Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
8272 | 1lvz RC | 5376 | cing | 1-original | 14 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ILE 1 1HT ILE 1 4.719 6.589 -1.826
2 2H ILE 1 2HT ILE 1 3.159 7.015 -1.304
3 3H ILE 1 3HT ILE 1 3.768 7.631 -2.765
4 HA ILE 1 HA ILE 1 2.577 5.994 -3.680
5 HB ILE 1 HB ILE 1 5.028 5.410 -3.944
6 1HG1 ILE 1 2HG1 ILE 1 3.090 3.080 -3.811
7 2HG1 ILE 1 1HG1 ILE 1 3.264 4.187 -5.171
8 1HG2 ILE 1 1HG2 ILE 1 4.473 3.283 -1.868
9 2HG2 ILE 1 2HG2 ILE 1 5.235 4.818 -1.454
10 3HG2 ILE 1 3HG2 ILE 1 6.020 3.722 -2.591
11 1HD1 ILE 1 1HD1 ILE 1 4.560 2.265 -5.732
12 2HD1 ILE 1 2HD1 ILE 1 5.275 2.189 -4.122
13 3HD1 ILE 1 3HD1 ILE 1 5.726 3.488 -5.227
14 H ARG 2 H ARG 2 3.061 5.813 -0.343
15 HA ARG 2 HA ARG 2 2.078 3.371 0.524
16 1HB ARG 2 2HB ARG 2 2.804 5.337 1.951
17 2HB ARG 2 1HB ARG 2 1.203 6.024 1.681
18 1HG ARG 2 2HG ARG 2 0.128 4.188 2.782
19 2HG ARG 2 1HG ARG 2 1.616 3.244 2.806
20 1HD ARG 2 2HD ARG 2 0.881 4.499 4.981
21 2HD ARG 2 1HD ARG 2 2.575 4.558 4.495
22 HE ARG 2 HE ARG 2 1.489 6.777 3.269
23 1HH1 ARG 2 1HH2 ARG 2 1.500 5.479 6.463
24 2HH1 ARG 2 2HH2 ARG 2 1.429 7.027 7.233
25 1HH2 ARG 2 1HH1 ARG 2 1.401 8.805 4.257
26 2HH2 ARG 2 2HH1 ARG 2 1.374 8.909 5.985
27 H GLU 3 H GLU 3 0.264 5.932 -1.047
28 HA GLU 3 HA GLU 3 -2.332 4.850 -0.302
29 1HB GLU 3 2HB GLU 3 -1.844 7.264 -1.063
30 2HB GLU 3 1HB GLU 3 -1.775 6.615 -2.702
31 1HG GLU 3 2HG GLU 3 -4.079 5.611 -2.262
32 2HG GLU 3 1HG GLU 3 -4.132 6.601 -0.805
33 H ASN 4 H ASN 4 -0.080 4.272 -2.931
34 HA ASN 4 HA ASN 4 -1.961 2.825 -4.586
35 1HB ASN 4 2HB ASN 4 0.359 3.741 -5.266
36 2HB ASN 4 1HB ASN 4 1.016 2.301 -4.489
37 1HD2 ASN 4 1HD2 ASN 4 0.550 3.254 -7.484
38 2HD2 ASN 4 2HD2 ASN 4 -0.073 1.853 -8.211
39 H LEU 5 H LEU 5 0.532 1.800 -2.234
40 HA LEU 5 HA LEU 5 -0.153 -0.987 -2.339
41 1HB LEU 5 2HB LEU 5 1.134 0.642 -0.126
42 2HB LEU 5 1HB LEU 5 1.043 -1.117 -0.141
43 HG LEU 5 HG LEU 5 2.384 0.561 -2.285
44 1HD1 LEU 5 1HD1 LEU 5 4.483 -0.398 -1.292
45 2HD1 LEU 5 2HD1 LEU 5 3.511 -1.031 0.036
46 3HD1 LEU 5 3HD1 LEU 5 3.638 0.710 -0.211
47 1HD2 LEU 5 1HD2 LEU 5 3.404 -1.867 -2.679
48 2HD2 LEU 5 2HD2 LEU 5 1.848 -1.434 -3.377
49 3HD2 LEU 5 3HD2 LEU 5 1.913 -2.391 -1.896
50 H LYS 6 H LYS 6 -1.249 1.697 -0.288
51 HA LYS 6 HA LYS 6 -2.812 0.275 1.566
52 1HB LYS 6 2HB LYS 6 -2.433 2.756 1.568
53 2HB LYS 6 1HB LYS 6 -3.584 2.888 0.238
54 1HG LYS 6 2HG LYS 6 -5.345 1.921 1.628
55 2HG LYS 6 1HG LYS 6 -4.204 1.694 2.953
56 1HD LYS 6 2HD LYS 6 -3.899 4.062 3.209
57 2HD LYS 6 1HD LYS 6 -4.789 4.394 1.722
58 1HE LYS 6 2HE LYS 6 -6.276 4.821 3.571
59 2HE LYS 6 1HE LYS 6 -6.810 3.336 2.788
60 1HZ LYS 6 1HZ LYS 6 -6.748 2.584 4.899
61 2HZ LYS 6 2HZ LYS 6 -5.596 3.725 5.404
62 3HZ LYS 6 3HZ LYS 6 -5.108 2.342 4.549
63 H ASP 7 H ASP 7 -3.477 1.169 -1.786
64 HA ASP 7 HA ASP 7 -6.235 0.298 -1.778
65 1HB ASP 7 2HB ASP 7 -4.263 0.666 -4.052
66 2HB ASP 7 1HB ASP 7 -5.987 0.361 -4.265
67 H SER 8 H SER 8 -3.160 -1.266 -2.721
68 HA SER 8 HA SER 8 -4.255 -3.679 -3.719
69 1HB SER 8 2HB SER 8 -2.108 -4.695 -3.157
70 2HB SER 8 1HB SER 8 -1.834 -3.078 -3.797
71 HG SER 8 HG SER 8 -2.220 -3.329 -1.048
72 H GLY 9 H GLY 9 -3.767 -2.585 -0.398
73 1HA GLY 9 2HA GLY 9 -4.889 -3.389 1.536
74 2HA GLY 9 1HA GLY 9 -5.668 -4.609 0.531
75 H LEU 10 H LEU 10 -2.515 -4.889 -0.278
76 HA LEU 10 HA LEU 10 -2.132 -7.188 1.544
77 1HB LEU 10 2HB LEU 10 -0.214 -6.190 -0.580
78 2HB LEU 10 1HB LEU 10 -0.308 -7.807 0.113
79 HG LEU 10 HG LEU 10 -2.465 -6.504 -1.575
80 1HD1 LEU 10 1HD1 LEU 10 -0.536 -8.753 -2.230
81 2HD1 LEU 10 2HD1 LEU 10 -0.408 -7.102 -2.838
82 3HD1 LEU 10 3HD1 LEU 10 -1.783 -8.107 -3.298
83 1HD2 LEU 10 1HD2 LEU 10 -3.261 -8.970 -1.592
84 2HD2 LEU 10 2HD2 LEU 10 -3.541 -8.042 -0.121
85 3HD2 LEU 10 3HD2 LEU 10 -2.200 -9.187 -0.200
86 H PHE 11 H PHE 11 -1.847 -4.100 2.100
87 HA PHE 11 HA PHE 11 0.617 -4.382 3.770
88 1HB PHE 11 2HB PHE 11 -0.015 -2.201 1.768
89 2HB PHE 11 1HB PHE 11 1.092 -1.932 3.093
90 HD1 PHE 11 1HD PHE 11 0.540 -3.701 -0.070
91 HD2 PHE 11 2HD PHE 11 3.226 -3.178 3.241
92 HE1 PHE 11 1HE PHE 11 2.343 -4.813 -1.358
93 HE2 PHE 11 2HE PHE 11 5.029 -4.290 1.953
94 HZ PHE 11 HZ PHE 11 4.588 -5.107 -0.346
Start of MODEL 2
1 1H ILE 1 1HT ILE 1 4.676 6.288 -0.978
2 2H ILE 1 2HT ILE 1 3.097 6.917 -0.950
3 3H ILE 1 3HT ILE 1 4.199 7.434 -2.133
4 HA ILE 1 HA ILE 1 2.933 5.960 -3.321
5 HB ILE 1 HB ILE 1 5.392 5.416 -3.309
6 1HG1 ILE 1 2HG1 ILE 1 3.512 3.056 -3.658
7 2HG1 ILE 1 1HG1 ILE 1 3.811 4.304 -4.863
8 1HG2 ILE 1 1HG2 ILE 1 5.361 4.616 -0.908
9 2HG2 ILE 1 2HG2 ILE 1 6.202 3.547 -2.032
10 3HG2 ILE 1 3HG2 ILE 1 4.577 3.143 -1.481
11 1HD1 ILE 1 1HD1 ILE 1 5.223 2.461 -5.446
12 2HD1 ILE 1 2HD1 ILE 1 5.770 2.270 -3.781
13 3HD1 ILE 1 3HD1 ILE 1 6.275 3.676 -4.721
14 H ARG 2 H ARG 2 2.886 5.505 0.022
15 HA ARG 2 HA ARG 2 1.743 2.972 0.416
16 1HB ARG 2 2HB ARG 2 2.306 4.744 2.178
17 2HB ARG 2 1HB ARG 2 0.749 5.474 1.791
18 1HG ARG 2 2HG ARG 2 -0.310 3.214 2.247
19 2HG ARG 2 1HG ARG 2 1.252 2.695 2.880
20 1HD ARG 2 2HD ARG 2 1.106 4.827 4.369
21 2HD ARG 2 1HD ARG 2 -0.611 4.804 3.962
22 HE ARG 2 HE ARG 2 -0.081 2.215 4.811
23 1HH1 ARG 2 1HH2 ARG 2 0.342 5.411 6.034
24 2HH1 ARG 2 2HH2 ARG 2 0.207 4.935 7.694
25 1HH2 ARG 2 1HH1 ARG 2 -0.256 1.578 6.973
26 2HH2 ARG 2 2HH1 ARG 2 -0.126 2.767 8.225
27 H GLU 3 H GLU 3 0.350 5.896 -0.906
28 HA GLU 3 HA GLU 3 -2.376 5.473 -0.821
29 1HB GLU 3 2HB GLU 3 -0.903 7.287 -2.033
30 2HB GLU 3 1HB GLU 3 -1.134 6.275 -3.451
31 1HG GLU 3 2HG GLU 3 -3.598 6.395 -3.111
