 1HH2 ARG 1 -4.136 1.750 8.621
15 2HH2 ARG 1 2HH2 ARG 1 -2.476 2.241 8.696
16 H ARG 2 H ARG 2 -5.669 2.166 3.972
17 HA ARG 2 HA ARG 2 -8.228 3.036 3.233
18 1HB ARG 2 2HB ARG 2 -7.068 4.404 1.530
19 2HB ARG 2 1HB ARG 2 -6.318 4.523 3.116
20 1HG ARG 2 2HG ARG 2 -4.537 3.059 2.446
21 2HG ARG 2 1HG ARG 2 -5.326 2.747 0.898
22 1HD ARG 2 2HD ARG 2 -4.318 5.429 1.842
23 2HD ARG 2 1HD ARG 2 -3.490 4.372 0.699
24 HE ARG 2 HE ARG 2 -6.063 4.842 -0.272
25 1HH1 ARG 2 1HH1 ARG 2 -3.126 6.613 0.350
26 2HH1 ARG 2 2HH1 ARG 2 -3.409 7.774 -0.904
27 1HH2 ARG 2 1HH2 ARG 2 -6.442 6.362 -1.923
28 2HH2 ARG 2 2HH2 ARG 2 -5.293 7.629 -2.200
29 H TRP 3 H TRP 3 -6.107 0.652 1.851
30 HA TRP 3 HA TRP 3 -8.227 -0.295 0.145
31 1HB TRP 3 2HB TRP 3 -6.817 -0.233 -1.929
32 2HB TRP 3 1HB TRP 3 -7.327 1.348 -1.359
33 HD1 TRP 3 HD TRP 3 -4.508 0.284 0.747
34 HE1 TRP 3 1HE TRP 3 -2.310 1.325 -0.084
35 HE3 TRP 3 3HE TRP 3 -6.064 1.917 -3.841
36 HZ2 TRP 3 2HZ TRP 3 -1.368 2.636 -2.378
37 HZ3 TRP 3 3HZ TRP 3 -4.438 3.049 -5.298
38 HH2 TRP 3 HH TRP 3 -2.133 3.406 -4.578
39 H GLN 4 H GLN 4 -5.730 -1.482 -1.438
40 HA GLN 4 HA GLN 4 -4.840 -3.420 0.545
41 1HB GLN 4 2HB GLN 4 -5.437 -5.314 -0.964
42 2HB GLN 4 1HB GLN 4 -6.830 -4.473 -0.298
43 1HG GLN 4 2HG GLN 4 -7.086 -3.247 -2.399
44 2HG GLN 4 1HG GLN 4 -5.704 -4.113 -3.065
45 1HE2 GLN 4 1HE2 GLN 4 -7.223 -6.257 -1.112
46 2HE2 GLN 4 2HE2 GLN 4 -8.260 -7.020 -2.261
47 H TRP 5 H TRP 5 -3.196 -1.591 -0.345
48 HA TRP 5 HA TRP 5 -1.868 -2.003 -2.777
49 1HB TRP 5 2HB TRP 5 -0.023 -0.713 -1.750
50 2HB TRP 5 1HB TRP 5 -1.590 0.041 -1.489
51 HD1 TRP 5 HD TRP 5 -2.673 -1.107 1.080
52 HE1 TRP 5 1HE TRP 5 -1.445 -0.921 3.333
53 HE3 TRP 5 3HE TRP 5 2.073 -0.296 -0.644
54 HZ2 TRP 5 2HZ TRP 5 1.183 -0.484 4.257
55 HZ3 TRP 5 3HZ TRP 5 3.886 -0.003 0.994
56 HH2 TRP 5 HH TRP 5 3.448 -0.094 3.393
57 H ARG 6 H ARG 6 0.881 -2.150 -1.644
58 HA ARG 6 HA ARG 6 1.094 -4.854 -0.608
59 1HB ARG 6 2HB ARG 6 2.140 -4.068 -3.330
60 2HB ARG 6 1HB ARG 6 2.698 -5.487 -2.456
61 1HG ARG 6 2HG ARG 6 -0.170 -5.005 -3.230
62 2HG ARG 6 1HG ARG 6 0.974 -5.953 -4.183
63 1HD ARG 6 2HD ARG 6 0.135 -6.525 -1.342
64 2HD ARG 6 1HD ARG 6 -0.429 -7.382 -2.776
65 HE ARG 6 HE ARG 6 2.366 -7.500 -2.721
66 1HH1 ARG 6 1HH1 ARG 6 -0.372 -8.695 -0.928
67 2HH1 ARG 6 2HH1 ARG 6 0.441 -10.126 -0.391
68 1HH2 ARG 6 1HH2 ARG 6 3.445 -9.381 -2.019
69 2HH2 ARG 6 2HH2 ARG 6 2.612 -10.516 -1.011
70 H MET 7 H MET 7 3.115 -2.392 -2.230
71 HA MET 7 HA MET 7 4.513 -1.642 0.086
72 1HB MET 7 2HB MET 7 6.705 -2.675 -0.394
73 2HB MET 7 1HB MET 7 5.477 -3.864 0.014
74 1HG MET 7 2HG MET 7 5.187 -4.357 -2.372
75 2HG MET 7 1HG MET 7 6.457 -3.195 -2.753
76 1HE MET 7 1HE MET 7 8.412 -3.244 -0.935
77 2HE MET 7 2HE MET 7 9.459 -4.130 -2.044
78 3HE MET 7 3HE MET 7 9.214 -4.722 -0.402
79 H LYS 8 H LYS 8 3.306 -0.521 -2.301
80 HA LYS 8 HA LYS 8 5.496 0.538 -3.878
81 1HB LYS 8 2HB LYS 8 3.750 1.747 -5.108
82 2HB LYS 8 1HB LYS 8 3.372 0.035 -4.983
83 1HG LYS 8 2HG LYS 8 1.777 0.477 -3.223
84 2HG LYS 8 1HG LYS 8 2.209 2.187 -3.227
85 1HD LYS 8 2HD LYS 8 0.992 0.681 -5.543
86 2HD LYS 8 1HD LYS 8 0.119 1.755 -4.448
87 1HE LYS 8 2HE LYS 8 2.389 2.537 -6.277
88 2HE LYS 8 1HE LYS 8 0.681 2.898 -6.528
89 1HZ LYS 8 1HZ LYS 8 1.627 4.824 -5.606
90 2HZ LYS 8 2HZ LYS 8 2.479 3.961 -4.427
91 3HZ LYS 8 3HZ LYS 8 0.795 4.095 -4.325
92 H LYS 9 H LYS 9 3.240 1.615 -1.408
93 HA LYS 9 HA LYS 9 3.804 4.345 -1.410
94 1HB LYS 9 2HB LYS 9 3.090 2.596 0.952
95 2HB LYS 9 1HB LYS 9 2.942 4.348 0.888
96 1HG LYS 9 2HG LYS 9 1.256 4.183 -0.833
97 2HG LYS 9 1HG LYS 9 1.454 2.430 -0.895
98 1HD LYS 9 2HD LYS 9 -0.513 2.984 0.400
99 2HD LYS 9 1HD LYS 9 0.721 2.298 1.460
100 1HE LYS 9 2HE LYS 9 -0.354 4.221 2.500
101 2HE LYS 9 1HE LYS 9 1.351 4.545 2.186
102 1HZ LYS 9 1HZ LYS 9 0.397 6.452 1.409
103 2HZ LYS 9 2HZ LYS 9 -1.025 5.690 0.902
104 3HZ LYS 9 3HZ LYS 9 0.387 5.538 -0.015
105 H LEU 10 H LEU 10 5.421 1.665 0.210
106 HA LEU 10 HA LEU 10 7.172 3.130 1.823
107 1HB LEU 10 2HB LEU 10 6.847 0.732 2.081
108 2HB LEU 10 1HB LEU 10 7.563 0.441 0.508
109 HG LEU 10 HG LEU 10 9.721 1.309 1.352
110 1HD1 LEU 10 1HD1 LEU 10 9.780 2.536 3.193
111 2HD1 LEU 10 2HD1 LEU 10 9.329 1.112 4.130
112 3HD1 LEU 10 3HD1 LEU 10 8.080 2.193 3.513
113 1HD2 LEU 10 1HD2 LEU 10 9.110 -0.737 3.358
114 2HD2 LEU 10 2HD2 LEU 10 10.305 -0.737 2.061
115 3HD2 LEU 10 3HD2 LEU 10 8.626 -1.154 1.715
116 H GLY 11 H GLY 11 7.565 1.954 -1.506
117 1HA GLY 11 2HA GLY 11 10.212 2.854 -1.865
118 2HA GLY 11 1HA GLY 11 9.060 2.529 -3.152
Start of MODEL 10
1 1H ARG 1 1HT ARG 1 -5.389 3.942 6.165
2 2H ARG 1 2HT ARG 1 -4.456 2.646 6.720
3 3H ARG 1 3HT ARG 1 -6.144 2.532 6.720
4 HA ARG 1 HA ARG 1 -4.588 2.920 4.237
5 1HB ARG 1 2HB ARG 1 -5.490 0.329 5.514
6 2HB ARG 1 1HB ARG 1 -4.774 0.478 3.916
7 1HG ARG 1 2HG ARG 1 -2.697 1.255 4.891
8 2HG ARG 1 1HG ARG 1 -3.413 1.195 6.503
9 1HD ARG 1 2HD ARG 1 -3.003 -1.154 4.654
10 2HD ARG 1 1HD ARG 1 -2.023 -0.770 6.070
11 HE ARG 1 HE ARG 1 -4.680 -0.977 6.896
12 1HH1 ARG 1 1HH1 ARG 1 -2.168 -3.005 5.584
13 2HH1 ARG 1 2HH1 ARG 1 -2.752 -4.444 6.350
14 1HH2 ARG 1 1HH2 ARG 1 -5.456 -2.864 7.909
15 2HH2 ARG 1 2HH2 ARG 1 -4.623 -4.364 7.672
16 H ARG 2 H ARG 2 -5.911 3.337 2.576
17 HA ARG 2 HA ARG 2 -8.774 2.830 2.941
18 1HB ARG 2 2HB ARG 2 -8.969 4.504 0.996
19 2HB ARG 2 1HB ARG 2 -8.563 5.112 2.593
20 1HG ARG 2 2HG ARG 2 -7.229 6.169 0.847
21 2HG ARG 2 1HG ARG 2 -6.224 5.258 1.975
22 1HD ARG 2 2HD ARG 2 -6.046 3.435 0.402
23 2HD ARG 2 1HD ARG 2 -7.160 4.238 -0.702
24 HE ARG 2 HE ARG 2 -5.369 5.332 -1.527
25 1HH1 ARG 2 1HH1 ARG 2 -4.677 4.560 1.797
26 2HH1 ARG 2 2HH1 ARG 2 -3.100 5.276 1.769
27 1HH2 ARG 2 1HH2 ARG 2 -3.294 6.275 -1.576
28 2HH2 ARG 2 2HH2 ARG 2 -2.314 6.252 -0.147
29 H TRP 3 H TRP 3 -6.890 0.802 2.084
30 HA TRP 3 HA TRP 3 -8.381 -0.352 0.011
31 1HB TRP 3 2HB TRP 3 -6.628 -0.356 -1.784
32 2HB TRP 3 1HB TRP 3 -7.360 1.215 -1.495
33 HD1 TRP 3 HD TRP 3 -4.892 0.650 1.172
34 HE1 TRP 3 1HE TRP 3 -2.669 1.817 0.613
35 HE3 TRP 3 3HE TRP 3 -5.728 1.668 -3.767
36 HZ2 TRP 3 2HZ TRP 3 -1.442 2.991 -1.620
37 HZ3 TRP 3 3HZ TRP 3 -3.967 2.816 -5.046
38 HH2 TRP 3 HH TRP 3 -1.863 3.467 -3.992
39 H GLN 4 H GLN 4 -5.780 -1.598 -1.092
40 HA GLN 4 HA GLN 4 -4.874 -3.124 1.217
41 1HB GLN 4 2HB GLN 4 -6.092 -4.453 -1.211
42 2HB GLN 4 1HB GLN 4 -5.366 -5.274 0.165
43 1HG GLN 4 2HG GLN 4 -7.097 -4.339 1.618
44 2HG GLN 4 1HG GLN 4 -7.834 -3.559 0.223
45 1HE2 GLN 4 1HE2 GLN 4 -8.113 -6.103 2.214
46 2HE2 GLN 4 2HE2 GLN 4 -8.907 -7.230 1.173
47 H TRP 5 H TRP 5 -3.184 -1.496 0.223
48 HA TRP 5 HA TRP 5 -1.808 -2.188 -2.132
49 1HB TRP 5 2HB TRP 5 0.006 -0.753 -1.231
50 2HB TRP 5 1HB TRP 5 -1.577 0.012 -1.147
51 HD1 TRP 5 HD TRP 5 -2.795 -0.435 1.460
52 HE1 TRP 5 1HE TRP 5 -1.649 -0.024 3.730
53 HE3 TRP 5 3HE TRP 5 2.093 -0.613 -0.042
54 HZ2 TRP 5 2HZ TRP 5 0.973 0.199 4.747
55 HZ3 TRP 5 3HZ TRP 5 3.857 -0.288 1.642
56 HH2 TRP 5 HH TRP 5 3.306 0.111 3.987
57 H ARG 6 H ARG 6 0.908 -2.127 -0.717
58 HA ARG 6 HA ARG 6 1.145 -4.566 0.719
59 1HB ARG 6 2HB ARG 6 2.444 -5.806 -1.024
60 2HB ARG 6 1HB ARG 6 0.731 -5.639 -1.379
61 1HG ARG 6 2HG ARG 6 1.209 -3.828 -2.927
62 2HG ARG 6 1HG ARG 6 2.928 -3.943 -2.548
63 1HD ARG 6 2HD ARG 6 1.250 -6.131 -3.772
64 2HD ARG 6 1HD ARG 6 2.360 -5.082 -4.652
65 HE ARG 6 HE ARG 6 3.773 -6.325 -2.582
66 1HH1 ARG 6 1HH1 ARG 6 2.175 -7.146 -5.567
67 2HH1 ARG 6 2HH1 ARG 6 3.203 -8.501 -5.894
68 1HH2 ARG 6 1HH2 ARG 6 5.133 -8.108 -3.007
69 2HH2 ARG 6 2HH2 ARG 6 4.885 -9.046 -4.441
70 H MET 7 H MET 7 2.936 -2.482 -1.559
71 HA MET 7 HA MET 7 4.706 -1.525 0.418