32 2HG GLU 3 1HG GLU 3 -3.336 7.476 -1.741
33 H ASN 4 H ASN 4 -0.185 4.210 -3.353
34 HA ASN 4 HA ASN 4 -2.194 2.565 -4.597
35 1HB ASN 4 2HB ASN 4 0.827 2.584 -4.732
36 2HB ASN 4 1HB ASN 4 -0.160 1.468 -5.676
37 1HD2 ASN 4 1HD2 ASN 4 -0.740 2.243 -7.704
38 2HD2 ASN 4 2HD2 ASN 4 -0.843 3.882 -8.131
39 H LEU 5 H LEU 5 0.461 1.818 -2.310
40 HA LEU 5 HA LEU 5 -0.069 -0.990 -2.195
41 1HB LEU 5 2HB LEU 5 1.028 0.786 0.004
42 2HB LEU 5 1HB LEU 5 1.170 -0.965 -0.072
43 HG LEU 5 HG LEU 5 2.334 0.991 -2.072
44 1HD1 LEU 5 1HD1 LEU 5 3.760 -0.856 -0.149
45 2HD1 LEU 5 2HD1 LEU 5 3.402 0.828 0.227
46 3HD1 LEU 5 3HD1 LEU 5 4.465 0.432 -1.126
47 1HD2 LEU 5 1HD2 LEU 5 3.553 -1.257 -2.736
48 2HD2 LEU 5 2HD2 LEU 5 1.937 -0.931 -3.356
49 3HD2 LEU 5 3HD2 LEU 5 2.150 -2.017 -1.983
50 H LYS 6 H LYS 6 -1.476 1.746 -0.445
51 HA LYS 6 HA LYS 6 -2.907 0.208 1.490
52 1HB LYS 6 2HB LYS 6 -2.488 2.776 1.355
53 2HB LYS 6 1HB LYS 6 -3.926 2.805 0.337
54 1HG LYS 6 2HG LYS 6 -5.171 1.610 2.165
55 2HG LYS 6 1HG LYS 6 -3.745 1.777 3.187
56 1HD LYS 6 2HD LYS 6 -4.925 4.224 1.870
57 2HD LYS 6 1HD LYS 6 -5.666 3.578 3.330
58 1HE LYS 6 2HE LYS 6 -2.751 4.378 3.059
59 2HE LYS 6 1HE LYS 6 -4.001 5.323 3.866
60 1HZ LYS 6 1HZ LYS 6 -4.333 3.050 5.124
61 2HZ LYS 6 2HZ LYS 6 -3.185 4.195 5.635
62 3HZ LYS 6 3HZ LYS 6 -2.699 2.851 4.715
63 H ASP 7 H ASP 7 -3.751 1.312 -1.787
64 HA ASP 7 HA ASP 7 -6.457 0.317 -1.742
65 1HB ASP 7 2HB ASP 7 -4.519 0.907 -3.994
66 2HB ASP 7 1HB ASP 7 -6.164 0.340 -4.285
67 H SER 8 H SER 8 -3.342 -1.157 -2.566
68 HA SER 8 HA SER 8 -4.428 -3.592 -3.630
69 1HB SER 8 2HB SER 8 -2.231 -4.466 -3.444
70 2HB SER 8 1HB SER 8 -1.989 -2.744 -3.720
71 HG SER 8 HG SER 8 -0.878 -3.932 -1.862
72 H GLY 9 H GLY 9 -3.773 -2.464 -0.346
73 1HA GLY 9 2HA GLY 9 -4.658 -3.335 1.683
74 2HA GLY 9 1HA GLY 9 -5.532 -4.525 0.725
75 H LEU 10 H LEU 10 -2.363 -4.604 -0.257
76 HA LEU 10 HA LEU 10 -1.839 -7.056 1.314
77 1HB LEU 10 2HB LEU 10 -0.023 -5.763 -0.743
78 2HB LEU 10 1HB LEU 10 -0.031 -7.444 -0.216
79 HG LEU 10 HG LEU 10 -2.325 -6.104 -1.683
80 1HD1 LEU 10 1HD1 LEU 10 -0.189 -8.003 -2.698
81 2HD1 LEU 10 2HD1 LEU 10 -0.332 -6.296 -3.117
82 3HD1 LEU 10 3HD1 LEU 10 -1.578 -7.436 -3.624
83 1HD2 LEU 10 1HD2 LEU 10 -3.160 -7.937 -0.401
84 2HD2 LEU 10 2HD2 LEU 10 -1.750 -8.931 -0.766
85 3HD2 LEU 10 3HD2 LEU 10 -2.932 -8.577 -2.027
86 H PHE 11 H PHE 11 -1.647 -3.959 2.028
87 HA PHE 11 HA PHE 11 0.797 -4.267 3.724
88 1HB PHE 11 2HB PHE 11 0.139 -1.981 1.850
89 2HB PHE 11 1HB PHE 11 1.262 -1.806 3.179
90 HD1 PHE 11 1HD PHE 11 0.679 -3.328 -0.100
91 HD2 PHE 11 2HD PHE 11 3.388 -3.077 3.223
92 HE1 PHE 11 1HE PHE 11 2.467 -4.346 -1.482
93 HE2 PHE 11 2HE PHE 11 5.178 -4.096 1.841
94 HZ PHE 11 HZ PHE 11 4.720 -4.731 -0.512
Start of MODEL 3
1 1H ILE 1 1HT ILE 1 3.478 6.484 -0.755
2 2H ILE 1 2HT ILE 1 3.543 7.528 -2.092
3 3H ILE 1 3HT ILE 1 4.893 6.581 -1.684
4 HA ILE 1 HA ILE 1 2.829 5.956 -3.431
5 HB ILE 1 HB ILE 1 5.285 5.390 -3.494
6 1HG1 ILE 1 2HG1 ILE 1 3.397 3.029 -3.804
7 2HG1 ILE 1 1HG1 ILE 1 3.635 4.298 -5.004
8 1HG2 ILE 1 1HG2 ILE 1 5.290 4.567 -1.091
9 2HG2 ILE 1 2HG2 ILE 1 6.123 3.523 -2.242
10 3HG2 ILE 1 3HG2 ILE 1 4.508 3.100 -1.676
11 1HD1 ILE 1 1HD1 ILE 1 6.113 3.688 -4.960
12 2HD1 ILE 1 2HD1 ILE 1 5.040 2.483 -5.672
13 3HD1 ILE 1 3HD1 ILE 1 5.649 2.262 -4.032
14 H ARG 2 H ARG 2 2.716 5.695 -0.137
15 HA ARG 2 HA ARG 2 1.665 3.145 0.418
16 1HB ARG 2 2HB ARG 2 2.128 5.011 2.086
17 2HB ARG 2 1HB ARG 2 0.597 5.728 1.582
18 1HG ARG 2 2HG ARG 2 -0.410 3.372 2.096
19 2HG ARG 2 1HG ARG 2 1.076 3.115 3.015
20 1HD ARG 2 2HD ARG 2 -0.731 3.994 4.457
21 2HD ARG 2 1HD ARG 2 0.609 5.135 4.348
22 HE ARG 2 HE ARG 2 -1.087 5.950 2.326
23 1HH1 ARG 2 1HH2 ARG 2 -1.392 5.247 5.689
24 2HH1 ARG 2 2HH2 ARG 2 -2.658 6.402 5.949
25 1HH2 ARG 2 1HH1 ARG 2 -2.735 7.459 2.648
26 2HH2 ARG 2 2HH1 ARG 2 -3.419 7.653 4.227
27 H GLU 3 H GLU 3 0.254 5.895 -1.195
28 HA GLU 3 HA GLU 3 -2.465 5.465 -1.128
29 1HB GLU 3 2HB GLU 3 -0.761 6.969 -2.714
30 2HB GLU 3 1HB GLU 3 -1.487 5.901 -3.905
31 1HG GLU 3 2HG GLU 3 -2.932 7.781 -3.810
32 2HG GLU 3 1HG GLU 3 -3.751 6.544 -2.856
33 H ASN 4 H ASN 4 -0.227 3.911 -3.448
34 HA ASN 4 HA ASN 4 -2.213 2.073 -4.464
35 1HB ASN 4 2HB ASN 4 0.795 2.231 -4.676
36 2HB ASN 4 1HB ASN 4 -0.104 0.882 -5.370
37 1HD2 ASN 4 1HD2 ASN 4 -0.103 1.332 -7.598
38 2HD2 ASN 4 2HD2 ASN 4 -0.625 2.798 -8.277
39 H LEU 5 H LEU 5 0.540 1.671 -2.204
40 HA LEU 5 HA LEU 5 0.166 -1.083 -1.683
41 1HB LEU 5 2HB LEU 5 0.936 0.948 0.424
42 2HB LEU 5 1HB LEU 5 1.370 -0.756 0.374
43 HG LEU 5 HG LEU 5 2.301 1.406 -1.535
44 1HD1 LEU 5 1HD1 LEU 5 3.909 -0.413 0.267
45 2HD1 LEU 5 2HD1 LEU 5 3.355 1.183 0.771
46 3HD1 LEU 5 3HD1 LEU 5 4.465 1.024 -0.590
47 1HD2 LEU 5 1HD2 LEU 5 2.517 -1.608 -1.618
48 2HD2 LEU 5 2HD2 LEU 5 3.737 -0.593 -2.387
49 3HD2 LEU 5 3HD2 LEU 5 2.059 -0.502 -2.914
50 H LYS 6 H LYS 6 -1.408 1.739 -0.207
51 HA LYS 6 HA LYS 6 -2.938 0.227 1.693
52 1HB LYS 6 2HB LYS 6 -2.611 2.558 2.115
53 2HB LYS 6 1HB LYS 6 -3.206 3.003 0.518
54 1HG LYS 6 2HG LYS 6 -5.452 2.432 1.086
55 2HG LYS 6 1HG LYS 6 -4.945 1.609 2.562
56 1HD LYS 6 2HD LYS 6 -4.486 3.617 3.687
57 2HD LYS 6 1HD LYS 6 -4.313 4.535 2.191
58 1HE LYS 6 2HE LYS 6 -6.639 4.639 1.838
59 2HE LYS 6 1HE LYS 6 -6.961 3.302 2.944
60 1HZ LYS 6 1HZ LYS 6 -7.528 5.424 3.941
61 2HZ LYS 6 2HZ LYS 6 -5.938 5.981 3.717
62 3HZ LYS 6 3HZ LYS 6 -6.249 4.695 4.782
63 H ASP 7 H ASP 7 -3.668 1.476 -1.571
64 HA ASP 7 HA ASP 7 -6.395 0.512 -1.562
65 1HB ASP 7 2HB ASP 7 -4.518 1.271 -3.815