72 1HB MET 7 2HB MET 7 6.787 -2.612 -0.326
73 2HB MET 7 1HB MET 7 5.646 -3.768 0.350
74 1HG MET 7 2HG MET 7 4.998 -4.449 -1.902
75 2HG MET 7 1HG MET 7 6.134 -3.286 -2.582
76 1HE MET 7 1HE MET 7 8.366 -3.111 -1.265
77 2HE MET 7 2HE MET 7 9.319 -4.181 -2.293
78 3HE MET 7 3HE MET 7 9.237 -4.470 -0.554
79 H LYS 8 H LYS 8 3.098 -0.554 -1.751
80 HA LYS 8 HA LYS 8 4.899 0.302 -3.839
81 1HB LYS 8 2HB LYS 8 2.542 -0.148 -4.351
82 2HB LYS 8 1HB LYS 8 2.048 1.108 -3.225
83 1HG LYS 8 2HG LYS 8 3.120 2.796 -4.613
84 2HG LYS 8 1HG LYS 8 3.655 1.541 -5.734
85 1HD LYS 8 2HD LYS 8 1.318 0.966 -6.197
86 2HD LYS 8 1HD LYS 8 0.788 2.224 -5.079
87 1HE LYS 8 2HE LYS 8 0.659 3.001 -7.382
88 2HE LYS 8 1HE LYS 8 1.863 3.918 -6.477
89 1HZ LYS 8 1HZ LYS 8 2.486 1.638 -8.276
90 2HZ LYS 8 2HZ LYS 8 3.604 2.631 -7.485
91 3HZ LYS 8 3HZ LYS 8 2.623 3.269 -8.708
92 H LYS 9 H LYS 9 3.369 1.629 -0.976
93 HA LYS 9 HA LYS 9 4.104 4.322 -1.323
94 1HB LYS 9 2HB LYS 9 3.752 2.869 1.302
95 2HB LYS 9 1HB LYS 9 3.586 4.596 1.018
96 1HG LYS 9 2HG LYS 9 1.635 4.177 -0.395
97 2HG LYS 9 1HG LYS 9 1.801 2.445 -0.099
98 1HD LYS 9 2HD LYS 9 1.512 2.873 2.322
99 2HD LYS 9 1HD LYS 9 1.239 4.579 1.958
100 1HE LYS 9 2HE LYS 9 -0.430 2.260 0.995
101 2HE LYS 9 1HE LYS 9 -0.873 3.407 2.259
102 1HZ LYS 9 1HZ LYS 9 -0.455 4.019 -0.616
103 2HZ LYS 9 2HZ LYS 9 -0.748 5.182 0.576
104 3HZ LYS 9 3HZ LYS 9 -1.930 4.026 0.214
105 H LEU 10 H LEU 10 5.677 1.659 0.394
106 HA LEU 10 HA LEU 10 7.852 3.104 1.424
107 1HB LEU 10 2HB LEU 10 7.989 0.222 0.571
108 2HB LEU 10 1HB LEU 10 8.858 1.008 1.877
109 HG LEU 10 HG LEU 10 5.908 0.387 1.812
110 1HD1 LEU 10 1HD1 LEU 10 7.867 -1.366 2.282
111 2HD1 LEU 10 2HD1 LEU 10 6.315 -1.414 3.117
112 3HD1 LEU 10 3HD1 LEU 10 7.713 -0.674 3.896
113 1HD2 LEU 10 1HD2 LEU 10 7.456 2.248 3.429
114 2HD2 LEU 10 2HD2 LEU 10 6.579 1.062 4.395
115 3HD2 LEU 10 3HD2 LEU 10 5.710 2.084 3.249
116 H GLY 11 H GLY 11 7.518 1.214 -1.557
117 1HA GLY 11 2HA GLY 11 10.132 1.583 -2.509
118 2HA GLY 11 1HA GLY 11 8.731 1.194 -3.494
Start of MODEL 11
1 1H ARG 1 1HT ARG 1 -7.627 -0.582 5.539
2 2H ARG 1 2HT ARG 1 -9.064 0.287 5.734
3 3H ARG 1 3HT ARG 1 -8.115 -0.088 7.082
4 HA ARG 1 HA ARG 1 -7.586 2.100 6.737
5 1HB ARG 1 2HB ARG 1 -5.588 0.552 5.063
6 2HB ARG 1 1HB ARG 1 -5.294 2.085 5.869
7 1HG ARG 1 2HG ARG 1 -4.280 0.472 7.216
8 2HG ARG 1 1HG ARG 1 -5.781 0.889 8.042
9 1HD ARG 1 2HD ARG 1 -6.842 -1.114 7.116
10 2HD ARG 1 1HD ARG 1 -5.342 -1.526 6.287
11 HE ARG 1 HE ARG 1 -5.982 -2.124 8.957
12 1HH1 ARG 1 1HH1 ARG 1 -3.316 -0.979 7.022
13 2HH1 ARG 1 2HH1 ARG 1 -2.106 -1.589 8.101
14 1HH2 ARG 1 1HH2 ARG 1 -4.397 -2.927 10.379
15 2HH2 ARG 1 2HH2 ARG 1 -2.721 -2.697 10.008
16 H ARG 2 H ARG 2 -5.851 2.566 4.137
17 HA ARG 2 HA ARG 2 -7.890 4.005 2.751
18 1HB ARG 2 2HB ARG 2 -5.439 4.660 2.996
19 2HB ARG 2 1HB ARG 2 -5.088 3.449 1.775
20 1HG ARG 2 2HG ARG 2 -6.997 5.724 1.313
21 2HG ARG 2 1HG ARG 2 -5.271 5.831 0.974
22 1HD ARG 2 2HD ARG 2 -5.472 3.928 -0.569
23 2HD ARG 2 1HD ARG 2 -7.203 3.858 -0.242
24 HE ARG 2 HE ARG 2 -5.931 5.548 -2.092
25 1HH1 ARG 2 1HH1 ARG 2 -8.433 5.629 0.337
26 2HH1 ARG 2 2HH1 ARG 2 -9.309 6.914 -0.428
27 1HH2 ARG 2 1HH2 ARG 2 -7.078 7.237 -3.100
28 2HH2 ARG 2 2HH2 ARG 2 -8.539 7.826 -2.380
29 H TRP 3 H TRP 3 -6.022 1.068 2.123
30 HA TRP 3 HA TRP 3 -8.087 -0.027 0.492
31 1HB TRP 3 2HB TRP 3 -6.683 -0.221 -1.589
32 2HB TRP 3 1HB TRP 3 -7.230 1.409 -1.226
33 HD1 TRP 3 HD TRP 3 -4.404 0.729 1.009
34 HE1 TRP 3 1HE TRP 3 -2.223 1.690 0.044
35 HE3 TRP 3 3HE TRP 3 -5.959 1.629 -3.777
36 HZ2 TRP 3 2HZ TRP 3 -1.293 2.674 -2.413
37 HZ3 TRP 3 3HZ TRP 3 -4.349 2.578 -5.377
38 HH2 TRP 3 HH TRP 3 -2.059 3.095 -4.706
39 H GLN 4 H GLN 4 -5.815 -1.489 -1.038
40 HA GLN 4 HA GLN 4 -4.857 -3.185 1.155
41 1HB GLN 4 2HB GLN 4 -6.113 -4.205 -1.400
42 2HB GLN 4 1HB GLN 4 -5.431 -5.196 -0.116
43 1HG GLN 4 2HG GLN 4 -7.128 -4.386 1.426
44 2HG GLN 4 1HG GLN 4 -7.802 -3.366 0.159
45 1HE2 GLN 4 1HE2 GLN 4 -8.207 -6.182 1.752
46 2HE2 GLN 4 2HE2 GLN 4 -9.090 -7.076 0.567
47 H TRP 5 H TRP 5 -3.183 -1.421 0.199
48 HA TRP 5 HA TRP 5 -1.764 -2.047 -2.151
49 1HB TRP 5 2HB TRP 5 -0.023 -0.575 -1.233
50 2HB TRP 5 1HB TRP 5 -1.622 0.131 -1.023
51 HD1 TRP 5 HD TRP 5 -2.706 -0.461 1.589
52 HE1 TRP 5 1HE TRP 5 -1.467 -0.231 3.835
53 HE3 TRP 5 3HE TRP 5 2.110 -0.551 -0.125
54 HZ2 TRP 5 2HZ TRP 5 1.201 -0.104 4.754
55 HZ3 TRP 5 3HZ TRP 5 3.946 -0.369 1.502
56 HH2 TRP 5 HH TRP 5 3.499 -0.148 3.890
57 H ARG 6 H ARG 6 0.928 -1.998 -0.820
58 HA ARG 6 HA ARG 6 1.255 -4.347 0.712
59 1HB ARG 6 2HB ARG 6 2.467 -5.699 -1.003
60 2HB ARG 6 1HB ARG 6 0.736 -5.572 -1.274
61 1HG ARG 6 2HG ARG 6 1.103 -3.910 -2.998
62 2HG ARG 6 1HG ARG 6 2.841 -3.946 -2.688
63 1HD ARG 6 2HD ARG 6 2.908 -6.301 -3.342
64 2HD ARG 6 1HD ARG 6 1.172 -6.271 -3.644
65 HE ARG 6 HE ARG 6 2.337 -4.261 -5.184
66 1HH1 ARG 6 1HH1 ARG 6 2.368 -7.740 -4.955
67 2HH1 ARG 6 2HH1 ARG 6 2.678 -7.976 -6.643
68 1HH2 ARG 6 1HH2 ARG 6 2.744 -4.564 -7.408
69 2HH2 ARG 6 2HH2 ARG 6 2.893 -6.171 -8.037
70 H MET 7 H MET 7 2.876 -2.376 -1.774
71 HA MET 7 HA MET 7 4.740 -1.282 0.027
72 1HB MET 7 2HB MET 7 6.795 -2.403 -0.721
73 2HB MET 7 1HB MET 7 5.693 -3.527 0.061
74 1HG MET 7 2HG MET 7 4.985 -4.376 -2.094
75 2HG MET 7 1HG MET 7 6.022 -3.210 -2.914
76 1HE MET 7 1HE MET 7 7.978 -5.656 -4.130
77 2HE MET 7 2HE MET 7 6.229 -5.446 -4.041
78 3HE MET 7 3HE MET 7 6.980 -6.888 -3.358
79 H LYS 8 H LYS 8 3.073 -0.285 -1.998
80 HA LYS 8 HA LYS 8 4.803 0.346 -4.253
81 1HB LYS 8 2HB LYS 8 1.937 1.100 -3.665
82 2HB LYS 8 1HB LYS 8 2.805 1.558 -5.124
83 1HG LYS 8 2HG LYS 8 2.212 -1.261 -4.244
84 2HG LYS 8 1HG LYS 8 1.356 -0.366 -5.500
85 1HD LYS 8 2HD LYS 8 4.291 -1.075 -5.545
86 2HD LYS 8 1HD LYS 8 3.022 -1.919 -6.434
87 1HE LYS 8 2HE LYS 8 2.522 0.123 -7.675
88 2HE LYS 8 1HE LYS 8 3.764 0.987 -6.770
89 1HZ LYS 8 1HZ LYS 8 5.455 -0.286 -7.770
90 2HZ LYS 8 2HZ LYS 8 4.425 0.161 -9.034
91 3HZ LYS 8 3HZ LYS 8 4.361 -1.409 -8.408
92 H LYS 9 H LYS 9 3.090 2.044 -1.651
93 HA LYS 9 HA LYS 9 4.111 4.608 -2.326
94 1HB LYS 9 2HB LYS 9 3.243 5.336 -0.169
95 2HB LYS 9 1HB LYS 9 2.065 4.332 -1.000
96 1HG LYS 9 2HG LYS 9 2.620 2.449 0.408
97 2HG LYS 9 1HG LYS 9 3.896 3.384 1.194
98 1HD LYS 9 2HD LYS 9 2.191 4.986 1.984
99 2HD LYS 9 1HD LYS 9 0.938 3.975 1.261
100 1HE LYS 9 2HE LYS 9 1.147 3.557 3.659
101 2HE LYS 9 1HE LYS 9 1.569 2.128 2.717
102 1HZ LYS 9 1HZ LYS 9 3.104 3.392 4.649
103 2HZ LYS 9 2HZ LYS 9 3.875 3.695 3.174
104 3HZ LYS 9 3HZ LYS 9 3.564 2.103 3.652
105 H LEU 10 H LEU 10 5.193 2.049 -0.177
106 HA LEU 10 HA LEU 10 7.125 3.403 1.285
107 1HB LEU 10 2HB LEU 10 6.448 1.117 1.780
108 2HB LEU 10 1HB LEU 10 7.158 0.557 0.278
109 HG LEU 10 HG LEU 10 9.395 1.201 1.120
110 1HD1 LEU 10 1HD1 LEU 10 9.084 1.385 3.846
111 2HD1 LEU 10 2HD1 LEU 10 7.783 2.399 3.222
112 3HD1 LEU 10 3HD1 LEU 10 9.452 2.717 2.751
113 1HD2 LEU 10 1HD2 LEU 10 9.125 -0.491 3.222
114 2HD2 LEU 10 2HD2 LEU 10 9.254 -1.000 1.538
115 3HD2 LEU 10 3HD2 LEU 10 7.669 -0.859 2.297
116 H GLY 11 H GLY 11 9.107 4.176 0.879
117 1HA GLY 11 2HA GLY 11 10.888 3.235 -1.073
118 2HA GLY 11 1HA GLY 11 9.992 4.582 -1.761
Start of MODEL 12
1 1H ARG 1 1HT ARG 1 -6.341 1.525 8.184
2 2H ARG 1 2HT ARG 1 -7.295 0.355 7.422
3 3H ARG 1 3HT ARG 1 -7.613 1.996 7.173
4 HA ARG 1 HA ARG 1 -5.041 1.835 6.424
5 1HB ARG 1 2HB ARG 1 -6.467 -0.694 5.572
6 2HB ARG 1 1HB ARG 1 -4.912 -0.154 4.956
7 1HG ARG 1 2HG ARG 1 -3.968 -0.338 7.212
8 2HG ARG 1 1HG ARG 1 -5.526 -0.919 7.802
9 1HD ARG 1 2HD ARG 1 -5.378 -2.826 6.258
10 2HD ARG 1 1HD ARG 1 -3.803 -2.250 5.714