66 2HB ASP 7 1HB ASP 7 -6.201 0.816 -4.068
67 H SER 8 H SER 8 -3.289 -0.909 -2.412
68 HA SER 8 HA SER 8 -4.365 -3.219 -3.772
69 1HB SER 8 2HB SER 8 -1.756 -2.848 -2.280
70 2HB SER 8 1HB SER 8 -2.137 -4.217 -3.318
71 HG SER 8 HG SER 8 -2.236 -2.846 -5.059
72 H GLY 9 H GLY 9 -3.685 -2.440 -0.382
73 1HA GLY 9 2HA GLY 9 -4.723 -3.451 1.514
74 2HA GLY 9 1HA GLY 9 -5.484 -4.610 0.433
75 H LEU 10 H LEU 10 -2.271 -4.601 -0.387
76 HA LEU 10 HA LEU 10 -1.799 -7.078 1.162
77 1HB LEU 10 2HB LEU 10 0.098 -5.735 -0.784
78 2HB LEU 10 1HB LEU 10 0.096 -7.422 -0.276
79 HG LEU 10 HG LEU 10 -2.133 -6.090 -1.846
80 1HD1 LEU 10 1HD1 LEU 10 0.150 -7.893 -2.695
81 2HD1 LEU 10 2HD1 LEU 10 -0.181 -6.253 -3.255
82 3HD1 LEU 10 3HD1 LEU 10 -1.264 -7.573 -3.699
83 1HD2 LEU 10 1HD2 LEU 10 -1.619 -8.907 -0.866
84 2HD2 LEU 10 2HD2 LEU 10 -2.707 -8.580 -2.215
85 3HD2 LEU 10 3HD2 LEU 10 -3.055 -7.912 -0.622
86 H PHE 11 H PHE 11 -1.671 -4.010 1.982
87 HA PHE 11 HA PHE 11 0.751 -4.338 3.717
88 1HB PHE 11 2HB PHE 11 -0.023 -1.994 1.966
89 2HB PHE 11 1HB PHE 11 0.990 -1.762 3.372
90 HD1 PHE 11 1HD PHE 11 0.704 -3.616 0.168
91 HD2 PHE 11 2HD PHE 11 3.303 -2.369 3.347
92 HE1 PHE 11 1HE PHE 11 2.665 -4.364 -1.148
93 HE2 PHE 11 2HE PHE 11 5.269 -3.121 2.035
94 HZ PHE 11 HZ PHE 11 4.951 -4.120 -0.215
Start of MODEL 4
1 1H ILE 1 1HT ILE 1 3.306 7.592 -2.448
2 2H ILE 1 2HT ILE 1 4.747 6.720 -2.224
3 3H ILE 1 3HT ILE 1 3.494 6.601 -1.084
4 HA ILE 1 HA ILE 1 2.508 5.930 -3.639
5 HB ILE 1 HB ILE 1 4.923 5.366 -4.032
6 1HG1 ILE 1 2HG1 ILE 1 3.063 2.989 -3.761
7 2HG1 ILE 1 1HG1 ILE 1 3.145 4.071 -5.150
8 1HG2 ILE 1 1HG2 ILE 1 4.527 3.282 -1.877
9 2HG2 ILE 1 2HG2 ILE 1 5.322 4.828 -1.573
10 3HG2 ILE 1 3HG2 ILE 1 6.019 3.690 -2.727
11 1HD1 ILE 1 1HD1 ILE 1 4.453 2.105 -5.668
12 2HD1 ILE 1 2HD1 ILE 1 5.309 2.209 -4.130
13 3HD1 ILE 1 3HD1 ILE 1 5.582 3.428 -5.375
14 H ARG 2 H ARG 2 3.193 5.539 -0.316
15 HA ARG 2 HA ARG 2 2.160 3.092 0.446
16 1HB ARG 2 2HB ARG 2 1.671 5.792 1.728
17 2HB ARG 2 1HB ARG 2 1.333 4.253 2.515
18 1HG ARG 2 2HG ARG 2 4.080 4.719 1.370
19 2HG ARG 2 1HG ARG 2 3.660 5.478 2.902
20 1HD ARG 2 2HD ARG 2 3.380 2.510 2.346
21 2HD ARG 2 1HD ARG 2 4.749 3.240 3.175
22 HE ARG 2 HE ARG 2 2.503 4.130 4.579
23 1HH1 ARG 2 1HH2 ARG 2 3.870 1.118 3.604
24 2HH1 ARG 2 2HH2 ARG 2 3.265 0.249 4.976
25 1HH2 ARG 2 1HH1 ARG 2 1.698 3.008 6.373
26 2HH2 ARG 2 2HH1 ARG 2 2.034 1.316 6.538
27 H GLU 3 H GLU 3 0.346 5.795 -0.883
28 HA GLU 3 HA GLU 3 -2.237 4.742 -0.078
29 1HB GLU 3 2HB GLU 3 -1.611 7.182 -0.889
30 2HB GLU 3 1HB GLU 3 -1.886 6.518 -2.496
31 1HG GLU 3 2HG GLU 3 -4.015 7.329 -1.941
32 2HG GLU 3 1HG GLU 3 -4.140 5.633 -1.476
33 H ASN 4 H ASN 4 -0.142 4.277 -2.861
34 HA ASN 4 HA ASN 4 -2.109 2.867 -4.445
35 1HB ASN 4 2HB ASN 4 0.885 3.126 -4.476
36 2HB ASN 4 1HB ASN 4 0.153 1.834 -5.421
37 1HD2 ASN 4 1HD2 ASN 4 -0.735 2.412 -7.433
38 2HD2 ASN 4 2HD2 ASN 4 -0.917 4.011 -7.972
39 H LEU 5 H LEU 5 0.455 1.837 -2.178
40 HA LEU 5 HA LEU 5 -0.128 -0.971 -2.336
41 1HB LEU 5 2HB LEU 5 0.999 0.620 -0.008
42 2HB LEU 5 1HB LEU 5 1.072 -1.131 -0.179
43 HG LEU 5 HG LEU 5 2.284 0.827 -2.144
44 1HD1 LEU 5 1HD1 LEU 5 3.555 -0.798 0.078
45 2HD1 LEU 5 2HD1 LEU 5 3.447 0.961 -0.001
46 3HD1 LEU 5 3HD1 LEU 5 4.452 0.086 -1.157
47 1HD2 LEU 5 1HD2 LEU 5 2.207 -2.181 -1.921
48 2HD2 LEU 5 2HD2 LEU 5 3.566 -1.390 -2.717
49 3HD2 LEU 5 3HD2 LEU 5 1.934 -1.167 -3.338
50 H LYS 6 H LYS 6 -1.385 1.677 -0.384
51 HA LYS 6 HA LYS 6 -2.931 0.225 1.479
52 1HB LYS 6 2HB LYS 6 -2.542 2.726 1.406
53 2HB LYS 6 1HB LYS 6 -3.761 2.806 0.135
54 1HG LYS 6 2HG LYS 6 -5.493 2.095 1.585
55 2HG LYS 6 1HG LYS 6 -4.355 1.493 2.794
56 1HD LYS 6 2HD LYS 6 -3.782 3.652 3.523
57 2HD LYS 6 1HD LYS 6 -4.383 4.415 2.052
58 1HE LYS 6 2HE LYS 6 -6.633 4.189 2.707
59 2HE LYS 6 1HE LYS 6 -6.261 2.936 3.892
60 1HZ LYS 6 1HZ LYS 6 -4.868 5.392 4.388
61 2HZ LYS 6 2HZ LYS 6 -5.810 4.448 5.441
62 3HZ LYS 6 3HZ LYS 6 -6.552 5.587 4.421
63 H ASP 7 H ASP 7 -3.580 1.151 -1.871
64 HA ASP 7 HA ASP 7 -6.321 0.262 -1.937
65 1HB ASP 7 2HB ASP 7 -4.316 0.456 -4.208
66 2HB ASP 7 1HB ASP 7 -6.071 0.375 -4.376
67 H SER 8 H SER 8 -3.259 -1.301 -2.941
68 HA SER 8 HA SER 8 -4.354 -3.756 -3.795
69 1HB SER 8 2HB SER 8 -2.181 -4.698 -3.399
70 2HB SER 8 1HB SER 8 -1.924 -3.031 -3.906
71 HG SER 8 HG SER 8 -1.962 -2.575 -1.556
72 H GLY 9 H GLY 9 -3.769 -2.534 -0.529
73 1HA GLY 9 2HA GLY 9 -4.821 -3.274 1.473
74 2HA GLY 9 1HA GLY 9 -5.614 -4.536 0.539
75 H LEU 10 H LEU 10 -2.407 -4.704 -0.251
76 HA LEU 10 HA LEU 10 -1.984 -6.976 1.610
77 1HB LEU 10 2HB LEU 10 -0.139 -6.012 -0.594
78 2HB LEU 10 1HB LEU 10 -0.169 -7.601 0.168
79 HG LEU 10 HG LEU 10 -2.423 -6.437 -1.496
80 1HD1 LEU 10 1HD1 LEU 10 -0.450 -6.970 -2.864
81 2HD1 LEU 10 2HD1 LEU 10 -1.745 -8.128 -3.166
82 3HD1 LEU 10 3HD1 LEU 10 -0.378 -8.581 -2.147
83 1HD2 LEU 10 1HD2 LEU 10 -3.394 -7.967 0.031
84 2HD2 LEU 10 2HD2 LEU 10 -2.005 -9.051 -0.038
85 3HD2 LEU 10 3HD2 LEU 10 -3.107 -8.942 -1.409
86 H PHE 11 H PHE 11 -1.801 -3.925 2.182
87 HA PHE 11 HA PHE 11 0.719 -4.095 3.770
88 1HB PHE 11 2HB PHE 11 -0.002 -1.991 1.721
89 2HB PHE 11 1HB PHE 11 1.106 -1.637 3.024
90 HD1 PHE 11 1HD PHE 11 0.577 -3.570 -0.048
91 HD2 PHE 11 2HD PHE 11 3.290 -2.763 3.182
92 HE1 PHE 11 1HE PHE 11 2.399 -4.688 -1.302
93 HE2 PHE 11 2HE PHE 11 5.116 -3.880 1.930
94 HZ PHE 11 HZ PHE 11 4.670 -4.846 -0.312
Start of MODEL 5
1 1H ILE 1 1HT ILE 1 4.366 4.281 -3.740
2 2H ILE 1 2HT ILE 1 3.154 4.779 -4.822
3 3H ILE 1 3HT ILE 1 2.821 3.586 -3.660
4 HA ILE 1 HA ILE 1 3.802 5.992 -2.488
5 HB ILE 1 HB ILE 1 1.486 6.003 -4.390
6 1HG1 ILE 1 2HG1 ILE 1 3.398 8.205 -3.548
7 2HG1 ILE 1 1HG1 ILE 1 3.705 7.105 -4.887
8 1HG2 ILE 1 1HG2 ILE 1 0.728 8.169 -3.079
9 2HG2 ILE 1 2HG2 ILE 1 1.544 7.396 -1.721
10 3HG2 ILE 1 3HG2 ILE 1 0.202 6.584 -2.521
11 1HD1 ILE 1 1HD1 ILE 1 1.856 7.939 -6.137
12 2HD1 ILE 1 2HD1 ILE 1 2.675 9.367 -5.504
13 3HD1 ILE 1 3HD1 ILE 1 1.195 8.788 -4.740
14 H ARG 2 H ARG 2 2.926 6.104 -0.408
15 HA ARG 2 HA ARG 2 2.092 3.787 0.867
16 1HB ARG 2 2HB ARG 2 1.414 6.657 1.562
17 2HB ARG 2 1HB ARG 2 1.153 5.290 2.650
18 1HG ARG 2 2HG ARG 2 3.492 4.802 2.754
19 2HG ARG 2 1HG ARG 2 3.847 5.886 1.409
20 1HD ARG 2 2HD ARG 2 2.608 6.906 3.967
21 2HD ARG 2 1HD ARG 2 4.353 6.754 3.782
22 HE ARG 2 HE ARG 2 3.540 8.173 1.530
23 1HH1 ARG 2 1HH2 ARG 2 3.218 8.448 4.950
24 2HH1 ARG 2 2HH2 ARG 2 3.147 10.178 4.940
25 1HH2 ARG 2 1HH1 ARG 2 3.450 10.433 1.496
26 2HH2 ARG 2 2HH1 ARG 2 3.278 11.301 2.984
27 H GLU 3 H GLU 3 0.060 6.125 -0.821
28 HA GLU 3 HA GLU 3 -2.412 4.790 0.032
29 1HB GLU 3 2HB GLU 3 -2.226 7.271 -0.594
30 2HB GLU 3 1HB GLU 3 -2.116 6.739 -2.275
31 1HG GLU 3 2HG GLU 3 -4.282 5.522 -1.983
32 2HG GLU 3 1HG GLU 3 -4.409 6.205 -0.363
33 H ASN 4 H ASN 4 -0.057 4.381 -2.439
34 HA ASN 4 HA ASN 4 -1.784 2.972 -4.308
35 1HB ASN 4 2HB ASN 4 0.475 3.968 -4.892
36 2HB ASN 4 1HB ASN 4 1.214 2.658 -3.973
37 1HD2 ASN 4 1HD2 ASN 4 -0.901 3.306 -6.791
38 2HD2 ASN 4 2HD2 ASN 4 -0.572 1.837 -7.576
39 H LEU 5 H LEU 5 0.640 1.932 -1.886
40 HA LEU 5 HA LEU 5 0.098 -0.858 -2.070
41 1HB LEU 5 2HB LEU 5 0.897 0.701 0.410
42 2HB LEU 5 1HB LEU 5 1.100 -1.030 0.162
43 HG LEU 5 HG LEU 5 2.398 1.106 -1.555
44 1HD1 LEU 5 1HD1 LEU 5 3.684 -0.659 0.540
45 2HD1 LEU 5 2HD1 LEU 5 3.177 1.000 0.853
46 3HD1 LEU 5 3HD1 LEU 5 4.430 0.672 -0.344
47 1HD2 LEU 5 1HD2 LEU 5 2.271 -0.854 -2.868
48 2HD2 LEU 5 2HD2 LEU 5 2.501 -1.914 -1.478
49 3HD2 LEU 5 3HD2 LEU 5 3.858 -0.984 -2.117
50 H LYS 6 H LYS 6 -1.368 1.714 -0.138
51 HA LYS 6 HA LYS 6 -3.100 0.195 1.484
52 1HB LYS 6 2HB LYS 6 -2.731 2.672 1.612
53 2HB LYS 6 1HB LYS 6 -3.754 2.846 0.187
54 1HG LYS 6 2HG LYS 6 -5.620 1.771 1.380
55 2HG LYS 6 1HG LYS 6 -4.601 1.578 2.807
56 1HD LYS 6 2HD LYS 6 -4.425 3.952 3.107
57 2HD LYS 6 1HD LYS 6 -5.163 4.267 1.538
58 1HE LYS 6 2HE LYS 6 -6.824 4.616 3.292
59 2HE LYS 6 1HE LYS 6 -7.262 3.192 2.348
60 1HZ LYS 6 1HZ LYS 6 -6.663 3.379 5.107
61 2HZ LYS 6 2HZ LYS 6 -5.586 2.303 4.355
62 3HZ LYS 6 3HZ LYS 6 -7.262 2.055 4.233
63 H ASP 7 H ASP 7 -3.444 1.244 -1.884
64 HA ASP 7 HA ASP 7 -6.188 0.406 -2.182
65 1HB ASP 7 2HB ASP 7 -3.960 0.864 -4.182
66 2HB ASP 7 1HB ASP 7 -5.603 0.433 -4.656
67 H SER 8 H SER 8 -3.063 -1.206 -2.754
68 HA SER 8 HA SER 8 -4.195 -3.603 -3.863
69 1HB SER 8 2HB SER 8 -1.584 -2.907 -2.546
70 2HB SER 8 1HB SER 8 -1.962 -4.588 -2.903
71 HG SER 8 HG SER 8 -0.904 -3.010 -4.554
72 H GLY 9 H GLY 9 -3.603 -2.523 -0.539
73 1HA GLY 9 2HA GLY 9 -4.726 -3.294 1.411
74 2HA GLY 9 1HA GLY 9 -5.548 -4.488 0.416
75 H LEU 10 H LEU 10 -2.326 -4.797 -0.305
76 HA LEU 10 HA LEU 10 -2.080 -7.146 1.490
77 1HB LEU 10 2HB LEU 10 -0.099 -6.168 -0.583
78 2HB LEU 10 1HB LEU 10 -0.206 -7.779 0.124
79 HG LEU 10 HG LEU 10 -2.338 -6.491 -1.606
80 1HD1 LEU 10 1HD1 LEU 10 -0.481 -7.038 -3.011
81 2HD1 LEU 10 2HD1 LEU 10 -1.630 -8.363 -3.189
82 3HD1 LEU 10 3HD1 LEU 10 -0.207 -8.563 -2.168
83 1HD2 LEU 10 1HD2 LEU 10 -3.124 -8.972 -1.615
84 2HD2 LEU 10 2HD2 LEU 10 -3.459 -8.005 -0.182
85 3HD2 LEU 10 3HD2 LEU 10 -2.113 -9.144 -0.179
86 H PHE 11 H PHE 11 -1.785 -4.103 2.154
87 HA PHE 11 HA PHE 11 0.668 -4.430 3.842
88 1HB PHE 11 2HB PHE 11 0.002 -2.186 1.928
89 2HB PHE 11 1HB PHE 11 1.033 -1.897 3.308
90 HD1 PHE 11 1HD PHE 11 0.648 -3.926 0.225
91 HD2 PHE 11 2HD PHE 11 3.298 -2.675 3.363
92 HE1 PHE 11 1HE PHE 11 2.565 -4.883 -1.017
93 HE2 PHE 11 2HE PHE 11 5.220 -3.635 2.123
94 HZ PHE 11 HZ PHE 11 4.853 -4.739 -0.066
Start of MODEL 6
1 1H ILE 1 1HT ILE 1 4.807 6.764 -3.068
2 2H ILE 1 2HT ILE 1 3.892 6.544 -1.654
3 3H ILE 1 3HT ILE 1 3.296 7.519 -2.912
4 HA ILE 1 HA ILE 1 2.426 5.810 -3.982
5 HB ILE 1 HB ILE 1 4.823 5.344 -4.670
6 1HG1 ILE 1 2HG1 ILE 1 3.054 2.901 -4.318
7 2HG1 ILE 1 1HG1 ILE 1 2.903 4.072 -5.624
8 1HG2 ILE 1 1HG2 ILE 1 5.461 4.689 -2.276
9 2HG2 ILE 1 2HG2 ILE 1 6.084 3.656 -3.563
10 3HG2 ILE 1 3HG2 ILE 1 4.695 3.136 -2.611
11 1HD1 ILE 1 1HD1 ILE 1 5.258 2.253 -5.055
12 2HD1 ILE 1 2HD1 ILE 1 5.297 3.561 -6.236
13 3HD1 ILE 1 3HD1 ILE 1 4.190 2.206 -6.458
14 H ARG 2 H ARG 2 3.076 5.976 -0.800
15 HA ARG 2 HA ARG 2 2.493 3.387 0.241
16 1HB ARG 2 2HB ARG 2 1.952 6.123 1.430
17 2HB ARG 2 1HB ARG 2 1.868 4.604 2.323
18 1HG ARG 2 2HG ARG 2 4.287 4.203 1.510
19 2HG ARG 2 1HG ARG 2 4.292 5.916 1.086
20 1HD ARG 2 2HD ARG 2 5.156 5.896 3.279
21 2HD ARG 2 1HD ARG 2 3.456 6.297 3.520
22 HE ARG 2 HE ARG 2 3.518 3.532 3.690
23 1HH1 ARG 2 1HH2 ARG 2 5.173 6.176 5.161
24 2HH1 ARG 2 2HH2 ARG 2 5.425 5.353 6.665
25 1HH2 ARG 2 1HH1 ARG 2 3.840 2.444 5.643
26 2HH2 ARG 2 2HH1 ARG 2 4.670 3.241 6.937
27 H GLU 3 H GLU 3 0.349 6.006 -0.801
28 HA GLU 3 HA GLU 3 -2.028 4.696 0.233
29 1HB GLU 3 2HB GLU 3 -3.271 6.444 -0.745
30 2HB GLU 3 1HB GLU 3 -1.713 7.217 -0.458
31 1HG GLU 3 2HG GLU 3 -1.137 6.418 -2.883
32 2HG GLU 3 1HG GLU 3 -2.879 6.234 -3.060
33 H ASN 4 H ASN 4 -0.181 4.448 -2.707
34 HA ASN 4 HA ASN 4 -2.160 3.053 -4.252
35 1HB ASN 4 2HB ASN 4 0.217 3.990 -4.943
36 2HB ASN 4 1HB ASN 4 0.781 2.394 -4.447
37 1HD2 ASN 4 1HD2 ASN 4 -0.992 4.147 -6.907
38 2HD2 ASN 4 2HD2 ASN 4 -1.276 2.821 -7.926