11 HE ARG 1 HE ARG 1 -4.303 -3.811 7.998
12 1HH1 ARG 1 1HH1 ARG 1 -2.390 -1.082 6.969
13 2HH1 ARG 1 2HH1 ARG 1 -1.144 -1.353 8.142
14 1HH2 ARG 1 1HH2 ARG 1 -2.665 -4.172 9.538
15 2HH2 ARG 1 2HH2 ARG 1 -1.299 -3.108 9.599
16 H ARG 2 H ARG 2 -4.823 2.819 4.467
17 HA ARG 2 HA ARG 2 -6.954 4.178 3.335
18 1HB ARG 2 2HB ARG 2 -4.646 4.866 2.999
19 2HB ARG 2 1HB ARG 2 -4.314 3.403 2.080
20 1HG ARG 2 2HG ARG 2 -5.916 4.143 0.365
21 2HG ARG 2 1HG ARG 2 -6.171 5.633 1.276
22 1HD ARG 2 2HD ARG 2 -3.832 6.226 1.009
23 2HD ARG 2 1HD ARG 2 -3.521 4.704 0.175
24 HE ARG 2 HE ARG 2 -5.543 6.053 -1.202
25 1HH1 ARG 2 1HH1 ARG 2 -2.154 6.413 -0.473
26 2HH1 ARG 2 2HH1 ARG 2 -1.801 7.282 -1.930
27 1HH2 ARG 2 1HH2 ARG 2 -5.086 7.195 -3.124
28 2HH2 ARG 2 2HH2 ARG 2 -3.468 7.727 -3.436
29 H TRP 3 H TRP 3 -5.537 1.081 2.421
30 HA TRP 3 HA TRP 3 -7.936 0.162 1.232
31 1HB TRP 3 2HB TRP 3 -7.040 -0.082 -1.106
32 2HB TRP 3 1HB TRP 3 -7.391 1.572 -0.628
33 HD1 TRP 3 HD TRP 3 -4.210 0.833 0.962
34 HE1 TRP 3 1HE TRP 3 -2.233 1.619 -0.482
35 HE3 TRP 3 3HE TRP 3 -6.672 1.562 -3.456
36 HZ2 TRP 3 2HZ TRP 3 -1.785 2.421 -3.135
37 HZ3 TRP 3 3HZ TRP 3 -5.387 2.335 -5.405
38 HH2 TRP 3 HH TRP 3 -2.988 2.759 -5.247
39 H GLN 4 H GLN 4 -6.038 -1.362 -0.756
40 HA GLN 4 HA GLN 4 -4.853 -3.189 1.213
41 1HB GLN 4 2HB GLN 4 -6.499 -4.020 -1.186
42 2HB GLN 4 1HB GLN 4 -5.668 -5.111 -0.086
43 1HG GLN 4 2HG GLN 4 -7.081 -4.320 1.750
44 2HG GLN 4 1HG GLN 4 -7.925 -3.255 0.631
45 1HE2 GLN 4 1HE2 GLN 4 -7.158 -5.959 -1.076
46 2HE2 GLN 4 2HE2 GLN 4 -8.614 -6.860 -0.855
47 H TRP 5 H TRP 5 -3.226 -1.463 0.146
48 HA TRP 5 HA TRP 5 -2.170 -2.022 -2.403
49 1HB TRP 5 2HB TRP 5 -0.209 -0.713 -1.633
50 2HB TRP 5 1HB TRP 5 -1.735 0.092 -1.294
51 HD1 TRP 5 HD TRP 5 -2.634 -0.508 1.410
52 HE1 TRP 5 1HE TRP 5 -1.200 -0.321 3.538
53 HE3 TRP 5 3HE TRP 5 2.008 -0.732 -0.714
54 HZ2 TRP 5 2HZ TRP 5 1.538 -0.269 4.226
55 HZ3 TRP 5 3HZ TRP 5 3.983 -0.602 0.744
56 HH2 TRP 5 HH TRP 5 3.753 -0.375 3.164
57 H ARG 6 H ARG 6 0.689 -2.157 -1.325
58 HA ARG 6 HA ARG 6 0.920 -4.762 -0.161
59 1HB ARG 6 2HB ARG 6 2.246 -5.628 -2.189
60 2HB ARG 6 1HB ARG 6 0.490 -5.644 -2.278
61 1HG ARG 6 2HG ARG 6 0.534 -3.583 -3.588
62 2HG ARG 6 1HG ARG 6 2.297 -3.566 -3.497
63 1HD ARG 6 2HD ARG 6 0.620 -5.735 -4.753
64 2HD ARG 6 1HD ARG 6 1.493 -4.478 -5.628
65 HE ARG 6 HE ARG 6 2.572 -6.887 -4.614
66 1HH1 ARG 6 1HH1 ARG 6 3.335 -3.519 -5.071
67 2HH1 ARG 6 2HH1 ARG 6 5.045 -3.785 -5.147
68 1HH2 ARG 6 1HH2 ARG 6 4.823 -7.245 -4.716
69 2HH2 ARG 6 2HH2 ARG 6 5.890 -5.900 -4.947
70 H MET 7 H MET 7 2.913 -2.792 -2.397
71 HA MET 7 HA MET 7 4.690 -2.023 -0.262
72 1HB MET 7 2HB MET 7 5.655 -3.883 -2.444
73 2HB MET 7 1HB MET 7 6.718 -2.979 -1.378
74 1HG MET 7 2HG MET 7 5.813 -4.168 0.546
75 2HG MET 7 1HG MET 7 4.730 -5.065 -0.514
76 1HE MET 7 1HE MET 7 7.526 -7.509 0.880
77 2HE MET 7 2HE MET 7 5.860 -7.657 0.316
78 3HE MET 7 3HE MET 7 6.286 -6.414 1.492
79 H LYS 8 H LYS 8 2.998 -0.839 -2.412
80 HA LYS 8 HA LYS 8 4.955 0.440 -4.147
81 1HB LYS 8 2HB LYS 8 1.950 0.748 -4.012
82 2HB LYS 8 1HB LYS 8 2.994 1.480 -5.223
83 1HG LYS 8 2HG LYS 8 3.658 -0.749 -5.989
84 2HG LYS 8 1HG LYS 8 2.587 -1.471 -4.790
85 1HD LYS 8 2HD LYS 8 1.418 -1.493 -6.857
86 2HD LYS 8 1HD LYS 8 0.695 -0.219 -5.877
87 1HE LYS 8 2HE LYS 8 2.791 0.235 -7.998
88 2HE LYS 8 1HE LYS 8 1.057 0.412 -8.258
89 1HZ LYS 8 1HZ LYS 8 2.907 2.135 -6.802
90 2HZ LYS 8 2HZ LYS 8 1.352 1.979 -6.158
91 3HZ LYS 8 3HZ LYS 8 1.557 2.543 -7.739
92 H LYS 9 H LYS 9 2.645 1.299 -1.609
93 HA LYS 9 HA LYS 9 3.069 4.068 -1.622
94 1HB LYS 9 2HB LYS 9 2.259 2.238 0.643
95 2HB LYS 9 1HB LYS 9 2.195 3.992 0.719
96 1HG LYS 9 2HG LYS 9 0.581 4.029 -1.101
97 2HG LYS 9 1HG LYS 9 0.664 2.271 -1.223
98 1HD LYS 9 2HD LYS 9 -1.309 2.955 0.032
99 2HD LYS 9 1HD LYS 9 -0.184 2.079 1.070
100 1HE LYS 9 2HE LYS 9 -1.102 4.029 2.215
101 2HE LYS 9 1HE LYS 9 0.637 4.194 1.974
102 1HZ LYS 9 1HZ LYS 9 0.067 5.528 -0.059
103 2HZ LYS 9 2HZ LYS 9 -0.326 6.257 1.417
104 3HZ LYS 9 3HZ LYS 9 -1.537 5.541 0.479
105 H LEU 10 H LEU 10 4.749 1.471 0.071
106 HA LEU 10 HA LEU 10 6.328 2.982 1.791
107 1HB LEU 10 2HB LEU 10 6.154 0.533 1.874
108 2HB LEU 10 1HB LEU 10 7.049 0.417 0.370
109 HG LEU 10 HG LEU 10 9.017 1.423 1.491
110 1HD1 LEU 10 1HD1 LEU 10 7.842 2.682 3.219
111 2HD1 LEU 10 2HD1 LEU 10 9.047 1.604 3.923
112 3HD1 LEU 10 3HD1 LEU 10 7.338 1.175 3.983
113 1HD2 LEU 10 1HD2 LEU 10 8.409 -1.100 1.401
114 2HD2 LEU 10 2HD2 LEU 10 8.153 -0.918 3.136
115 3HD2 LEU 10 3HD2 LEU 10 9.732 -0.560 2.435
116 H GLY 11 H GLY 11 8.074 4.244 1.555
117 1HA GLY 11 2HA GLY 11 10.026 4.021 -0.441
118 2HA GLY 11 1HA GLY 11 8.841 5.201 -0.980
Start of MODEL 13
1 1H ARG 1 1HT ARG 1 -3.022 4.361 5.994
2 2H ARG 1 2HT ARG 1 -3.772 3.492 7.236
3 3H ARG 1 3HT ARG 1 -4.642 4.663 6.380
4 HA ARG 1 HA ARG 1 -3.664 2.917 4.481
5 1HB ARG 1 2HB ARG 1 -3.252 1.354 6.333
6 2HB ARG 1 1HB ARG 1 -4.931 1.501 6.837
7 1HG ARG 1 2HG ARG 1 -5.668 0.491 4.759
8 2HG ARG 1 1HG ARG 1 -4.000 0.399 4.192
9 1HD ARG 1 2HD ARG 1 -3.450 -1.099 6.040
10 2HD ARG 1 1HD ARG 1 -5.110 -0.997 6.626
11 HE ARG 1 HE ARG 1 -5.176 -1.859 3.969
12 1HH1 ARG 1 1HH1 ARG 1 -4.092 -2.992 7.082
13 2HH1 ARG 1 2HH1 ARG 1 -4.324 -4.666 6.696
14 1HH2 ARG 1 1HH2 ARG 1 -5.485 -4.057 3.454
15 2HH2 ARG 1 2HH2 ARG 1 -5.112 -5.270 4.634
16 H ARG 2 H ARG 2 -5.291 2.420 3.024
17 HA ARG 2 HA ARG 2 -8.065 2.740 3.681
18 1HB ARG 2 2HB ARG 2 -8.246 4.581 1.817
19 2HB ARG 2 1HB ARG 2 -7.873 5.024 3.476
20 1HG ARG 2 2HG ARG 2 -6.464 6.233 1.918
21 2HG ARG 2 1HG ARG 2 -5.500 5.148 2.918
22 1HD ARG 2 2HD ARG 2 -4.761 5.095 0.597
23 2HD ARG 2 1HD ARG 2 -5.411 3.533 1.091
24 HE ARG 2 HE ARG 2 -6.883 3.740 -0.625
25 1HH1 ARG 2 1HH1 ARG 2 -6.036 6.952 0.440
26 2HH1 ARG 2 2HH1 ARG 2 -7.046 7.741 -0.724
27 1HH2 ARG 2 1HH2 ARG 2 -8.209 4.775 -2.162
28 2HH2 ARG 2 2HH2 ARG 2 -8.276 6.506 -2.203
29 H TRP 3 H TRP 3 -6.440 0.687 2.559
30 HA TRP 3 HA TRP 3 -8.071 -0.148 0.441
31 1HB TRP 3 2HB TRP 3 -6.312 -0.151 -1.382
32 2HB TRP 3 1HB TRP 3 -6.995 1.419 -0.988
33 HD1 TRP 3 HD TRP 3 -4.514 0.546 1.598
34 HE1 TRP 3 1HE TRP 3 -2.271 1.712 1.118
35 HE3 TRP 3 3HE TRP 3 -5.400 2.051 -3.201
36 HZ2 TRP 3 2HZ TRP 3 -1.050 3.065 -1.018
37 HZ3 TRP 3 3HZ TRP 3 -3.631 3.269 -4.399
38 HH2 TRP 3 HH TRP 3 -1.498 3.771 -3.325
39 H GLN 4 H GLN 4 -5.264 -1.292 -0.671
40 HA GLN 4 HA GLN 4 -4.522 -3.125 1.400
41 1HB GLN 4 2HB GLN 4 -5.216 -5.161 0.110
42 2HB GLN 4 1HB GLN 4 -6.552 -4.236 0.783
43 1HG GLN 4 2HG GLN 4 -6.941 -3.206 -1.390
44 2HG GLN 4 1HG GLN 4 -5.600 -4.126 -2.067
45 1HE2 GLN 4 1HE2 GLN 4 -8.841 -4.014 -1.877
46 2HE2 GLN 4 2HE2 GLN 4 -9.223 -5.686 -2.085
47 H TRP 5 H TRP 5 -2.892 -1.450 0.229
48 HA TRP 5 HA TRP 5 -1.670 -2.193 -2.188
49 1HB TRP 5 2HB TRP 5 0.199 -0.774 -1.419
50 2HB TRP 5 1HB TRP 5 -1.359 0.003 -1.160
51 HD1 TRP 5 HD TRP 5 -2.331 -0.606 1.540
52 HE1 TRP 5 1HE TRP 5 -0.976 -0.268 3.706
53 HE3 TRP 5 3HE TRP 5 2.374 -0.585 -0.440
54 HZ2 TRP 5 2HZ TRP 5 1.736 -0.024 4.467
55 HZ3 TRP 5 3HZ TRP 5 4.295 -0.296 1.065
56 HH2 TRP 5 HH TRP 5 3.983 -0.022 3.466
57 H ARG 6 H ARG 6 1.116 -2.184 -1.008
58 HA ARG 6 HA ARG 6 1.400 -4.610 0.461
59 1HB ARG 6 2HB ARG 6 2.624 -5.873 -1.298
60 2HB ARG 6 1HB ARG 6 0.915 -5.661 -1.650
61 1HG ARG 6 2HG ARG 6 1.448 -3.858 -3.201
62 2HG ARG 6 1HG ARG 6 3.163 -4.045 -2.834
63 1HD ARG 6 2HD ARG 6 2.657 -5.176 -4.904
64 2HD ARG 6 1HD ARG 6 3.057 -6.365 -3.665
65 HE ARG 6 HE ARG 6 0.278 -6.008 -3.701
66 1HH1 ARG 6 1HH1 ARG 6 2.829 -7.320 -5.679
67 2HH1 ARG 6 2HH1 ARG 6 1.803 -8.470 -6.468
68 1HH2 ARG 6 1HH2 ARG 6 -1.084 -7.520 -4.741
69 2HH2 ARG 6 2HH2 ARG 6 -0.420 -8.583 -5.936
70 H MET 7 H MET 7 3.189 -2.643 -1.935
71 HA MET 7 HA MET 7 5.016 -1.721 0.085
72 1HB MET 7 2HB MET 7 6.028 -3.549 -2.104
73 2HB MET 7 1HB MET 7 7.056 -2.541 -1.098
74 1HG MET 7 2HG MET 7 6.282 -3.759 0.886
75 2HG MET 7 1HG MET 7 5.301 -4.793 -0.151
76 1HE MET 7 1HE MET 7 9.111 -3.931 0.916
77 2HE MET 7 2HE MET 7 8.756 -3.223 -0.660
78 3HE MET 7 3HE MET 7 9.883 -4.574 -0.533
79 H LYS 8 H LYS 8 3.148 -0.887 -2.205
80 HA LYS 8 HA LYS 8 4.879 0.513 -4.031
81 1HB LYS 8 2HB LYS 8 1.891 0.730 -3.600
82 2HB LYS 8 1HB LYS 8 2.783 1.475 -4.919
83 1HG LYS 8 2HG LYS 8 3.430 -0.741 -5.729
84 2HG LYS 8 1HG LYS 8 2.521 -1.482 -4.410
85 1HD LYS 8 2HD LYS 8 0.463 -0.459 -5.268
86 2HD LYS 8 1HD LYS 8 1.380 0.263 -6.592
87 1HE LYS 8 2HE LYS 8 1.074 -2.690 -6.059
88 2HE LYS 8 1HE LYS 8 0.220 -1.773 -7.300
89 1HZ LYS 8 1HZ LYS 8 1.991 -2.733 -8.425
90 2HZ LYS 8 2HZ LYS 8 3.088 -2.464 -7.165
91 3HZ LYS 8 3HZ LYS 8 2.554 -1.167 -8.110
92 H LYS 9 H LYS 9 2.960 1.248 -1.192
93 HA LYS 9 HA LYS 9 3.110 4.042 -1.243
94 1HB LYS 9 2HB LYS 9 1.621 2.839 0.270
95 2HB LYS 9 1HB LYS 9 3.002 2.173 1.131
96 1HG LYS 9 2HG LYS 9 3.648 4.467 1.789
97 2HG LYS 9 1HG LYS 9 2.183 5.068 1.010
98 1HD LYS 9 2HD LYS 9 2.254 3.073 3.276
99 2HD LYS 9 1HD LYS 9 1.922 4.798 3.451
100 1HE LYS 9 2HE LYS 9 0.292 2.847 1.825
101 2HE LYS 9 1HE LYS 9 -0.136 3.459 3.422
102 1HZ LYS 9 1HZ LYS 9 -0.213 4.812 0.833
103 2HZ LYS 9 2HZ LYS 9 0.183 5.747 2.187
104 3HZ LYS 9 3HZ LYS 9 -1.287 4.911 2.136
105 H LEU 10 H LEU 10 5.277 1.650 0.197
106 HA LEU 10 HA LEU 10 7.063 3.473 1.385
107 1HB LEU 10 2HB LEU 10 6.966 1.104 1.990
108 2HB LEU 10 1HB LEU 10 7.564 0.663 0.402
109 HG LEU 10 HG LEU 10 9.686 1.838 0.900
110 1HD1 LEU 10 1HD1 LEU 10 10.145 2.439 3.262
111 2HD1 LEU 10 2HD1 LEU 10 8.432 2.209 3.613
112 3HD1 LEU 10 3HD1 LEU 10 8.940 3.470 2.491
113 1HD2 LEU 10 1HD2 LEU 10 9.508 -0.556 1.272
114 2HD2 LEU 10 2HD2 LEU 10 8.881 -0.274 2.897
115 3HD2 LEU 10 3HD2 LEU 10 10.536 0.185 2.498
116 H GLY 11 H GLY 11 8.858 4.499 0.669
117 1HA GLY 11 2HA GLY 11 10.257 3.870 -1.705
118 2HA GLY 11 1HA GLY 11 9.117 5.167 -2.027
Start of MODEL 14
1 1H ARG 1 1HT ARG 1 -9.007 1.359 5.426
2 2H ARG 1 2HT ARG 1 -7.989 0.814 6.662
3 3H ARG 1 3HT ARG 1 -7.638 0.438 5.052
4 HA ARG 1 HA ARG 1 -7.449 3.055 6.398
5 1HB ARG 1 2HB ARG 1 -5.500 1.397 4.790
6 2HB ARG 1 1HB ARG 1 -5.140 2.942 5.546
7 1HG ARG 1 2HG ARG 1 -5.498 1.978 7.744
8 2HG ARG 1 1HG ARG 1 -5.930 0.432 7.008
9 1HD ARG 1 2HD ARG 1 -3.689 0.275 6.033
10 2HD ARG 1 1HD ARG 1 -3.260 1.817 6.771
11 HE ARG 1 HE ARG 1 -2.783 0.658 8.665
12 1HH1 ARG 1 1HH1 ARG 1 -5.181 -1.143 6.884
13 2HH1 ARG 1 2HH1 ARG 1 -5.239 -2.441 8.030
14 1HH2 ARG 1 1HH2 ARG 1 -2.854 -1.047 10.171
15 2HH2 ARG 1 2HH2 ARG 1 -3.916 -2.387 9.896
16 H ARG 2 H ARG 2 -7.442 1.426 3.281
17 HA ARG 2 HA ARG 2 -8.795 3.491 1.935
18 1HB ARG 2 2HB ARG 2 -6.949 4.253 0.443
19 2HB ARG 2 1HB ARG 2 -6.765 4.767 2.114
20 1HG ARG 2 2HG ARG 2 -5.174 2.916 2.473
21 2HG ARG 2 1HG ARG 2 -5.314 2.501 0.763
22 1HD ARG 2 2HD ARG 2 -4.328 5.123 1.884
23 2HD ARG 2 1HD ARG 2 -3.327 3.854 1.179
24 HE ARG 2 HE ARG 2 -5.261 4.610 -0.698
25 1HH1 ARG 2 1HH1 ARG 2 -2.443 5.912 0.884
26 2HH1 ARG 2 2HH1 ARG 2 -2.032 6.963 -0.431
27 1HH2 ARG 2 1HH2 ARG 2 -4.729 5.992 -2.431
28 2HH2 ARG 2 2HH2 ARG 2 -3.332 7.009 -2.314
29 H TRP 3 H TRP 3 -6.645 0.722 1.767
30 HA TRP 3 HA TRP 3 -8.366 -0.600 -0.085
31 1HB TRP 3 2HB TRP 3 -6.667 -0.905 -1.886
32 2HB TRP 3 1HB TRP 3 -7.237 0.748 -1.735
33 HD1 TRP 3 HD TRP 3 -4.724 0.028 0.908
34 HE1 TRP 3 1HE TRP 3 -2.457 1.051 0.253
35 HE3 TRP 3 3HE TRP 3 -5.700 1.103 -3.993
36 HZ2 TRP 3 2HZ TRP 3 -1.253 2.155 -2.032
37 HZ3 TRP 3 3HZ TRP 3 -3.926 2.134 -5.347
38 HH2 TRP 3 HH TRP 3 -1.743 2.652 -4.385
39 H GLN 4 H GLN 4 -5.669 -1.980 -1.001
40 HA GLN 4 HA GLN 4 -4.915 -3.376 1.417
41 1HB GLN 4 2HB GLN 4 -5.459 -5.606 0.460
42 2HB GLN 4 1HB GLN 4 -6.883 -4.637 0.810
43 1HG GLN 4 2HG GLN 4 -7.030 -4.028 -1.561
44 2HG GLN 4 1HG GLN 4 -5.632 -5.049 -1.896
45 1HE2 GLN 4 1HE2 GLN 4 -6.122 -6.954 -2.679
46 2HE2 GLN 4 2HE2 GLN 4 -7.555 -7.862 -2.351
47 H TRP 5 H TRP 5 -3.248 -1.847 0.208
48 HA TRP 5 HA TRP 5 -1.853 -2.708 -2.045
49 1HB TRP 5 2HB TRP 5 -0.015 -1.278 -1.189
50 2HB TRP 5 1HB TRP 5 -1.582 -0.479 -1.134
51 HD1 TRP 5 HD TRP 5 -2.817 -0.974 1.503
52 HE1 TRP 5 1HE TRP 5 -1.686 -0.465 3.759
53 HE3 TRP 5 3HE TRP 5 2.065 -0.932 -0.020
54 HZ2 TRP 5 2HZ TRP 5 0.925 -0.090 4.760
55 HZ3 TRP 5 3HZ TRP 5 3.817 -0.487 1.649
56 HH2 TRP 5 HH TRP 5 3.256 -0.075 3.989
57 H ARG 6 H ARG 6 0.852 -2.640 -0.703
58 HA ARG 6 HA ARG 6 1.093 -5.008 0.862
59 1HB ARG 6 2HB ARG 6 2.423 -6.287 -0.843
60 2HB ARG 6 1HB ARG 6 0.700 -6.186 -1.178
61 1HG ARG 6 2HG ARG 6 1.106 -4.430 -2.812
62 2HG ARG 6 1HG ARG 6 2.833 -4.484 -2.454
63 1HD ARG 6 2HD ARG 6 2.269 -5.732 -4.493
64 2HD ARG 6 1HD ARG 6 2.955 -6.771 -3.245
65 HE ARG 6 HE ARG 6 0.164 -6.824 -3.017
66 1HH1 ARG 6 1HH1 ARG 6 2.669 -7.855 -5.211
67 2HH1 ARG 6 2HH1 ARG 6 1.765 -9.206 -5.809
68 1HH2 ARG 6 1HH2 ARG 6 -1.030 -8.599 -3.797
69 2HH2 ARG 6 2HH2 ARG 6 -0.337 -9.630 -5.004
70 H MET 7 H MET 7 2.805 -2.938 -1.471
71 HA MET 7 HA MET 7 4.606 -1.979 0.498
72 1HB MET 7 2HB MET 7 6.691 -2.912 -0.451
73 2HB MET 7 1HB MET 7 5.661 -4.131 0.278
74 1HG MET 7 2HG MET 7 4.874 -4.799 -1.932
75 2HG MET 7 1HG MET 7 5.891 -3.562 -2.667
76 1HE MET 7 1HE MET 7 8.654 -4.006 -0.661
77 2HE MET 7 2HE MET 7 8.406 -3.416 -2.305
78 3HE MET 7 3HE MET 7 9.469 -4.793 -2.014
79 H LYS 8 H LYS 8 2.841 -1.201 -1.812
80 HA LYS 8 HA LYS 8 4.609 -0.005 -3.740
81 1HB LYS 8 2HB LYS 8 2.363 -0.659 -4.421
82 2HB LYS 8 1HB LYS 8 1.657 0.394 -3.203
83 1HG LYS 8 2HG LYS 8 1.494 1.394 -5.401
84 2HG LYS 8 1HG LYS 8 2.560 2.345 -4.365
85 1HD LYS 8 2HD LYS 8 4.508 1.313 -5.416
86 2HD LYS 8 1HD LYS 8 3.447 0.351 -6.449
87 1HE LYS 8 2HE LYS 8 2.554 2.399 -7.439
88 2HE LYS 8 1HE LYS 8 3.598 3.365 -6.396
89 1HZ LYS 8 1HZ LYS 8 4.453 3.034 -8.690
90 2HZ LYS 8 2HZ LYS 8 4.614 1.383 -8.359
91 3HZ LYS 8 3HZ LYS 8 5.518 2.512 -7.482
92 H LYS 9 H LYS 9 2.806 0.967 -0.903
93 HA LYS 9 HA LYS 9 3.714 3.721 -1.085
94 1HB LYS 9 2HB LYS 9 1.405 3.105 -0.311
95 2HB LYS 9 1HB LYS 9 2.131 2.384 1.118
96 1HG LYS 9 2HG LYS 9 3.033 4.561 1.764
97 2HG LYS 9 1HG LYS 9 2.304 5.286 0.330
98 1HD LYS 9 2HD LYS 9 0.892 5.709 2.239
99 2HD LYS 9 1HD LYS 9 0.078 4.579 1.155
100 1HE LYS 9 2HE LYS 9 -0.177 3.888 3.476
101 2HE LYS 9 1HE LYS 9 0.781 2.714 2.573
102 1HZ LYS 9 1HZ LYS 9 2.242 4.823 3.960
103 2HZ LYS 9 2HZ LYS 9 2.640 3.194 3.747
104 3HZ LYS 9 3HZ LYS 9 1.516 3.641 4.929
105 H LEU 10 H LEU 10 5.799 1.833 -0.877
106 HA LEU 10 HA LEU 10 6.698 1.584 1.816
107 1HB LEU 10 2HB LEU 10 8.892 0.969 0.682
108 2HB LEU 10 1HB LEU 10 7.505 -0.054 0.368
109 HG LEU 10 HG LEU 10 7.187 1.154 -1.806
110 1HD1 LEU 10 1HD1 LEU 10 8.226 3.135 -1.943
111 2HD1 LEU 10 2HD1 LEU 10 9.627 2.176 -2.419
112 3HD1 LEU 10 3HD1 LEU 10 9.443 2.695 -0.744
113 1HD2 LEU 10 1HD2 LEU 10 9.685 0.213 -2.519
114 2HD2 LEU 10 2HD2 LEU 10 8.191 -0.723 -2.451
115 3HD2 LEU 10 3HD2 LEU 10 9.286 -0.705 -1.067
116 H GLY 11 H GLY 11 6.061 4.318 1.098
117 1HA GLY 11 2HA GLY 11 8.226 5.635 2.310
118 2HA GLY 11 1HA GLY 11 8.326 5.881 0.573
Start of MODEL 15
1 1H ARG 1 1HT ARG 1 -8.167 1.376 6.815
2 2H ARG 1 2HT ARG 1 -6.976 1.121 7.988
3 3H ARG 1 3HT ARG 1 -7.591 -0.187 7.111
4 HA ARG 1 HA ARG 1 -5.501 1.646 6.441
5 1HB ARG 1 2HB ARG 1 -6.427 -0.964 5.221
6 2HB ARG 1 1HB ARG 1 -4.859 -0.208 4.978
7 1HG ARG 1 2HG ARG 1 -4.375 -0.489 7.371