39 H LEU 5 H LEU 5 0.280 2.042 -1.885
40 HA LEU 5 HA LEU 5 -0.173 -0.781 -2.087
41 1HB LEU 5 2HB LEU 5 0.645 0.813 0.362
42 2HB LEU 5 1HB LEU 5 0.864 -0.920 0.133
43 HG LEU 5 HG LEU 5 2.158 1.278 -1.511
44 1HD1 LEU 5 1HD1 LEU 5 2.997 0.844 0.850
45 2HD1 LEU 5 2HD1 LEU 5 4.198 0.631 -0.425
46 3HD1 LEU 5 3HD1 LEU 5 3.433 -0.778 0.311
47 1HD2 LEU 5 1HD2 LEU 5 2.072 -1.729 -1.787
48 2HD2 LEU 5 2HD2 LEU 5 3.492 -0.835 -2.332
49 3HD2 LEU 5 3HD2 LEU 5 1.915 -0.497 -3.040
50 H LYS 6 H LYS 6 -1.663 1.747 -0.066
51 HA LYS 6 HA LYS 6 -3.298 0.126 1.550
52 1HB LYS 6 2HB LYS 6 -3.690 2.884 0.385
53 2HB LYS 6 1HB LYS 6 -4.945 2.138 1.369
54 1HG LYS 6 2HG LYS 6 -3.249 1.793 3.180
55 2HG LYS 6 1HG LYS 6 -2.083 2.691 2.207
56 1HD LYS 6 2HD LYS 6 -3.804 4.581 2.148
57 2HD LYS 6 1HD LYS 6 -4.667 3.701 3.410
58 1HE LYS 6 2HE LYS 6 -1.794 4.662 3.565
59 2HE LYS 6 1HE LYS 6 -3.170 5.371 4.413
60 1HZ LYS 6 1HZ LYS 6 -3.474 2.959 5.271
61 2HZ LYS 6 2HZ LYS 6 -2.313 3.967 5.991
62 3HZ LYS 6 3HZ LYS 6 -1.836 2.789 4.864
63 H ASP 7 H ASP 7 -3.708 1.172 -1.801
64 HA ASP 7 HA ASP 7 -6.386 0.118 -2.100
65 1HB ASP 7 2HB ASP 7 -4.243 0.752 -4.151
66 2HB ASP 7 1HB ASP 7 -5.907 0.323 -4.551
67 H SER 8 H SER 8 -3.126 -1.195 -2.632
68 HA SER 8 HA SER 8 -3.958 -3.631 -3.887
69 1HB SER 8 2HB SER 8 -1.766 -4.386 -3.509
70 2HB SER 8 1HB SER 8 -1.567 -2.636 -3.568
71 HG SER 8 HG SER 8 -1.620 -2.618 -1.304
72 H GLY 9 H GLY 9 -3.710 -2.645 -0.493
73 1HA GLY 9 2HA GLY 9 -4.900 -3.595 1.338
74 2HA GLY 9 1HA GLY 9 -5.523 -4.826 0.246
75 H LEU 10 H LEU 10 -2.253 -4.776 -0.269
76 HA LEU 10 HA LEU 10 -1.872 -7.149 1.465
77 1HB LEU 10 2HB LEU 10 0.066 -5.888 -0.503
78 2HB LEU 10 1HB LEU 10 0.177 -7.500 0.205
79 HG LEU 10 HG LEU 10 -2.087 -6.553 -1.582
80 1HD1 LEU 10 1HD1 LEU 10 0.343 -8.275 -2.152
81 2HD1 LEU 10 2HD1 LEU 10 -0.034 -6.708 -2.869
82 3HD1 LEU 10 3HD1 LEU 10 -1.032 -8.112 -3.244
83 1HD2 LEU 10 1HD2 LEU 10 -2.391 -9.144 -1.682
84 2HD2 LEU 10 2HD2 LEU 10 -2.949 -8.299 -0.240
85 3HD2 LEU 10 3HD2 LEU 10 -1.413 -9.165 -0.212
86 H PHE 11 H PHE 11 -1.900 -4.113 2.230
87 HA PHE 11 HA PHE 11 0.445 -4.292 4.074
88 1HB PHE 11 2HB PHE 11 -0.214 -2.038 2.165
89 2HB PHE 11 1HB PHE 11 0.748 -1.766 3.596
90 HD1 PHE 11 1HD PHE 11 0.618 -3.400 0.311
91 HD2 PHE 11 2HD PHE 11 2.972 -2.778 3.850
92 HE1 PHE 11 1HE PHE 11 2.623 -4.249 -0.873
93 HE2 PHE 11 2HE PHE 11 4.978 -3.629 2.665
94 HZ PHE 11 HZ PHE 11 4.803 -4.364 0.303
Start of MODEL 7
1 1H ILE 1 1HT ILE 1 1.309 6.374 -4.202
2 2H ILE 1 2HT ILE 1 2.091 7.794 -3.694
3 3H ILE 1 3HT ILE 1 1.068 6.955 -2.628
4 HA ILE 1 HA ILE 1 3.391 5.582 -3.771
5 HB ILE 1 HB ILE 1 4.571 6.376 -1.587
6 1HG1 ILE 1 2HG1 ILE 1 2.573 8.627 -2.023
7 2HG1 ILE 1 1HG1 ILE 1 2.538 7.501 -0.670
8 1HG2 ILE 1 1HG2 ILE 1 4.158 8.299 -3.904
9 2HG2 ILE 1 2HG2 ILE 1 5.318 6.969 -3.873
10 3HG2 ILE 1 3HG2 ILE 1 5.509 8.331 -2.774
11 1HD1 ILE 1 1HD1 ILE 1 4.723 9.481 -1.336
12 2HD1 ILE 1 2HD1 ILE 1 4.862 8.248 -0.084
13 3HD1 ILE 1 3HD1 ILE 1 3.647 9.520 0.062
14 H ARG 2 H ARG 2 3.295 5.879 -0.402
15 HA ARG 2 HA ARG 2 2.737 3.166 0.122
16 1HB ARG 2 2HB ARG 2 2.144 5.532 1.931
17 2HB ARG 2 1HB ARG 2 2.338 3.856 2.445
18 1HG ARG 2 2HG ARG 2 4.648 3.836 1.887
19 2HG ARG 2 1HG ARG 2 4.514 5.321 0.944
20 1HD ARG 2 2HD ARG 2 3.921 5.250 3.907
21 2HD ARG 2 1HD ARG 2 5.544 5.545 3.285
22 HE ARG 2 HE ARG 2 3.995 7.369 1.909
23 1HH1 ARG 2 1HH2 ARG 2 4.438 6.486 5.211
24 2HH1 ARG 2 2HH2 ARG 2 4.137 8.081 5.816
25 1HH2 ARG 2 1HH1 ARG 2 3.597 9.456 2.679
26 2HH2 ARG 2 2HH1 ARG 2 3.658 9.763 4.382
27 H GLU 3 H GLU 3 0.641 5.718 -0.800
28 HA GLU 3 HA GLU 3 -1.786 4.506 0.304
29 1HB GLU 3 2HB GLU 3 -1.531 6.999 -0.166
30 2HB GLU 3 1HB GLU 3 -1.590 6.605 -1.883
31 1HG GLU 3 2HG GLU 3 -3.797 5.430 -1.422
32 2HG GLU 3 1HG GLU 3 -3.753 6.154 0.187
33 H ASN 4 H ASN 4 0.032 4.376 -2.697
34 HA ASN 4 HA ASN 4 -2.017 3.080 -4.258
35 1HB ASN 4 2HB ASN 4 0.980 3.312 -4.415
36 2HB ASN 4 1HB ASN 4 0.191 2.070 -5.389
37 1HD2 ASN 4 1HD2 ASN 4 0.131 5.607 -4.733
38 2HD2 ASN 4 2HD2 ASN 4 -0.463 6.034 -6.266
39 H LEU 5 H LEU 5 0.560 1.932 -2.098
40 HA LEU 5 HA LEU 5 0.001 -0.871 -2.425
41 1HB LEU 5 2HB LEU 5 1.127 0.578 -0.004
42 2HB LEU 5 1HB LEU 5 1.234 -1.154 -0.306
43 HG LEU 5 HG LEU 5 2.386 0.971 -2.141
44 1HD1 LEU 5 1HD1 LEU 5 3.452 0.820 0.150
45 2HD1 LEU 5 2HD1 LEU 5 4.538 0.467 -1.192
46 3HD1 LEU 5 3HD1 LEU 5 3.868 -0.850 -0.230
47 1HD2 LEU 5 1HD2 LEU 5 3.716 -1.171 -2.874
48 2HD2 LEU 5 2HD2 LEU 5 2.070 -0.954 -3.460
49 3HD2 LEU 5 3HD2 LEU 5 2.386 -2.051 -2.115
50 H LYS 6 H LYS 6 -1.212 1.619 -0.212
51 HA LYS 6 HA LYS 6 -2.768 0.057 1.523
52 1HB LYS 6 2HB LYS 6 -2.456 2.545 1.639
53 2HB LYS 6 1HB LYS 6 -3.633 2.701 0.335
54 1HG LYS 6 2HG LYS 6 -5.338 1.602 1.682
55 2HG LYS 6 1HG LYS 6 -4.174 1.306 2.972
56 1HD LYS 6 2HD LYS 6 -4.870 4.083 1.973
57 2HD LYS 6 1HD LYS 6 -5.701 3.315 3.323
58 1HE LYS 6 2HE LYS 6 -4.053 4.493 4.468
59 2HE LYS 6 1HE LYS 6 -3.206 2.970 4.218
60 1HZ LYS 6 1HZ LYS 6 -2.890 4.613 1.951
61 2HZ LYS 6 2HZ LYS 6 -1.701 4.015 3.005
62 3HZ LYS 6 3HZ LYS 6 -2.467 5.496 3.336
63 H ASP 7 H ASP 7 -3.392 1.110 -1.793
64 HA ASP 7 HA ASP 7 -6.130 0.218 -1.925
65 1HB ASP 7 2HB ASP 7 -4.113 0.469 -4.179
66 2HB ASP 7 1HB ASP 7 -5.866 0.413 -4.350
67 H SER 8 H SER 8 -3.023 -1.302 -2.817
68 HA SER 8 HA SER 8 -4.014 -3.726 -3.840
69 1HB SER 8 2HB SER 8 -1.888 -4.639 -3.389
70 2HB SER 8 1HB SER 8 -1.560 -2.914 -3.529
71 HG SER 8 HG SER 8 -0.687 -4.063 -1.625
72 H GLY 9 H GLY 9 -3.845 -2.589 -0.509
73 1HA GLY 9 2HA GLY 9 -5.094 -3.407 1.344