8 2HG ARG 1 1HG ARG 1 -5.930 -1.298 7.574
9 1HD ARG 1 2HD ARG 1 -4.200 -2.959 7.378
10 2HD ARG 1 1HD ARG 1 -5.206 -3.003 5.931
11 HE ARG 1 HE ARG 1 -3.016 -1.309 5.470
12 1HH1 ARG 1 1HH1 ARG 1 -3.748 -4.688 5.916
13 2HH1 ARG 1 2HH1 ARG 1 -2.394 -5.236 4.985
14 1HH2 ARG 1 1HH2 ARG 1 -1.229 -2.022 4.247
15 2HH2 ARG 1 2HH2 ARG 1 -0.962 -3.721 4.037
16 H ARG 2 H ARG 2 -5.167 2.735 4.539
17 HA ARG 2 HA ARG 2 -7.287 3.914 3.221
18 1HB ARG 2 2HB ARG 2 -4.997 4.792 3.156
19 2HB ARG 2 1HB ARG 2 -4.493 3.430 2.165
20 1HG ARG 2 2HG ARG 2 -6.018 4.181 0.390
21 2HG ARG 2 1HG ARG 2 -6.462 5.571 1.382
22 1HD ARG 2 2HD ARG 2 -4.134 6.325 1.364
23 2HD ARG 2 1HD ARG 2 -3.690 4.936 0.374
24 HE ARG 2 HE ARG 2 -4.368 6.130 -1.435
25 1HH1 ARG 2 1HH1 ARG 2 -6.091 7.327 1.352
26 2HH1 ARG 2 2HH1 ARG 2 -6.940 8.545 0.460
27 1HH2 ARG 2 1HH2 ARG 2 -5.486 7.728 -2.612
28 2HH2 ARG 2 2HH2 ARG 2 -6.597 8.773 -1.792
29 H TRP 3 H TRP 3 -5.549 0.961 2.433
30 HA TRP 3 HA TRP 3 -7.718 -0.081 0.935
31 1HB TRP 3 2HB TRP 3 -6.481 -0.264 -1.257
32 2HB TRP 3 1HB TRP 3 -7.015 1.357 -0.842
33 HD1 TRP 3 HD TRP 3 -4.014 0.697 1.154
34 HE1 TRP 3 1HE TRP 3 -1.947 1.756 0.050
35 HE3 TRP 3 3HE TRP 3 -5.968 1.671 -3.466
36 HZ2 TRP 3 2HZ TRP 3 -1.247 2.844 -2.439
37 HZ3 TRP 3 3HZ TRP 3 -4.522 2.717 -5.157
38 HH2 TRP 3 HH TRP 3 -2.204 3.295 -4.653
39 H GLN 4 H GLN 4 -5.328 -1.395 -0.745
40 HA GLN 4 HA GLN 4 -4.276 -3.144 1.339
41 1HB GLN 4 2HB GLN 4 -4.920 -5.163 0.034
42 2HB GLN 4 1HB GLN 4 -6.298 -4.284 0.683
43 1HG GLN 4 2HG GLN 4 -6.678 -3.260 -1.495
44 2HG GLN 4 1HG GLN 4 -5.293 -4.134 -2.150
45 1HE2 GLN 4 1HE2 GLN 4 -5.839 -5.833 -3.291
46 2HE2 GLN 4 2HE2 GLN 4 -7.204 -6.856 -3.021
47 H TRP 5 H TRP 5 -2.792 -1.306 0.121
48 HA TRP 5 HA TRP 5 -1.574 -1.959 -2.315
49 1HB TRP 5 2HB TRP 5 0.225 -0.441 -1.577
50 2HB TRP 5 1HB TRP 5 -1.369 0.241 -1.276
51 HD1 TRP 5 HD TRP 5 -2.240 -0.421 1.439
52 HE1 TRP 5 1HE TRP 5 -0.861 -0.020 3.575
53 HE3 TRP 5 3HE TRP 5 2.421 -0.147 -0.641
54 HZ2 TRP 5 2HZ TRP 5 1.842 0.365 4.284
55 HZ3 TRP 5 3HZ TRP 5 4.351 0.243 0.836
56 HH2 TRP 5 HH TRP 5 4.065 0.494 3.246
57 H ARG 6 H ARG 6 1.208 -1.873 -1.549
58 HA ARG 6 HA ARG 6 1.700 -4.342 -0.086
59 1HB ARG 6 2HB ARG 6 2.657 -3.961 -2.931
60 2HB ARG 6 1HB ARG 6 3.036 -5.322 -1.886
61 1HG ARG 6 2HG ARG 6 0.719 -6.010 -1.883
62 2HG ARG 6 1HG ARG 6 0.275 -4.595 -2.840
63 1HD ARG 6 2HD ARG 6 1.774 -5.408 -4.642
64 2HD ARG 6 1HD ARG 6 2.067 -6.865 -3.692
65 HE ARG 6 HE ARG 6 -0.163 -6.361 -5.344
66 1HH1 ARG 6 1HH1 ARG 6 0.692 -7.792 -2.283
67 2HH1 ARG 6 2HH1 ARG 6 -0.655 -8.879 -2.271
68 1HH2 ARG 6 1HH2 ARG 6 -1.937 -7.788 -5.336
69 2HH2 ARG 6 2HH2 ARG 6 -2.152 -8.875 -4.004
70 H MET 7 H MET 7 3.531 -2.310 -2.368
71 HA MET 7 HA MET 7 5.104 -1.136 -0.251
72 1HB MET 7 2HB MET 7 6.387 -2.996 -2.265
73 2HB MET 7 1HB MET 7 7.276 -1.906 -1.212
74 1HG MET 7 2HG MET 7 6.406 -3.087 0.742
75 2HG MET 7 1HG MET 7 5.524 -4.184 -0.318
76 1HE MET 7 1HE MET 7 8.369 -5.611 1.778
77 2HE MET 7 2HE MET 7 7.557 -6.753 0.707
78 3HE MET 7 3HE MET 7 6.630 -5.490 1.516
79 H LYS 8 H LYS 8 3.330 -0.271 -2.396
80 HA LYS 8 HA LYS 8 5.051 1.011 -4.347
81 1HB LYS 8 2HB LYS 8 2.060 1.183 -3.928
82 2HB LYS 8 1HB LYS 8 2.937 1.900 -5.272
83 1HG LYS 8 2HG LYS 8 3.638 -0.330 -5.998
84 2HG LYS 8 1HG LYS 8 2.737 -1.043 -4.659
85 1HD LYS 8 2HD LYS 8 0.664 -0.090 -5.566
86 2HD LYS 8 1HD LYS 8 1.578 0.603 -6.906
87 1HE LYS 8 2HE LYS 8 1.303 -2.334 -6.276
88 2HE LYS 8 1HE LYS 8 0.471 -1.470 -7.568
89 1HZ LYS 8 1HZ LYS 8 2.562 -1.029 -8.628
90 2HZ LYS 8 2HZ LYS 8 2.445 -2.691 -8.337
91 3HZ LYS 8 3HZ LYS 8 3.421 -1.726 -7.348
92 H LYS 9 H LYS 9 3.013 1.898 -1.607
93 HA LYS 9 HA LYS 9 3.192 4.674 -1.818
94 1HB LYS 9 2HB LYS 9 1.628 3.559 -0.309
95 2HB LYS 9 1HB LYS 9 2.966 2.969 0.668
96 1HG LYS 9 2HG LYS 9 3.541 5.235 1.302
97 2HG LYS 9 1HG LYS 9 2.266 5.872 0.262
98 1HD LYS 9 2HD LYS 9 1.521 5.838 2.572
99 2HD LYS 9 1HD LYS 9 0.592 4.679 1.621
100 1HE LYS 9 2HE LYS 9 2.017 2.865 2.453
101 2HE LYS 9 1HE LYS 9 2.933 4.029 3.410
102 1HZ LYS 9 1HZ LYS 9 0.604 4.585 4.375
103 2HZ LYS 9 2HZ LYS 9 1.445 3.232 4.941
104 3HZ LYS 9 3HZ LYS 9 0.196 3.040 3.818
105 H LEU 10 H LEU 10 5.264 2.397 -0.070
106 HA LEU 10 HA LEU 10 7.068 4.432 0.849
107 1HB LEU 10 2HB LEU 10 7.683 1.493 0.663
108 2HB LEU 10 1HB LEU 10 8.336 2.667 1.790
109 HG LEU 10 HG LEU 10 5.516 1.615 1.765
110 1HD1 LEU 10 1HD1 LEU 10 7.484 1.233 3.975
111 2HD1 LEU 10 2HD1 LEU 10 7.518 0.167 2.568
112 3HD1 LEU 10 3HD1 LEU 10 6.063 0.277 3.558
113 1HD2 LEU 10 1HD2 LEU 10 4.922 3.147 3.298
114 2HD2 LEU 10 2HD2 LEU 10 6.274 4.071 2.642
115 3HD2 LEU 10 3HD2 LEU 10 6.493 3.101 4.098
116 H GLY 11 H GLY 11 9.388 2.530 0.139
117 1HA GLY 11 2HA GLY 11 11.067 2.541 -1.426
118 2HA GLY 11 1HA GLY 11 9.757 2.326 -2.576
Start of MODEL 16
1 1H ARG 1 1HT ARG 1 -8.103 -1.141 5.458
2 2H ARG 1 2HT ARG 1 -7.756 -1.177 7.113
3 3H ARG 1 3HT ARG 1 -6.569 -1.617 5.992
4 HA ARG 1 HA ARG 1 -7.229 0.946 7.003
5 1HB ARG 1 2HB ARG 1 -5.057 0.027 5.103
6 2HB ARG 1 1HB ARG 1 -5.022 1.461 6.123
7 1HG ARG 1 2HG ARG 1 -5.056 0.032 8.115
8 2HG ARG 1 1HG ARG 1 -5.028 -1.393 7.075
9 1HD ARG 1 2HD ARG 1 -2.796 -0.909 7.881
10 2HD ARG 1 1HD ARG 1 -2.881 -0.645 6.141
11 HE ARG 1 HE ARG 1 -3.387 1.791 7.401
12 1HH1 ARG 1 1HH1 ARG 1 -0.770 -0.480 7.019
13 2HH1 ARG 1 2HH1 ARG 1 0.467 0.724 7.175
14 1HH2 ARG 1 1HH2 ARG 1 -1.763 3.380 7.609
15 2HH2 ARG 1 2HH2 ARG 1 -0.098 2.914 7.511
16 H ARG 2 H ARG 2 -5.771 2.046 4.457
17 HA ARG 2 HA ARG 2 -8.049 3.227 3.297
18 1HB ARG 2 2HB ARG 2 -5.872 4.327 3.266
19 2HB ARG 2 1HB ARG 2 -5.217 3.045 2.255
20 1HG ARG 2 2HG ARG 2 -6.673 3.683 0.436
21 2HG ARG 2 1HG ARG 2 -7.446 4.904 1.450
22 1HD ARG 2 2HD ARG 2 -5.787 5.886 -0.070
23 2HD ARG 2 1HD ARG 2 -5.354 6.120 1.622
24 HE ARG 2 HE ARG 2 -4.106 3.790 0.709
25 1HH1 ARG 2 1HH1 ARG 2 -4.001 7.232 0.184
26 2HH1 ARG 2 2HH1 ARG 2 -2.321 7.248 -0.238
27 1HH2 ARG 2 1HH2 ARG 2 -1.893 3.799 0.155
28 2HH2 ARG 2 2HH2 ARG 2 -1.122 5.295 -0.258
29 H TRP 3 H TRP 3 -6.109 0.439 2.438
30 HA TRP 3 HA TRP 3 -8.186 -0.665 0.848
31 1HB TRP 3 2HB TRP 3 -6.881 -0.751 -1.299
32 2HB TRP 3 1HB TRP 3 -7.461 0.848 -0.865
33 HD1 TRP 3 HD TRP 3 -4.506 0.222 1.210
34 HE1 TRP 3 1HE TRP 3 -2.429 1.339 0.180
35 HE3 TRP 3 3HE TRP 3 -6.345 1.214 -3.451
36 HZ2 TRP 3 2HZ TRP 3 -1.681 2.474 -2.276
37 HZ3 TRP 3 3HZ TRP 3 -4.874 2.311 -5.089
38 HH2 TRP 3 HH TRP 3 -2.584 2.930 -4.512
39 H GLN 4 H GLN 4 -5.650 -1.833 -0.746
40 HA GLN 4 HA GLN 4 -4.624 -3.592 1.338
41 1HB GLN 4 2HB GLN 4 -5.161 -5.607 -0.021
42 2HB GLN 4 1HB GLN 4 -6.588 -4.783 0.594
43 1HG GLN 4 2HG GLN 4 -6.904 -3.716 -1.580
44 2HG GLN 4 1HG GLN 4 -5.484 -4.558 -2.194
45 1HE2 GLN 4 1HE2 GLN 4 -6.904 -6.644 -0.105
46 2HE2 GLN 4 2HE2 GLN 4 -7.903 -7.526 -1.203
47 H TRP 5 H TRP 5 -3.128 -1.711 0.226
48 HA TRP 5 HA TRP 5 -1.844 -2.268 -2.199
49 1HB TRP 5 2HB TRP 5 -0.055 -0.778 -1.351
50 2HB TRP 5 1HB TRP 5 -1.664 -0.101 -1.113
51 HD1 TRP 5 HD TRP 5 -2.676 -0.722 1.523
52 HE1 TRP 5 1HE TRP 5 -1.402 -0.394 3.738
53 HE3 TRP 5 3HE TRP 5 2.109 -0.651 -0.286
54 HZ2 TRP 5 2HZ TRP 5 1.273 -0.138 4.603
55 HZ3 TRP 5 3HZ TRP 5 3.966 -0.359 1.302
56 HH2 TRP 5 HH TRP 5 3.555 -0.108 3.694
57 H ARG 6 H ARG 6 0.926 -2.201 -1.374
58 HA ARG 6 HA ARG 6 1.406 -4.691 0.042
59 1HB ARG 6 2HB ARG 6 2.214 -4.321 -2.850
60 2HB ARG 6 1HB ARG 6 2.760 -5.633 -1.818
61 1HG ARG 6 2HG ARG 6 0.489 -6.455 -1.616
62 2HG ARG 6 1HG ARG 6 -0.104 -5.101 -2.580
63 1HD ARG 6 2HD ARG 6 1.234 -5.880 -4.482
64 2HD ARG 6 1HD ARG 6 1.802 -7.244 -3.517
65 HE ARG 6 HE ARG 6 -0.976 -7.310 -3.491
66 1HH1 ARG 6 1HH1 ARG 6 1.603 -7.607 -5.817
67 2HH1 ARG 6 2HH1 ARG 6 0.712 -8.665 -6.858
68 1HH2 ARG 6 1HH2 ARG 6 -2.152 -8.702 -4.854
69 2HH2 ARG 6 2HH2 ARG 6 -1.423 -9.288 -6.311
70 H MET 7 H MET 7 3.019 -2.365 -2.131
71 HA MET 7 HA MET 7 4.658 -1.245 -0.139
72 1HB MET 7 2HB MET 7 6.846 -2.194 -0.848
73 2HB MET 7 1HB MET 7 5.794 -3.374 -0.079
74 1HG MET 7 2HG MET 7 5.166 -4.244 -2.274
75 2HG MET 7 1HG MET 7 6.229 -3.066 -3.041
76 1HE MET 7 1HE MET 7 6.299 -6.188 -3.574
77 2HE MET 7 2HE MET 7 8.026 -6.550 -3.544
78 3HE MET 7 3HE MET 7 7.442 -5.105 -4.370
79 H LYS 8 H LYS 8 3.067 -0.346 -2.296
80 HA LYS 8 HA LYS 8 4.981 0.623 -4.284
81 1HB LYS 8 2HB LYS 8 1.969 0.826 -4.159
82 2HB LYS 8 1HB LYS 8 2.960 1.474 -5.458
83 1HG LYS 8 2HG LYS 8 2.759 -1.431 -4.693
84 2HG LYS 8 1HG LYS 8 1.945 -0.665 -6.057
85 1HD LYS 8 2HD LYS 8 4.930 -0.893 -5.663
86 2HD LYS 8 1HD LYS 8 3.955 -1.841 -6.786
87 1HE LYS 8 2HE LYS 8 4.368 1.147 -6.853
88 2HE LYS 8 1HE LYS 8 5.088 -0.031 -7.950
89 1HZ LYS 8 1HZ LYS 8 2.166 0.423 -7.666
90 2HZ LYS 8 2HZ LYS 8 2.930 -0.567 -8.806
91 3HZ LYS 8 3HZ LYS 8 3.125 1.113 -8.879
92 H LYS 9 H LYS 9 2.505 1.899 -2.076
93 HA LYS 9 HA LYS 9 3.193 4.614 -2.521
94 1HB LYS 9 2HB LYS 9 1.772 5.075 -0.551
95 2HB LYS 9 1HB LYS 9 0.984 4.038 -1.728
96 1HG LYS 9 2HG LYS 9 0.426 3.002 0.235
97 2HG LYS 9 1HG LYS 9 1.879 2.112 -0.216
98 1HD LYS 9 2HD LYS 9 2.093 2.601 2.088
99 2HD LYS 9 1HD LYS 9 3.167 3.721 1.251
100 1HE LYS 9 2HE LYS 9 0.380 4.378 2.201
101 2HE LYS 9 1HE LYS 9 1.861 4.786 3.064
102 1HZ LYS 9 1HZ LYS 9 2.512 5.988 0.937
103 2HZ LYS 9 2HZ LYS 9 1.308 6.703 1.887
104 3HZ LYS 9 3HZ LYS 9 0.887 5.853 0.485
105 H LEU 10 H LEU 10 4.190 2.216 -0.151
106 HA LEU 10 HA LEU 10 5.616 4.005 1.529
107 1HB LEU 10 2HB LEU 10 4.845 1.769 2.240
108 2HB LEU 10 1HB LEU 10 5.996 1.034 1.141
109 HG LEU 10 HG LEU 10 7.846 2.063 2.437
110 1HD1 LEU 10 1HD1 LEU 10 7.410 3.056 4.595
111 2HD1 LEU 10 2HD1 LEU 10 5.674 2.838 4.378
112 3HD1 LEU 10 3HD1 LEU 10 6.558 3.959 3.343
113 1HD2 LEU 10 1HD2 LEU 10 7.933 0.285 3.810
114 2HD2 LEU 10 2HD2 LEU 10 6.470 -0.206 2.956
115 3HD2 LEU 10 3HD2 LEU 10 6.350 0.615 4.512
116 H GLY 11 H GLY 11 7.683 4.727 1.458
117 1HA GLY 11 2HA GLY 11 9.789 3.532 0.027
118 2HA GLY 11 1HA GLY 11 9.071 4.779 -0.979
Start of MODEL 17
1 1H ARG 1 1HT ARG 1 -8.605 -0.699 6.128
2 2H ARG 1 2HT ARG 1 -8.944 0.924 6.461
3 3H ARG 1 3HT ARG 1 -7.940 0.041 7.496
4 HA ARG 1 HA ARG 1 -6.415 1.250 6.311
5 1HB ARG 1 2HB ARG 1 -6.822 -1.277 4.698
6 2HB ARG 1 1HB ARG 1 -5.333 -0.350 4.809
7 1HG ARG 1 2HG ARG 1 -5.241 -0.845 7.223
8 2HG ARG 1 1HG ARG 1 -6.684 -1.844 7.046
9 1HD ARG 1 2HD ARG 1 -4.709 -3.241 7.017
10 2HD ARG 1 1HD ARG 1 -5.480 -3.259 5.432
11 HE ARG 1 HE ARG 1 -3.522 -1.260 5.445
12 1HH1 ARG 1 1HH1 ARG 1 -3.774 -4.732 5.577
13 2HH1 ARG 1 2HH1 ARG 1 -2.232 -5.001 4.836
14 1HH2 ARG 1 1HH2 ARG 1 -1.489 -1.604 4.472
15 2HH2 ARG 1 2HH2 ARG 1 -0.933 -3.223 4.210
16 H ARG 2 H ARG 2 -5.808 2.484 4.544
17 HA ARG 2 HA ARG 2 -7.747 3.730 3.049
18 1HB ARG 2 2HB ARG 2 -5.441 4.565 3.387
19 2HB ARG 2 1HB ARG 2 -4.845 3.344 2.275
20 1HG ARG 2 2HG ARG 2 -6.886 5.360 1.411
21 2HG ARG 2 1HG ARG 2 -5.164 5.742 1.421
22 1HD ARG 2 2HD ARG 2 -4.757 3.793 -0.038
23 2HD ARG 2 1HD ARG 2 -6.492 3.490 -0.085
24 HE ARG 2 HE ARG 2 -6.605 5.035 -1.741
25 1HH1 ARG 2 1HH1 ARG 2 -3.863 5.824 0.263
26 2HH1 ARG 2 2HH1 ARG 2 -3.397 7.190 -0.693
27 1HH2 ARG 2 1HH2 ARG 2 -5.992 6.831 -3.006
28 2HH2 ARG 2 2HH2 ARG 2 -4.605 7.763 -2.548
29 H TRP 3 H TRP 3 -5.912 0.832 2.267
30 HA TRP 3 HA TRP 3 -7.888 -0.084 0.456
31 1HB TRP 3 2HB TRP 3 -6.421 -0.149 -1.587
32 2HB TRP 3 1HB TRP 3 -6.973 1.454 -1.131
33 HD1 TRP 3 HD TRP 3 -4.204 0.596 1.123
34 HE1 TRP 3 1HE TRP 3 -2.023 1.691 0.312
35 HE3 TRP 3 3HE TRP 3 -5.662 1.923 -3.591
36 HZ2 TRP 3 2HZ TRP 3 -1.057 2.935 -2.011
37 HZ3 TRP 3 3HZ TRP 3 -4.038 3.057 -5.051
38 HH2 TRP 3 HH TRP 3 -1.777 3.555 -4.274
39 H GLN 4 H GLN 4 -5.309 -1.314 -1.006
40 HA GLN 4 HA GLN 4 -4.483 -3.188 1.060
41 1HB GLN 4 2HB GLN 4 -5.069 -5.142 -0.358
42 2HB GLN 4 1HB GLN 4 -6.479 -4.250 0.204
43 1HG GLN 4 2HG GLN 4 -6.632 -3.135 -1.966
44 2HG GLN 4 1HG GLN 4 -5.233 -4.048 -2.528
45 1HE2 GLN 4 1HE2 GLN 4 -8.477 -3.911 -2.668
46 2HE2 GLN 4 2HE2 GLN 4 -8.844 -5.573 -2.969
47 H TRP 5 H TRP 5 -2.869 -1.351 0.059
48 HA TRP 5 HA TRP 5 -1.496 -1.899 -2.321
49 1HB TRP 5 2HB TRP 5 0.282 -0.478 -1.371
50 2HB TRP 5 1HB TRP 5 -1.312 0.231 -1.130
51 HD1 TRP 5 HD TRP 5 -2.390 -0.535 1.460
52 HE1 TRP 5 1HE TRP 5 -1.152 -0.340 3.711
53 HE3 TRP 5 3HE TRP 5 2.423 -0.386 -0.265
54 HZ2 TRP 5 2HZ TRP 5 1.510 -0.149 4.631
55 HZ3 TRP 5 3HZ TRP 5 4.255 -0.196 1.366
56 HH2 TRP 5 HH TRP 5 3.807 -0.079 3.763
57 H ARG 6 H ARG 6 1.219 -1.941 -1.359
58 HA ARG 6 HA ARG 6 1.601 -4.432 0.066
59 1HB ARG 6 2HB ARG 6 2.423 -4.131 -2.830
60 2HB ARG 6 1HB ARG 6 3.009 -5.400 -1.768
61 1HG ARG 6 2HG ARG 6 0.114 -4.975 -2.471
62 2HG ARG 6 1HG ARG 6 1.189 -6.112 -3.287
63 1HD ARG 6 2HD ARG 6 1.551 -7.283 -1.165
64 2HD ARG 6 1HD ARG 6 0.472 -6.148 -0.356
65 HE ARG 6 HE ARG 6 -0.915 -7.294 -2.493
66 1HH1 ARG 6 1HH1 ARG 6 0.468 -8.240 0.563
67 2HH1 ARG 6 2HH1 ARG 6 -0.667 -9.523 0.824
68 1HH2 ARG 6 1HH2 ARG 6 -2.411 -8.979 -2.157
69 2HH2 ARG 6 2HH2 ARG 6 -2.302 -9.944 -0.722
70 H MET 7 H MET 7 3.316 -2.241 -2.157
71 HA MET 7 HA MET 7 4.930 -1.043 -0.197
72 1HB MET 7 2HB MET 7 7.109 -2.081 -0.749
73 2HB MET 7 1HB MET 7 5.997 -3.212 0.011
74 1HG MET 7 2HG MET 7 5.444 -4.110 -2.223
75 2HG MET 7 1HG MET 7 6.654 -3.035 -2.921
76 1HE MET 7 1HE MET 7 9.517 -4.022 -0.483
77 2HE MET 7 2HE MET 7 8.771 -2.750 -1.451
78 3HE MET 7 3HE MET 7 9.808 -3.951 -2.222
79 H LYS 8 H LYS 8 3.419 -0.200 -2.395
80 HA LYS 8 HA LYS 8 5.261 0.459 -4.536
81 1HB LYS 8 2HB LYS 8 3.298 1.565 -5.561
82 2HB LYS 8 1HB LYS 8 2.995 -0.118 -5.155
83 1HG LYS 8 2HG LYS 8 1.813 0.593 -3.129
84 2HG LYS 8 1HG LYS 8 2.096 2.278 -3.568
85 1HD LYS 8 2HD LYS 8 0.603 0.312 -5.301
86 2HD LYS 8 1HD LYS 8 -0.178 1.400 -4.156
87 1HE LYS 8 2HE LYS 8 -0.297 2.407 -6.317
88 2HE LYS 8 1HE LYS 8 0.880 3.312 -5.367
89 1HZ LYS 8 1HZ LYS 8 1.447 2.662 -7.776
90 2HZ LYS 8 2HZ LYS 8 1.761 1.127 -7.140
91 3HZ LYS 8 3HZ LYS 8 2.634 2.467 -6.586
92 H LYS 9 H LYS 9 3.452 2.134 -1.999
93 HA LYS 9 HA LYS 9 4.401 4.726 -2.701
94 1HB LYS 9 2HB LYS 9 3.457 5.438 -0.548
95 2HB LYS 9 1HB LYS 9 2.324 4.456 -1.466
96 1HG LYS 9 2HG LYS 9 2.886 2.520 -0.083
97 2HG LYS 9 1HG LYS 9 4.012 3.516 0.843
98 1HD LYS 9 2HD LYS 9 2.158 4.968 1.524
99 2HD LYS 9 1HD LYS 9 1.035 3.962 0.605
100 1HE LYS 9 2HE LYS 9 1.586 2.049 2.019
101 2HE LYS 9 1HE LYS 9 2.723 3.042 2.929
102 1HZ LYS 9 1HZ LYS 9 -0.207 3.505 2.752
103 2HZ LYS 9 2HZ LYS 9 0.889 4.437 3.641
104 3HZ LYS 9 3HZ LYS 9 0.604 2.829 4.074
105 H LEU 10 H LEU 10 5.459 2.259 -0.426
106 HA LEU 10 HA LEU 10 7.506 3.923 0.727
107 1HB LEU 10 2HB LEU 10 6.350 2.100 1.969
108 2HB LEU 10 1HB LEU 10 7.137 0.931 0.925
109 HG LEU 10 HG LEU 10 9.337 1.677 1.777
110 1HD1 LEU 10 1HD1 LEU 10 9.371 3.753 2.623
111 2HD1 LEU 10 2HD1 LEU 10 8.846 2.977 4.117
112 3HD1 LEU 10 3HD1 LEU 10 7.659 3.717 3.043
113 1HD2 LEU 10 1HD2 LEU 10 9.181 0.117 3.356
114 2HD2 LEU 10 2HD2 LEU 10 7.450 0.073 3.022
115 3HD2 LEU 10 3HD2 LEU 10 8.073 1.097 4.316
116 H GLY 11 H GLY 11 7.881 4.050 -1.946
117 1HA GLY 11 2HA GLY 11 9.594 2.113 -3.063
118 2HA GLY 11 1HA GLY 11 9.439 3.776 -3.607
Start of MODEL 18
1 1H ARG 1 1HT ARG 1 -3.320 4.544 5.041
2 2H ARG 1 2HT ARG 1 -3.210 3.692 6.498
3 3H ARG 1 3HT ARG 1 -4.622 4.543 6.121