74 2HA GLY 9 1HA GLY 9 -5.774 -4.638 0.284
75 H LEU 10 H LEU 10 -2.551 -4.821 -0.235
76 HA LEU 10 HA LEU 10 -2.271 -7.131 1.595
77 1HB LEU 10 2HB LEU 10 -0.156 -6.127 -0.321
78 2HB LEU 10 1HB LEU 10 -0.412 -7.768 0.270
79 HG LEU 10 HG LEU 10 -2.281 -6.256 -1.581
80 1HD1 LEU 10 1HD1 LEU 10 -0.397 -8.580 -2.077
81 2HD1 LEU 10 2HD1 LEU 10 -0.194 -6.936 -2.683
82 3HD1 LEU 10 3HD1 LEU 10 -1.539 -7.925 -3.250
83 1HD2 LEU 10 1HD2 LEU 10 -3.289 -8.601 -1.783
84 2HD2 LEU 10 2HD2 LEU 10 -3.583 -7.765 -0.257
85 3HD2 LEU 10 3HD2 LEU 10 -2.349 -9.021 -0.352
86 H PHE 11 H PHE 11 -2.037 -3.981 2.047
87 HA PHE 11 HA PHE 11 0.240 -4.207 3.975
88 1HB PHE 11 2HB PHE 11 -0.219 -2.052 1.895
89 2HB PHE 11 1HB PHE 11 0.800 -1.797 3.292
90 HD1 PHE 11 1HD PHE 11 0.445 -3.530 0.090
91 HD2 PHE 11 2HD PHE 11 2.886 -3.110 3.599
92 HE1 PHE 11 1HE PHE 11 2.310 -4.679 -1.072
93 HE2 PHE 11 2HE PHE 11 4.751 -4.259 2.439
94 HZ PHE 11 HZ PHE 11 4.463 -5.044 0.104
Start of MODEL 8
1 1H ILE 1 1HT ILE 1 3.454 7.141 -1.759
2 2H ILE 1 2HT ILE 1 4.244 7.280 -3.257
3 3H ILE 1 3HT ILE 1 4.782 6.147 -2.110
4 HA ILE 1 HA ILE 1 2.290 6.083 -3.704
5 HB ILE 1 HB ILE 1 3.145 4.034 -4.559
6 1HG1 ILE 1 2HG1 ILE 1 5.356 4.235 -2.472
7 2HG1 ILE 1 1HG1 ILE 1 4.045 3.063 -2.495
8 1HG2 ILE 1 1HG2 ILE 1 5.105 4.744 -5.697
9 2HG2 ILE 1 2HG2 ILE 1 5.602 5.778 -4.357
10 3HG2 ILE 1 3HG2 ILE 1 4.215 6.226 -5.348
11 1HD1 ILE 1 1HD1 ILE 1 4.879 2.412 -4.834
12 2HD1 ILE 1 2HD1 ILE 1 5.903 1.945 -3.476
13 3HD1 ILE 1 3HD1 ILE 1 6.323 3.351 -4.453
14 H ARG 2 H ARG 2 2.869 6.160 -0.594
15 HA ARG 2 HA ARG 2 2.223 3.649 0.516
16 1HB ARG 2 2HB ARG 2 2.952 5.629 1.836
17 2HB ARG 2 1HB ARG 2 1.365 6.354 1.574
18 1HG ARG 2 2HG ARG 2 0.268 4.548 2.749
19 2HG ARG 2 1HG ARG 2 1.777 3.642 2.858
20 1HD ARG 2 2HD ARG 2 1.386 4.720 4.993
21 2HD ARG 2 1HD ARG 2 2.739 5.533 4.205
22 HE ARG 2 HE ARG 2 0.545 7.019 3.417
23 1HH1 ARG 2 1HH2 ARG 2 1.842 5.878 6.399
24 2HH1 ARG 2 2HH2 ARG 2 1.265 7.226 7.321
25 1HH2 ARG 2 1HH1 ARG 2 -0.218 8.790 4.606
26 2HH2 ARG 2 2HH1 ARG 2 0.100 8.875 6.307
27 H GLU 3 H GLU 3 0.092 6.020 -0.977
28 HA GLU 3 HA GLU 3 -2.322 4.666 -0.003
29 1HB GLU 3 2HB GLU 3 -3.517 6.171 -1.622
30 2HB GLU 3 1HB GLU 3 -2.505 7.052 -0.483
31 1HG GLU 3 2HG GLU 3 -1.432 6.222 -3.184
32 2HG GLU 3 1HG GLU 3 -2.371 7.701 -2.998
33 H ASN 4 H ASN 4 -0.127 4.236 -2.592
34 HA ASN 4 HA ASN 4 -1.966 2.855 -4.365
35 1HB ASN 4 2HB ASN 4 0.320 3.883 -4.980
36 2HB ASN 4 1HB ASN 4 1.028 2.431 -4.270
37 1HD2 ASN 4 1HD2 ASN 4 -0.471 3.709 -7.112
38 2HD2 ASN 4 2HD2 ASN 4 -0.610 2.245 -7.959
39 H LEU 5 H LEU 5 0.616 1.744 -2.136
40 HA LEU 5 HA LEU 5 -0.023 -1.037 -2.331
41 1HB LEU 5 2HB LEU 5 1.089 0.456 0.068
42 2HB LEU 5 1HB LEU 5 1.187 -1.281 -0.201
43 HG LEU 5 HG LEU 5 2.355 0.768 -2.104
44 1HD1 LEU 5 1HD1 LEU 5 4.499 0.394 -1.091
45 2HD1 LEU 5 2HD1 LEU 5 3.857 -0.886 -0.063
46 3HD1 LEU 5 3HD1 LEU 5 3.386 0.789 0.218
47 1HD2 LEU 5 1HD2 LEU 5 2.078 -1.263 -3.278
48 2HD2 LEU 5 2HD2 LEU 5 2.464 -2.243 -1.864
49 3HD2 LEU 5 3HD2 LEU 5 3.738 -1.358 -2.699
50 H LYS 6 H LYS 6 -1.282 1.595 -0.372
51 HA LYS 6 HA LYS 6 -2.871 0.104 1.441
52 1HB LYS 6 2HB LYS 6 -2.392 2.631 1.390
53 2HB LYS 6 1HB LYS 6 -3.709 2.739 0.221
54 1HG LYS 6 2HG LYS 6 -5.269 1.784 1.818
55 2HG LYS 6 1HG LYS 6 -3.967 1.492 2.972
56 1HD LYS 6 2HD LYS 6 -3.626 3.818 3.338
57 2HD LYS 6 1HD LYS 6 -4.585 4.260 1.926
58 1HE LYS 6 2HE LYS 6 -5.806 2.740 4.231
59 2HE LYS 6 1HE LYS 6 -5.702 4.501 4.242
60 1HZ LYS 6 1HZ LYS 6 -6.710 3.363 1.786
61 2HZ LYS 6 2HZ LYS 6 -7.274 4.692 2.684
62 3HZ LYS 6 3HZ LYS 6 -7.707 3.111 3.135
63 H ASP 7 H ASP 7 -3.455 1.197 -1.870
64 HA ASP 7 HA ASP 7 -6.209 0.374 -2.018
65 1HB ASP 7 2HB ASP 7 -4.214 0.525 -4.294
66 2HB ASP 7 1HB ASP 7 -5.969 0.660 -4.406
67 H SER 8 H SER 8 -3.129 -1.262 -2.608
68 HA SER 8 HA SER 8 -4.247 -3.649 -3.744
69 1HB SER 8 2HB SER 8 -2.108 -4.634 -3.343
70 2HB SER 8 1HB SER 8 -1.789 -2.939 -3.703
71 HG SER 8 HG SER 8 -2.207 -3.833 -1.058
72 H GLY 9 H GLY 9 -3.775 -2.544 -0.416
73 1HA GLY 9 2HA GLY 9 -4.887 -3.349 1.529
74 2HA GLY 9 1HA GLY 9 -5.706 -4.529 0.511
75 H LEU 10 H LEU 10 -2.485 -4.759 -0.206
76 HA LEU 10 HA LEU 10 -2.173 -7.155 1.521
77 1HB LEU 10 2HB LEU 10 -0.259 -6.136 -0.592
78 2HB LEU 10 1HB LEU 10 -0.380 -7.770 0.062
79 HG LEU 10 HG LEU 10 -2.523 -6.374 -1.572
80 1HD1 LEU 10 1HD1 LEU 10 -1.901 -7.836 -3.370
81 2HD1 LEU 10 2HD1 LEU 10 -0.796 -8.738 -2.334
82 3HD1 LEU 10 3HD1 LEU 10 -0.417 -7.079 -2.796
83 1HD2 LEU 10 1HD2 LEU 10 -2.340 -9.077 -0.231
84 2HD2 LEU 10 2HD2 LEU 10 -3.398 -8.817 -1.618
85 3HD2 LEU 10 3HD2 LEU 10 -3.643 -7.890 -0.140
86 H PHE 11 H PHE 11 -1.863 -4.113 2.206
87 HA PHE 11 HA PHE 11 0.629 -4.458 3.821
88 1HB PHE 11 2HB PHE 11 -0.026 -2.208 1.906
89 2HB PHE 11 1HB PHE 11 1.080 -1.970 3.238
90 HD1 PHE 11 1HD PHE 11 0.516 -3.720 0.053
91 HD2 PHE 11 2HD PHE 11 3.251 -3.110 3.309
92 HE1 PHE 11 1HE PHE 11 2.328 -4.769 -1.274
93 HE2 PHE 11 2HE PHE 11 5.065 -4.160 1.981
94 HZ PHE 11 HZ PHE 11 4.603 -4.989 -0.310
Start of MODEL 9
1 1H ILE 1 1HT ILE 1 3.632 3.158 -2.934
2 2H ILE 1 2HT ILE 1 4.611 4.229 -3.818
3 3H ILE 1 3HT ILE 1 3.008 3.939 -4.303
4 HA ILE 1 HA ILE 1 4.044 5.652 -2.205
5 HB ILE 1 HB ILE 1 1.940 5.596 -4.323
6 1HG1 ILE 1 2HG1 ILE 1 3.712 7.833 -3.285
7 2HG1 ILE 1 1HG1 ILE 1 4.165 6.733 -4.582
8 1HG2 ILE 1 1HG2 ILE 1 0.877 7.689 -3.258
9 2HG2 ILE 1 2HG2 ILE 1 1.660 7.186 -1.763
10 3HG2 ILE 1 3HG2 ILE 1 0.471 6.139 -2.533
11 1HD1 ILE 1 1HD1 ILE 1 3.286 8.828 -5.515
12 2HD1 ILE 1 2HD1 ILE 1 1.787 8.617 -4.611
13 3HD1 ILE 1 3HD1 ILE 1 2.207 7.487 -5.899
14 H ARG 2 H ARG 2 2.712 6.152 -0.324
15 HA ARG 2 HA ARG 2 1.866 3.874 1.116
16 1HB ARG 2 2HB ARG 2 2.511 6.077 2.116
17 2HB ARG 2 1HB ARG 2 0.961 6.727 1.584
18 1HG ARG 2 2HG ARG 2 -0.216 5.008 2.915
19 2HG ARG 2 1HG ARG 2 1.338 4.376 3.462
20 1HD ARG 2 2HD ARG 2 1.826 6.750 4.309
21 2HD ARG 2 1HD ARG 2 0.105 7.068 4.061
22 HE ARG 2 HE ARG 2 0.137 4.750 5.576
23 1HH1 ARG 2 1HH2 ARG 2 1.519 7.901 5.790
24 2HH1 ARG 2 2HH2 ARG 2 1.516 7.931 7.522
25 1HH2 ARG 2 1HH1 ARG 2 0.124 4.771 7.838
26 2HH2 ARG 2 2HH1 ARG 2 0.726 6.159 8.681
27 H GLU 3 H GLU 3 -0.033 6.137 -0.839
28 HA GLU 3 HA GLU 3 -2.549 4.821 -0.092
29 1HB GLU 3 2HB GLU 3 -2.601 7.219 -0.584
30 2HB GLU 3 1HB GLU 3 -1.934 6.928 -2.192
31 1HG GLU 3 2HG GLU 3 -3.907 5.847 -2.939
32 2HG GLU 3 1HG GLU 3 -4.514 5.631 -1.298
33 H ASN 4 H ASN 4 -0.168 4.472 -2.626
34 HA ASN 4 HA ASN 4 -1.928 3.037 -4.434
35 1HB ASN 4 2HB ASN 4 1.051 3.385 -4.168
36 2HB ASN 4 1HB ASN 4 0.446 2.082 -5.189
37 1HD2 ASN 4 1HD2 ASN 4 1.808 4.696 -5.949
38 2HD2 ASN 4 2HD2 ASN 4 0.744 5.429 -7.049
39 H LEU 5 H LEU 5 0.523 2.011 -2.039
40 HA LEU 5 HA LEU 5 -0.022 -0.785 -2.257
41 1HB LEU 5 2HB LEU 5 0.880 0.728 0.214
42 2HB LEU 5 1HB LEU 5 1.086 -0.994 -0.090
43 HG LEU 5 HG LEU 5 2.238 1.083 -1.960
44 1HD1 LEU 5 1HD1 LEU 5 3.215 1.626 0.161
45 2HD1 LEU 5 2HD1 LEU 5 4.405 0.654 -0.704
46 3HD1 LEU 5 3HD1 LEU 5 3.426 -0.076 0.569
47 1HD2 LEU 5 1HD2 LEU 5 2.184 -1.152 -2.875
48 2HD2 LEU 5 2HD2 LEU 5 2.814 -1.837 -1.378
49 3HD2 LEU 5 3HD2 LEU 5 3.844 -0.826 -2.386
50 H LYS 6 H LYS 6 -1.442 1.793 -0.277
51 HA LYS 6 HA LYS 6 -3.073 0.226 1.407
52 1HB LYS 6 2HB LYS 6 -2.758 2.776 1.419
53 2HB LYS 6 1HB LYS 6 -4.020 2.822 0.184
54 1HG LYS 6 2HG LYS 6 -5.566 1.650 1.696
55 2HG LYS 6 1HG LYS 6 -4.302 1.523 2.912
56 1HD LYS 6 2HD LYS 6 -5.603 3.395 3.584
57 2HD LYS 6 1HD LYS 6 -4.158 4.078 2.846
58 1HE LYS 6 2HE LYS 6 -5.317 4.858 0.984
59 2HE LYS 6 1HE LYS 6 -6.555 3.606 1.092
60 1HZ LYS 6 1HZ LYS 6 -7.818 5.005 2.210
61 2HZ LYS 6 2HZ LYS 6 -6.620 6.205 2.116
62 3HZ LYS 6 3HZ LYS 6 -6.646 5.128 3.431
63 H ASP 7 H ASP 7 -3.538 1.241 -1.957
64 HA ASP 7 HA ASP 7 -6.261 0.304 -2.180
65 1HB ASP 7 2HB ASP 7 -4.091 0.885 -4.206
66 2HB ASP 7 1HB ASP 7 -5.667 0.260 -4.689
67 H SER 8 H SER 8 -3.084 -1.194 -2.592
68 HA SER 8 HA SER 8 -4.058 -3.649 -3.739
69 1HB SER 8 2HB SER 8 -1.883 -4.508 -3.302
70 2HB SER 8 1HB SER 8 -1.634 -2.795 -3.627
71 HG SER 8 HG SER 8 -2.193 -3.168 -1.031
72 H GLY 9 H GLY 9 -3.654 -2.487 -0.416
73 1HA GLY 9 2HA GLY 9 -4.738 -3.294 1.533
74 2HA GLY 9 1HA GLY 9 -5.544 -4.498 0.530
75 H LEU 10 H LEU 10 -2.375 -4.761 -0.264
76 HA LEU 10 HA LEU 10 -2.002 -7.098 1.525
77 1HB LEU 10 2HB LEU 10 -0.118 -6.139 -0.641
78 2HB LEU 10 1HB LEU 10 -0.260 -7.759 0.040
79 HG LEU 10 HG LEU 10 -2.402 -6.359 -1.590
80 1HD1 LEU 10 1HD1 LEU 10 -1.815 -7.891 -3.367
81 2HD1 LEU 10 2HD1 LEU 10 -0.648 -8.715 -2.333
82 3HD1 LEU 10 3HD1 LEU 10 -0.345 -7.059 -2.858
83 1HD2 LEU 10 1HD2 LEU 10 -3.491 -7.869 -0.108
84 2HD2 LEU 10 2HD2 LEU 10 -2.209 -9.070 -0.258
85 3HD2 LEU 10 3HD2 LEU 10 -3.308 -8.777 -1.608
86 H PHE 11 H PHE 11 -1.665 -4.017 2.082
87 HA PHE 11 HA PHE 11 0.873 -4.314 3.644
88 1HB PHE 11 2HB PHE 11 0.110 -2.092 1.737
89 2HB PHE 11 1HB PHE 11 1.281 -1.842 3.008
90 HD1 PHE 11 1HD PHE 11 0.563 -3.631 -0.128
91 HD2 PHE 11 2HD PHE 11 3.464 -2.955 2.967
92 HE1 PHE 11 1HE PHE 11 2.314 -4.675 -1.540
93 HE2 PHE 11 2HE PHE 11 5.213 -3.999 1.554
94 HZ PHE 11 HZ PHE 11 4.640 -4.860 -0.700
Start of MODEL 10
1 1H ILE 1 1HT ILE 1 1.618 7.081 -2.821
2 2H ILE 1 2HT ILE 1 1.374 5.732 -3.822
3 3H ILE 1 3HT ILE 1 2.478 6.941 -4.274
4 HA ILE 1 HA ILE 1 3.751 5.142 -3.485
5 HB ILE 1 HB ILE 1 3.495 7.315 -1.373
6 1HG1 ILE 1 2HG1 ILE 1 5.132 7.050 -3.907
7 2HG1 ILE 1 1HG1 ILE 1 3.876 8.235 -3.563
8 1HG2 ILE 1 1HG2 ILE 1 5.694 6.721 -0.648
9 2HG2 ILE 1 2HG2 ILE 1 5.945 5.650 -2.022
10 3HG2 ILE 1 3HG2 ILE 1 4.841 5.185 -0.734
11 1HD1 ILE 1 1HD1 ILE 1 5.339 8.938 -1.557
12 2HD1 ILE 1 2HD1 ILE 1 5.922 9.382 -3.162
13 3HD1 ILE 1 3HD1 ILE 1 6.622 7.999 -2.321
14 H ARG 2 H ARG 2 2.809 6.052 -0.265
15 HA ARG 2 HA ARG 2 2.311 3.318 0.502
16 1HB ARG 2 2HB ARG 2 3.105 5.247 2.009
17 2HB ARG 2 1HB ARG 2 1.419 5.757 2.055
18 1HG ARG 2 2HG ARG 2 0.912 3.297 2.735
19 2HG ARG 2 1HG ARG 2 2.636 3.196 3.090
20 1HD ARG 2 2HD ARG 2 2.408 5.172 4.592
21 2HD ARG 2 1HD ARG 2 0.671 5.166 4.291
22 HE ARG 2 HE ARG 2 1.223 2.585 5.162
23 1HH1 ARG 2 1HH2 ARG 2 1.763 5.797 6.286
24 2HH1 ARG 2 2HH2 ARG 2 1.696 5.365 7.963
25 1HH2 ARG 2 1HH1 ARG 2 1.134 1.999 7.343
26 2HH2 ARG 2 2HH1 ARG 2 1.343 3.213 8.561
27 H GLU 3 H GLU 3 0.389 5.805 -0.889
28 HA GLU 3 HA GLU 3 -2.166 4.686 0.019
29 1HB GLU 3 2HB GLU 3 -1.824 7.144 -0.591
30 2HB GLU 3 1HB GLU 3 -1.704 6.624 -2.272
31 1HG GLU 3 2HG GLU 3 -3.951 5.686 -2.191
32 2HG GLU 3 1HG GLU 3 -4.076 6.050 -0.470
33 H ASN 4 H ASN 4 0.070 4.233 -2.597
34 HA ASN 4 HA ASN 4 -1.797 2.864 -4.356
35 1HB ASN 4 2HB ASN 4 1.204 3.088 -4.161
36 2HB ASN 4 1HB ASN 4 0.507 1.833 -5.186
37 1HD2 ASN 4 1HD2 ASN 4 0.956 2.769 -7.248
38 2HD2 ASN 4 2HD2 ASN 4 0.328 4.265 -7.746
39 H LEU 5 H LEU 5 0.693 1.802 -2.022
40 HA LEU 5 HA LEU 5 0.100 -0.987 -2.158
41 1HB LEU 5 2HB LEU 5 1.018 0.566 0.282
42 2HB LEU 5 1HB LEU 5 1.237 -1.155 -0.006
43 HG LEU 5 HG LEU 5 2.389 0.963 -1.843
44 1HD1 LEU 5 1HD1 LEU 5 3.253 1.175 0.512
45 2HD1 LEU 5 2HD1 LEU 5 4.491 0.732 -0.663
46 3HD1 LEU 5 3HD1 LEU 5 3.807 -0.496 0.403