4 HA ARG 1 HA ARG 1 -3.838 2.580 4.158
5 1HB ARG 1 2HB ARG 1 -3.186 1.408 6.188
6 2HB ARG 1 1HB ARG 1 -4.731 1.784 6.937
7 1HG ARG 1 2HG ARG 1 -5.876 0.409 5.272
8 2HG ARG 1 1HG ARG 1 -4.324 0.029 4.524
9 1HD ARG 1 2HD ARG 1 -3.577 -1.048 6.574
10 2HD ARG 1 1HD ARG 1 -5.092 -0.621 7.368
11 HE ARG 1 HE ARG 1 -5.986 -2.496 6.450
12 1HH1 ARG 1 1HH1 ARG 1 -3.350 -1.464 4.412
13 2HH1 ARG 1 2HH1 ARG 1 -3.522 -2.787 3.308
14 1HH2 ARG 1 1HH2 ARG 1 -6.213 -4.236 4.999
15 2HH2 ARG 1 2HH2 ARG 1 -5.146 -4.362 3.641
16 H ARG 2 H ARG 2 -5.558 2.093 2.922
17 HA ARG 2 HA ARG 2 -8.254 2.245 3.804
18 1HB ARG 2 2HB ARG 2 -9.019 4.126 2.476
19 2HB ARG 2 1HB ARG 2 -7.790 4.664 3.611
20 1HG ARG 2 2HG ARG 2 -7.262 4.056 0.711
21 2HG ARG 2 1HG ARG 2 -7.610 5.663 1.346
22 1HD ARG 2 2HD ARG 2 -5.632 5.508 2.791
23 2HD ARG 2 1HD ARG 2 -5.283 3.911 2.131
24 HE ARG 2 HE ARG 2 -4.269 4.961 0.390
25 1HH1 ARG 2 1HH1 ARG 2 -6.649 7.136 1.716
26 2HH1 ARG 2 2HH1 ARG 2 -6.287 8.414 0.604
27 1HH2 ARG 2 1HH2 ARG 2 -3.791 6.636 -1.079
28 2HH2 ARG 2 2HH2 ARG 2 -4.665 8.129 -0.985
29 H TRP 3 H TRP 3 -6.587 0.362 2.538
30 HA TRP 3 HA TRP 3 -8.285 -0.556 0.497
31 1HB TRP 3 2HB TRP 3 -6.632 -0.464 -1.403
32 2HB TRP 3 1HB TRP 3 -7.324 1.086 -0.949
33 HD1 TRP 3 HD TRP 3 -4.753 0.391 1.549
34 HE1 TRP 3 1HE TRP 3 -2.536 1.542 0.936
35 HE3 TRP 3 3HE TRP 3 -5.764 1.556 -3.321
36 HZ2 TRP 3 2HZ TRP 3 -1.377 2.759 -1.314
37 HZ3 TRP 3 3HZ TRP 3 -4.037 2.709 -4.640
38 HH2 TRP 3 HH TRP 3 -1.884 3.303 -3.653
39 H GLN 4 H GLN 4 -5.711 -1.738 -0.851
40 HA GLN 4 HA GLN 4 -4.877 -3.555 1.273
41 1HB GLN 4 2HB GLN 4 -6.052 -4.510 -1.342
42 2HB GLN 4 1HB GLN 4 -5.352 -5.535 -0.094
43 1HG GLN 4 2HG GLN 4 -7.092 -4.762 1.468
44 2HG GLN 4 1HG GLN 4 -7.813 -3.826 0.163
45 1HE2 GLN 4 1HE2 GLN 4 -9.513 -4.770 -0.682
46 2HE2 GLN 4 2HE2 GLN 4 -9.753 -6.471 -0.877
47 H TRP 5 H TRP 5 -3.212 -1.726 0.418
48 HA TRP 5 HA TRP 5 -1.695 -2.335 -1.893
49 1HB TRP 5 2HB TRP 5 -0.040 -0.782 -0.948
50 2HB TRP 5 1HB TRP 5 -1.668 -0.123 -0.830
51 HD1 TRP 5 HD TRP 5 -2.827 -0.840 1.777
52 HE1 TRP 5 1HE TRP 5 -1.700 -0.409 4.051
53 HE3 TRP 5 3HE TRP 5 2.022 -0.421 0.215
54 HZ2 TRP 5 2HZ TRP 5 0.900 0.050 5.049
55 HZ3 TRP 5 3HZ TRP 5 3.767 0.015 1.892
56 HH2 TRP 5 HH TRP 5 3.217 0.247 4.259
57 H ARG 6 H ARG 6 0.930 -2.140 -0.381
58 HA ARG 6 HA ARG 6 1.249 -4.464 1.190
59 1HB ARG 6 2HB ARG 6 2.562 -5.832 -0.391
60 2HB ARG 6 1HB ARG 6 0.879 -5.679 -0.872
61 1HG ARG 6 2HG ARG 6 1.480 -4.035 -2.546
62 2HG ARG 6 1HG ARG 6 3.164 -4.088 -2.022
63 1HD ARG 6 2HD ARG 6 3.238 -6.484 -2.622
64 2HD ARG 6 1HD ARG 6 1.584 -6.360 -3.222
65 HE ARG 6 HE ARG 6 3.124 -4.416 -4.509
66 1HH1 ARG 6 1HH1 ARG 6 2.850 -7.887 -4.345
67 2HH1 ARG 6 2HH1 ARG 6 3.434 -8.139 -5.955
68 1HH2 ARG 6 1HH2 ARG 6 3.897 -4.740 -6.630
69 2HH2 ARG 6 2HH2 ARG 6 4.029 -6.350 -7.253
70 H MET 7 H MET 7 2.968 -2.513 -1.243
71 HA MET 7 HA MET 7 4.675 -1.289 0.632
72 1HB MET 7 2HB MET 7 6.816 -2.365 -0.070
73 2HB MET 7 1HB MET 7 5.758 -3.417 0.857
74 1HG MET 7 2HG MET 7 5.012 -4.485 -1.214
75 2HG MET 7 1HG MET 7 6.088 -3.435 -2.135
76 1HE MET 7 1HE MET 7 6.439 -7.020 -2.123
77 2HE MET 7 2HE MET 7 8.018 -6.532 -2.739
78 3HE MET 7 3HE MET 7 6.578 -5.615 -3.180
79 H LYS 8 H LYS 8 3.058 -0.814 -1.812
80 HA LYS 8 HA LYS 8 4.968 0.016 -3.816
81 1HB LYS 8 2HB LYS 8 1.982 0.456 -3.608
82 2HB LYS 8 1HB LYS 8 2.967 0.925 -4.986
83 1HG LYS 8 2HG LYS 8 2.500 -1.880 -3.992
84 2HG LYS 8 1HG LYS 8 1.821 -1.149 -5.447
85 1HD LYS 8 2HD LYS 8 4.751 -1.654 -4.913
86 2HD LYS 8 1HD LYS 8 3.715 -2.599 -5.984
87 1HE LYS 8 2HE LYS 8 4.404 0.321 -6.312
88 2HE LYS 8 1HE LYS 8 5.100 -1.012 -7.232
89 1HZ LYS 8 1HZ LYS 8 2.261 -0.141 -7.245
90 2HZ LYS 8 2HZ LYS 8 2.839 -1.516 -8.041
91 3HZ LYS 8 3HZ LYS 8 3.375 0.018 -8.509
92 H LYS 9 H LYS 9 3.006 1.454 -1.299
93 HA LYS 9 HA LYS 9 3.308 4.154 -1.902
94 1HB LYS 9 2HB LYS 9 3.204 2.893 0.847
95 2HB LYS 9 1HB LYS 9 2.837 4.570 0.462
96 1HG LYS 9 2HG LYS 9 0.920 3.885 -0.847
97 2HG LYS 9 1HG LYS 9 1.307 2.188 -0.565
98 1HD LYS 9 2HD LYS 9 -0.424 2.744 0.955
99 2HD LYS 9 1HD LYS 9 1.062 2.664 1.902
100 1HE LYS 9 2HE LYS 9 -0.152 5.207 0.830
101 2HE LYS 9 1HE LYS 9 -0.396 4.598 2.465
102 1HZ LYS 9 1HZ LYS 9 2.244 4.595 2.371
103 2HZ LYS 9 2HZ LYS 9 1.355 5.949 2.858
104 3HZ LYS 9 3HZ LYS 9 1.950 5.852 1.278
105 H LEU 10 H LEU 10 5.447 1.921 -0.239
106 HA LEU 10 HA LEU 10 7.309 3.747 0.771
107 1HB LEU 10 2HB LEU 10 7.521 0.875 -0.054
108 2HB LEU 10 1HB LEU 10 8.920 1.747 0.521
109 HG LEU 10 HG LEU 10 7.703 2.182 2.615
110 1HD1 LEU 10 1HD1 LEU 10 5.427 1.838 1.497
111 2HD1 LEU 10 2HD1 LEU 10 5.645 1.237 3.140
112 3HD1 LEU 10 3HD1 LEU 10 5.712 0.121 1.776
113 1HD2 LEU 10 1HD2 LEU 10 7.661 -0.352 3.272
114 2HD2 LEU 10 2HD2 LEU 10 9.178 0.454 2.874
115 3HD2 LEU 10 3HD2 LEU 10 8.371 -0.550 1.670
116 H GLY 11 H GLY 11 8.948 4.869 -0.095
117 1HA GLY 11 2HA GLY 11 10.356 4.177 -2.424
118 2HA GLY 11 1HA GLY 11 9.088 5.311 -2.862
Start of MODEL 19
1 1H ARG 1 1HT ARG 1 -8.175 -1.148 5.064
2 2H ARG 1 2HT ARG 1 -9.093 -0.375 6.256
3 3H ARG 1 3HT ARG 1 -7.656 -1.163 6.674
4 HA ARG 1 HA ARG 1 -7.536 1.329 6.546
5 1HB ARG 1 2HB ARG 1 -5.655 -0.436 6.375
6 2HB ARG 1 1HB ARG 1 -5.669 -0.094 4.651
7 1HG ARG 1 2HG ARG 1 -5.210 2.283 5.165
8 2HG ARG 1 1HG ARG 1 -5.082 1.853 6.869
9 1HD ARG 1 2HD ARG 1 -3.352 0.787 4.637
10 2HD ARG 1 1HD ARG 1 -2.883 2.016 5.807
11 HE ARG 1 HE ARG 1 -2.594 0.368 7.400
12 1HH1 ARG 1 1HH1 ARG 1 -4.020 -0.993 4.522
13 2HH1 ARG 1 2HH1 ARG 1 -3.824 -2.631 5.047
14 1HH2 ARG 1 1HH2 ARG 1 -2.332 -1.788 8.091
15 2HH2 ARG 1 2HH2 ARG 1 -2.868 -3.082 7.073
16 H ARG 2 H ARG 2 -5.983 1.890 3.940
17 HA ARG 2 HA ARG 2 -8.160 3.170 2.581
18 1HB ARG 2 2HB ARG 2 -5.948 4.238 2.787
19 2HB ARG 2 1HB ARG 2 -5.240 2.953 1.817
20 1HG ARG 2 2HG ARG 2 -6.639 3.629 -0.081
21 2HG ARG 2 1HG ARG 2 -7.310 4.937 0.895
22 1HD ARG 2 2HD ARG 2 -5.072 5.900 1.134
23 2HD ARG 2 1HD ARG 2 -4.405 4.594 0.156
24 HE ARG 2 HE ARG 2 -5.001 5.800 -1.674
25 1HH1 ARG 2 1HH1 ARG 2 -7.138 6.693 0.935
26 2HH1 ARG 2 2HH1 ARG 2 -8.008 7.858 -0.008
27 1HH2 ARG 2 1HH2 ARG 2 -6.141 7.329 -2.915
28 2HH2 ARG 2 2HH2 ARG 2 -7.441 8.220 -2.195
29 H TRP 3 H TRP 3 -6.073 0.403 2.013
30 HA TRP 3 HA TRP 3 -7.941 -0.827 0.263
31 1HB TRP 3 2HB TRP 3 -6.425 -0.884 -1.749
32 2HB TRP 3 1HB TRP 3 -7.131 0.688 -1.409
33 HD1 TRP 3 HD TRP 3 -4.289 0.069 0.900
34 HE1 TRP 3 1HE TRP 3 -2.215 1.363 0.096
35 HE3 TRP 3 3HE TRP 3 -5.890 1.340 -3.784
36 HZ2 TRP 3 2HZ TRP 3 -1.381 2.729 -2.213
37 HZ3 TRP 3 3HZ TRP 3 -4.382 2.636 -5.231
38 HH2 TRP 3 HH TRP 3 -2.170 3.320 -4.460
39 H GLN 4 H GLN 4 -5.273 -1.912 -1.097
40 HA GLN 4 HA GLN 4 -4.162 -3.477 1.062
41 1HB GLN 4 2HB GLN 4 -4.669 -5.643 -0.059
42 2HB GLN 4 1HB GLN 4 -6.096 -4.826 0.562
43 1HG GLN 4 2HG GLN 4 -6.587 -4.002 -1.698
44 2HG GLN 4 1HG GLN 4 -5.183 -4.879 -2.305
45 1HE2 GLN 4 1HE2 GLN 4 -5.669 -6.727 -3.229
46 2HE2 GLN 4 2HE2 GLN 4 -6.984 -7.766 -2.814
47 H TRP 5 H TRP 5 -2.739 -1.729 -0.132
48 HA TRP 5 HA TRP 5 -1.566 -2.240 -2.607
49 1HB TRP 5 2HB TRP 5 0.283 -0.789 -1.785
50 2HB TRP 5 1HB TRP 5 -1.313 -0.102 -1.510
51 HD1 TRP 5 HD TRP 5 -2.241 -0.980 1.181
52 HE1 TRP 5 1HE TRP 5 -0.924 -0.579 3.355
53 HE3 TRP 5 3HE TRP 5 2.426 -0.321 -0.802
54 HZ2 TRP 5 2HZ TRP 5 1.736 -0.048 4.128
55 HZ3 TRP 5 3HZ TRP 5 4.300 0.133 0.724
56 HH2 TRP 5 HH TRP 5 3.961 0.268 3.138
57 H ARG 6 H ARG 6 1.268 -2.165 -1.750
58 HA ARG 6 HA ARG 6 1.694 -4.824 -0.625
59 1HB ARG 6 2HB ARG 6 2.672 -4.004 -3.365
60 2HB ARG 6 1HB ARG 6 3.229 -5.428 -2.500
61 1HG ARG 6 2HG ARG 6 0.375 -4.927 -3.319
62 2HG ARG 6 1HG ARG 6 1.526 -5.922 -4.212
63 1HD ARG 6 2HD ARG 6 1.763 -7.384 -2.253
64 2HD ARG 6 1HD ARG 6 0.592 -6.394 -1.382
65 HE ARG 6 HE ARG 6 -0.579 -7.255 -3.773
66 1HH1 ARG 6 1HH1 ARG 6 0.541 -8.564 -0.744
67 2HH1 ARG 6 2HH1 ARG 6 -0.581 -9.883 -0.752
68 1HH2 ARG 6 1HH2 ARG 6 -2.060 -8.987 -3.790
69 2HH2 ARG 6 2HH2 ARG 6 -2.061 -10.123 -2.482
70 H MET 7 H MET 7 3.525 -2.271 -2.337
71 HA MET 7 HA MET 7 4.937 -1.413 -0.060
72 1HB MET 7 2HB MET 7 7.171 -2.333 -0.578
73 2HB MET 7 1HB MET 7 6.016 -3.581 -0.132
74 1HG MET 7 2HG MET 7 5.711 -4.151 -2.482
75 2HG MET 7 1HG MET 7 6.853 -2.888 -2.938
76 1HE MET 7 1HE MET 7 7.795 -6.809 -0.767
77 2HE MET 7 2HE MET 7 6.252 -5.958 -0.825
78 3HE MET 7 3HE MET 7 7.523 -5.406 0.265
79 H LYS 8 H LYS 8 3.626 -0.339 -2.401
80 HA LYS 8 HA LYS 8 5.748 0.789 -4.028
81 1HB LYS 8 2HB LYS 8 3.948 1.891 -5.266
82 2HB LYS 8 1HB LYS 8 3.633 0.169 -5.099
83 1HG LYS 8 2HG LYS 8 2.055 0.624 -3.295
84 2HG LYS 8 1HG LYS 8 2.387 2.351 -3.437
85 1HD LYS 8 2HD LYS 8 1.229 0.604 -5.608
86 2HD LYS 8 1HD LYS 8 0.311 1.709 -4.583
87 1HE LYS 8 2HE LYS 8 1.600 3.593 -5.462
88 2HE LYS 8 1HE LYS 8 2.526 2.490 -6.479
89 1HZ LYS 8 1HZ LYS 8 0.690 2.064 -7.818
90 2HZ LYS 8 2HZ LYS 8 0.567 3.725 -7.520
91 3HZ LYS 8 3HZ LYS 8 -0.417 2.640 -6.676
92 H LYS 9 H LYS 9 3.452 1.805 -1.562
93 HA LYS 9 HA LYS 9 3.992 4.557 -1.608
94 1HB LYS 9 2HB LYS 9 2.048 3.642 -0.466
95 2HB LYS 9 1HB LYS 9 3.084 2.790 0.670
96 1HG LYS 9 2HG LYS 9 3.886 4.929 1.542
97 2HG LYS 9 1HG LYS 9 2.842 5.779 0.402
98 1HD LYS 9 2HD LYS 9 1.806 5.684 2.603
99 2HD LYS 9 1HD LYS 9 0.876 4.739 1.438
100 1HE LYS 9 2HE LYS 9 1.092 3.569 3.574
101 2HE LYS 9 1HE LYS 9 1.891 2.688 2.272
102 1HZ LYS 9 1HZ LYS 9 3.958 3.144 3.110
103 2HZ LYS 9 2HZ LYS 9 3.074 3.047 4.548
104 3HZ LYS 9 3HZ LYS 9 3.467 4.558 3.898
105 H LEU 10 H LEU 10 5.431 1.933 0.279
106 HA LEU 10 HA LEU 10 7.144 3.504 1.849
107 1HB LEU 10 2HB LEU 10 6.650 1.171 2.362
108 2HB LEU 10 1HB LEU 10 7.472 0.657 0.901
109 HG LEU 10 HG LEU 10 9.604 1.497 1.816
110 1HD1 LEU 10 1HD1 LEU 10 9.673 2.890 3.536
111 2HD1 LEU 10 2HD1 LEU 10 8.878 1.699 4.565
112 3HD1 LEU 10 3HD1 LEU 10 7.912 2.841 3.631
113 1HD2 LEU 10 1HD2 LEU 10 8.197 -0.794 2.537
114 2HD2 LEU 10 2HD2 LEU 10 8.873 -0.180 4.046
115 3HD2 LEU 10 3HD2 LEU 10 9.933 -0.523 2.679
116 H GLY 11 H GLY 11 7.710 1.853 -1.247
117 1HA GLY 11 2HA GLY 11 10.414 2.597 -1.525
118 2HA GLY 11 1HA GLY 11 9.345 2.123 -2.836
Start of MODEL 20
1 1H ARG 1 1HT ARG 1 -9.090 0.322 6.841
2 2H ARG 1 2HT ARG 1 -8.013 -0.476 7.871
3 3H ARG 1 3HT ARG 1 -8.606 -1.262 6.496
4 HA ARG 1 HA ARG 1 -6.615 0.891 6.692
5 1HB ARG 1 2HB ARG 1 -5.947 -1.502 6.645
6 2HB ARG 1 1HB ARG 1 -6.750 -1.674 5.095
7 1HG ARG 1 2HG ARG 1 -4.454 -1.464 4.641
8 2HG ARG 1 1HG ARG 1 -5.196 0.074 4.198
9 1HD ARG 1 2HD ARG 1 -3.909 -0.405 6.872
10 2HD ARG 1 1HD ARG 1 -3.013 0.179 5.475
11 HE ARG 1 HE ARG 1 -5.199 1.854 5.781
12 1HH1 ARG 1 1HH1 ARG 1 -2.360 0.954 7.584
13 2HH1 ARG 1 2HH1 ARG 1 -2.222 2.485 8.381
14 1HH2 ARG 1 1HH2 ARG 1 -5.029 3.876 6.829
15 2HH2 ARG 1 2HH2 ARG 1 -3.739 4.145 7.954
16 H ARG 2 H ARG 2 -6.121 2.163 4.895
17 HA ARG 2 HA ARG 2 -8.179 3.164 3.367
18 1HB ARG 2 2HB ARG 2 -6.008 4.284 3.697
19 2HB ARG 2 1HB ARG 2 -5.237 3.097 2.660
20 1HG ARG 2 2HG ARG 2 -7.486 4.762 1.614
21 2HG ARG 2 1HG ARG 2 -5.854 5.424 1.715
22 1HD ARG 2 2HD ARG 2 -5.033 3.536 0.366
23 2HD ARG 2 1HD ARG 2 -6.683 2.931 0.232
24 HE ARG 2 HE ARG 2 -6.955 4.378 -1.494
25 1HH1 ARG 2 1HH1 ARG 2 -4.528 5.699 0.632
26 2HH1 ARG 2 2HH1 ARG 2 -4.251 7.100 -0.350
27 1HH2 ARG 2 1HH2 ARG 2 -6.592 6.215 -2.789
28 2HH2 ARG 2 2HH2 ARG 2 -5.422 7.392 -2.292
29 H TRP 3 H TRP 3 -6.087 0.435 2.729
30 HA TRP 3 HA TRP 3 -7.899 -0.709 0.886
31 1HB TRP 3 2HB TRP 3 -6.358 -0.702 -1.106
32 2HB TRP 3 1HB TRP 3 -7.075 0.855 -0.725
33 HD1 TRP 3 HD TRP 3 -4.310 0.316 1.637
34 HE1 TRP 3 1HE TRP 3 -2.190 1.531 0.837
35 HE3 TRP 3 3HE TRP 3 -5.724 1.342 -3.165
36 HZ2 TRP 3 2HZ TRP 3 -1.248 2.739 -1.515
37 HZ3 TRP 3 3HZ TRP 3 -4.145 2.531 -4.630
38 HH2 TRP 3 HH TRP 3 -1.948 3.218 -3.818
39 H GLN 4 H GLN 4 -5.482 -1.966 -0.553
40 HA GLN 4 HA GLN 4 -4.345 -3.545 1.620
41 1HB GLN 4 2HB GLN 4 -5.772 -4.791 -0.737
42 2HB GLN 4 1HB GLN 4 -4.931 -5.658 0.541
43 1HG GLN 4 2HG GLN 4 -6.526 -4.776 2.173
44 2HG GLN 4 1HG GLN 4 -7.375 -3.940 0.879
45 1HE2 GLN 4 1HE2 GLN 4 -6.289 -6.749 -0.426
46 2HE2 GLN 4 2HE2 GLN 4 -7.675 -7.746 -0.166
47 H TRP 5 H TRP 5 -2.826 -1.807 0.460
48 HA TRP 5 HA TRP 5 -1.627 -2.455 -1.995
49 1HB TRP 5 2HB TRP 5 0.172 -0.932 -1.277
50 2HB TRP 5 1HB TRP 5 -1.420 -0.251 -0.970
51 HD1 TRP 5 HD TRP 5 -2.273 -0.834 1.766
52 HE1 TRP 5 1HE TRP 5 -0.859 -0.419 3.879
53 HE3 TRP 5 3HE TRP 5 2.377 -0.702 -0.368
54 HZ2 TRP 5 2HZ TRP 5 1.863 -0.078 4.551
55 HZ3 TRP 5 3HZ TRP 5 4.330 -0.326 1.080
56 HH2 TRP 5 HH TRP 5 4.078 -0.022 3.486
57 H ARG 6 H ARG 6 1.191 -2.296 -0.838
58 HA ARG 6 HA ARG 6 1.665 -4.695 0.594
59 1HB ARG 6 2HB ARG 6 2.784 -5.949 -1.247
60 2HB ARG 6 1HB ARG 6 1.041 -5.812 -1.437
61 1HG ARG 6 2HG ARG 6 1.458 -3.888 -2.988
62 2HG ARG 6 1HG ARG 6 3.176 -4.290 -2.910
63 1HD ARG 6 2HD ARG 6 2.178 -5.295 -4.875
64 2HD ARG 6 1HD ARG 6 2.662 -6.550 -3.736
65 HE ARG 6 HE ARG 6 -0.008 -5.918 -3.232
66 1HH1 ARG 6 1HH1 ARG 6 1.917 -7.338 -5.769
67 2HH1 ARG 6 2HH1 ARG 6 0.633 -8.341 -6.356
68 1HH2 ARG 6 1HH2 ARG 6 -1.701 -7.233 -4.001
69 2HH2 ARG 6 2HH2 ARG 6 -1.424 -8.280 -5.352
70 H MET 7 H MET 7 3.116 -2.606 -1.905
71 HA MET 7 HA MET 7 5.042 -1.514 -0.172
72 1HB MET 7 2HB MET 7 7.075 -2.553 -1.085
73 2HB MET 7 1HB MET 7 6.065 -3.721 -0.249
74 1HG MET 7 2HG MET 7 5.245 -4.573 -2.356
75 2HG MET 7 1HG MET 7 6.153 -3.344 -3.234
76 1HE MET 7 1HE MET 7 6.728 -5.454 -0.227
77 2HE MET 7 2HE MET 7 8.319 -6.182 -0.452
78 3HE MET 7 3HE MET 7 6.889 -6.959 -1.133
79 H LYS 8 H LYS 8 3.192 -0.661 -2.185
80 HA LYS 8 HA LYS 8 4.785 0.149 -4.469
81 1HB LYS 8 2HB LYS 8 2.429 -0.478 -4.786
82 2HB LYS 8 1HB LYS 8 1.934 0.825 -3.714
83 1HG LYS 8 2HG LYS 8 1.600 1.482 -6.003
84 2HG LYS 8 1HG LYS 8 2.892 2.454 -5.292
85 1HD LYS 8 2HD LYS 8 4.559 1.002 -6.354
86 2HD LYS 8 1HD LYS 8 3.261 0.045 -7.073
87 1HE LYS 8 2HE LYS 8 2.479 2.042 -8.275
88 2HE LYS 8 1HE LYS 8 3.808 2.968 -7.580
89 1HZ LYS 8 1HZ LYS 8 4.546 2.342 -9.686
90 2HZ LYS 8 2HZ LYS 8 3.943 0.768 -9.550
91 3HZ LYS 8 3HZ LYS 8 5.298 1.235 -8.652
92 H LYS 9 H LYS 9 3.174 1.633 -1.699
93 HA LYS 9 HA LYS 9 4.462 4.195 -2.286
94 1HB LYS 9 2HB LYS 9 2.999 5.052 -0.450
95 2HB LYS 9 1HB LYS 9 2.117 4.360 -1.805
96 1HG LYS 9 2HG LYS 9 1.815 2.283 -0.530
97 2HG LYS 9 1HG LYS 9 2.663 3.014 0.834
98 1HD LYS 9 2HD LYS 9 0.951 4.712 1.035
99 2HD LYS 9 1HD LYS 9 0.131 4.097 -0.401
100 1HE LYS 9 2HE LYS 9 -0.284 1.976 0.750
101 2HE LYS 9 1HE LYS 9 0.542 2.591 2.182
102 1HZ LYS 9 1HZ LYS 9 -1.968 2.716 2.172
103 2HZ LYS 9 2HZ LYS 9 -1.820 3.948 1.023
104 3HZ LYS 9 3HZ LYS 9 -1.151 4.146 2.564
105 H LEU 10 H LEU 10 6.144 2.082 -1.458
106 HA LEU 10 HA LEU 10 6.687 2.135 1.314
107 1HB LEU 10 2HB LEU 10 7.465 0.326 -0.117
108 2HB LEU 10 1HB LEU 10 8.482 1.441 -1.011
109 HG LEU 10 HG LEU 10 9.851 1.810 1.000
110 1HD1 LEU 10 1HD1 LEU 10 7.926 -0.147 2.226
111 2HD1 LEU 10 2HD1 LEU 10 8.323 1.481 2.772
112 3HD1 LEU 10 3HD1 LEU 10 9.517 0.191 2.906
113 1HD2 LEU 10 1HD2 LEU 10 9.991 -0.251 -0.697
114 2HD2 LEU 10 2HD2 LEU 10 9.771 -1.139 0.810
115 3HD2 LEU 10 3HD2 LEU 10 11.126 -0.024 0.633
116 H GLY 11 H GLY 11 7.850 3.485 2.547
117 1HA GLY 11 2HA GLY 11 9.990 5.079 1.721
118 2HA GLY 11 1HA GLY 11 8.535 6.056 1.602