47 1HD2 LEU 5 1HD2 LEU 5 2.292 -1.192 -2.897
48 2HD2 LEU 5 2HD2 LEU 5 2.842 -2.007 -1.434
49 3HD2 LEU 5 3HD2 LEU 5 3.953 -0.989 -2.346
50 H LYS 6 H LYS 6 -1.265 1.677 -0.301
51 HA LYS 6 HA LYS 6 -2.933 0.231 1.472
52 1HB LYS 6 2HB LYS 6 -2.486 2.744 1.402
53 2HB LYS 6 1HB LYS 6 -3.720 2.829 0.145
54 1HG LYS 6 2HG LYS 6 -5.227 1.542 1.807
55 2HG LYS 6 1HG LYS 6 -4.031 1.978 3.027
56 1HD LYS 6 2HD LYS 6 -4.311 4.380 2.367
57 2HD LYS 6 1HD LYS 6 -5.613 3.887 1.284
58 1HE LYS 6 2HE LYS 6 -5.550 3.409 4.279
59 2HE LYS 6 1HE LYS 6 -6.497 4.654 3.465
60 1HZ LYS 6 1HZ LYS 6 -6.900 2.075 2.314
61 2HZ LYS 6 2HZ LYS 6 -8.043 3.183 2.907
62 3HZ LYS 6 3HZ LYS 6 -7.289 2.086 3.965
63 H ASP 7 H ASP 7 -3.370 1.171 -1.910
64 HA ASP 7 HA ASP 7 -6.137 0.401 -2.122
65 1HB ASP 7 2HB ASP 7 -4.019 0.485 -4.294
66 2HB ASP 7 1HB ASP 7 -5.766 0.503 -4.540
67 H SER 8 H SER 8 -3.079 -1.329 -2.788
68 HA SER 8 HA SER 8 -4.291 -3.729 -3.750
69 1HB SER 8 2HB SER 8 -2.164 -4.820 -3.026
70 2HB SER 8 1HB SER 8 -1.889 -3.359 -3.971
71 HG SER 8 HG SER 8 -1.729 -2.261 -1.901
72 H GLY 9 H GLY 9 -3.774 -2.496 -0.486
73 1HA GLY 9 2HA GLY 9 -4.871 -3.191 1.497
74 2HA GLY 9 1HA GLY 9 -5.724 -4.404 0.547
75 H LEU 10 H LEU 10 -2.598 -4.834 -0.284
76 HA LEU 10 HA LEU 10 -2.280 -7.102 1.593
77 1HB LEU 10 2HB LEU 10 -0.460 -6.215 -0.666
78 2HB LEU 10 1HB LEU 10 -0.443 -7.775 0.152
79 HG LEU 10 HG LEU 10 -2.776 -6.691 -1.456
80 1HD1 LEU 10 1HD1 LEU 10 -0.986 -7.202 -2.974
81 2HD1 LEU 10 2HD1 LEU 10 -2.103 -8.566 -3.029
82 3HD1 LEU 10 3HD1 LEU 10 -0.602 -8.693 -2.113
83 1HD2 LEU 10 1HD2 LEU 10 -3.382 -9.234 -1.278
84 2HD2 LEU 10 2HD2 LEU 10 -3.697 -8.194 0.109
85 3HD2 LEU 10 3HD2 LEU 10 -2.274 -9.235 0.093
86 H PHE 11 H PHE 11 -1.878 -4.022 2.058
87 HA PHE 11 HA PHE 11 0.637 -4.330 3.650
88 1HB PHE 11 2HB PHE 11 -0.055 -2.092 1.726
89 2HB PHE 11 1HB PHE 11 1.187 -1.945 2.942
90 HD1 PHE 11 1HD PHE 11 0.221 -3.573 -0.203
91 HD2 PHE 11 2HD PHE 11 3.248 -3.292 2.834
92 HE1 PHE 11 1HE PHE 11 1.832 -4.728 -1.698
93 HE2 PHE 11 2HE PHE 11 4.852 -4.449 1.341
94 HZ PHE 11 HZ PHE 11 4.146 -5.167 -0.925
Start of MODEL 11
1 1H ILE 1 1HT ILE 1 2.671 4.009 -4.508
2 2H ILE 1 2HT ILE 1 3.582 3.355 -3.231
3 3H ILE 1 3HT ILE 1 4.302 4.437 -4.326
4 HA ILE 1 HA ILE 1 3.926 5.828 -2.589
5 HB ILE 1 HB ILE 1 1.717 5.765 -4.590
6 1HG1 ILE 1 2HG1 ILE 1 3.474 8.029 -3.583
7 2HG1 ILE 1 1HG1 ILE 1 3.899 6.963 -4.918
8 1HG2 ILE 1 1HG2 ILE 1 0.300 6.244 -2.741
9 2HG2 ILE 1 2HG2 ILE 1 0.648 7.818 -3.445
10 3HG2 ILE 1 3HG2 ILE 1 1.495 7.297 -1.990
11 1HD1 ILE 1 1HD1 ILE 1 2.949 9.023 -5.812
12 2HD1 ILE 1 2HD1 ILE 1 1.513 8.832 -4.806
13 3HD1 ILE 1 3HD1 ILE 1 1.832 7.691 -6.114
14 H ARG 2 H ARG 2 2.820 6.305 -0.589
15 HA ARG 2 HA ARG 2 2.031 4.089 0.935
16 1HB ARG 2 2HB ARG 2 1.552 7.048 1.221
17 2HB ARG 2 1HB ARG 2 0.825 5.929 2.374
18 1HG ARG 2 2HG ARG 2 2.969 5.079 3.036
19 2HG ARG 2 1HG ARG 2 3.779 5.911 1.708
20 1HD ARG 2 2HD ARG 2 3.613 7.999 2.738
21 2HD ARG 2 1HD ARG 2 2.218 7.528 3.711
22 HE ARG 2 HE ARG 2 4.248 5.907 4.659
23 1HH1 ARG 2 1HH2 ARG 2 3.803 9.284 4.119
24 2HH1 ARG 2 2HH2 ARG 2 4.832 9.763 5.426
25 1HH2 ARG 2 1HH1 ARG 2 5.594 6.515 6.368
26 2HH2 ARG 2 2HH1 ARG 2 5.844 8.196 6.700
27 H GLU 3 H GLU 3 0.002 6.289 -0.963
28 HA GLU 3 HA GLU 3 -2.458 4.954 -0.118
29 1HB GLU 3 2HB GLU 3 -2.570 7.307 -0.751
30 2HB GLU 3 1HB GLU 3 -1.907 6.941 -2.348
31 1HG GLU 3 2HG GLU 3 -3.872 5.679 -2.951
32 2HG GLU 3 1HG GLU 3 -4.498 5.765 -1.304
33 H ASN 4 H ASN 4 -0.086 4.457 -2.612
34 HA ASN 4 HA ASN 4 -1.817 2.894 -4.341
35 1HB ASN 4 2HB ASN 4 1.182 3.115 -4.023
36 2HB ASN 4 1HB ASN 4 0.470 1.913 -5.098
37 1HD2 ASN 4 1HD2 ASN 4 1.428 3.103 -6.955
38 2HD2 ASN 4 2HD2 ASN 4 0.697 4.529 -7.516
39 H LEU 5 H LEU 5 0.589 2.054 -1.831
40 HA LEU 5 HA LEU 5 0.159 -0.752 -1.866
41 1HB LEU 5 2HB LEU 5 0.916 1.070 0.439
42 2HB LEU 5 1HB LEU 5 1.046 -0.684 0.478
43 HG LEU 5 HG LEU 5 2.382 0.836 -1.758
44 1HD1 LEU 5 1HD1 LEU 5 3.142 1.989 0.256
45 2HD1 LEU 5 2HD1 LEU 5 4.439 0.960 -0.352
46 3HD1 LEU 5 3HD1 LEU 5 3.485 0.448 1.041
47 1HD2 LEU 5 1HD2 LEU 5 3.051 -1.706 -0.236
48 2HD2 LEU 5 2HD2 LEU 5 3.960 -1.069 -1.606
49 3HD2 LEU 5 3HD2 LEU 5 2.305 -1.633 -1.830
50 H LYS 6 H LYS 6 -1.389 1.786 0.104
51 HA LYS 6 HA LYS 6 -3.080 0.176 1.667
52 1HB LYS 6 2HB LYS 6 -3.433 2.937 0.509
53 2HB LYS 6 1HB LYS 6 -4.684 2.204 1.507
54 1HG LYS 6 2HG LYS 6 -2.976 1.840 3.302
55 2HG LYS 6 1HG LYS 6 -1.805 2.714 2.318
56 1HD LYS 6 2HD LYS 6 -3.510 4.632 2.275
57 2HD LYS 6 1HD LYS 6 -4.345 3.769 3.566
58 1HE LYS 6 2HE LYS 6 -2.901 5.277 4.696
59 2HE LYS 6 1HE LYS 6 -2.070 3.724 4.774
60 1HZ LYS 6 1HZ LYS 6 -0.375 4.585 3.669
61 2HZ LYS 6 2HZ LYS 6 -1.138 6.102 3.677
62 3HZ LYS 6 3HZ LYS 6 -1.383 5.034 2.378
63 H ASP 7 H ASP 7 -3.435 1.224 -1.700
64 HA ASP 7 HA ASP 7 -6.143 0.274 -2.015
65 1HB ASP 7 2HB ASP 7 -3.951 0.780 -4.047
66 2HB ASP 7 1HB ASP 7 -5.616 0.384 -4.470
67 H SER 8 H SER 8 -2.959 -1.191 -2.740
68 HA SER 8 HA SER 8 -3.914 -3.601 -3.868
69 1HB SER 8 2HB SER 8 -1.781 -4.583 -3.122
70 2HB SER 8 1HB SER 8 -1.519 -2.979 -3.798
71 HG SER 8 HG SER 8 -1.996 -3.352 -1.042
72 H GLY 9 H GLY 9 -3.713 -2.576 -0.491
73 1HA GLY 9 2HA GLY 9 -4.917 -3.478 1.347
74 2HA GLY 9 1HA GLY 9 -5.609 -4.674 0.252
75 H LEU 10 H LEU 10 -2.426 -4.852 -0.387
76 HA LEU 10 HA LEU 10 -2.069 -7.214 1.359
77 1HB LEU 10 2HB LEU 10 -0.098 -6.106 -0.658
78 2HB LEU 10 1HB LEU 10 -0.198 -7.753 -0.036
79 HG LEU 10 HG LEU 10 -2.336 -6.419 -1.728
80 1HD1 LEU 10 1HD1 LEU 10 -0.145 -6.891 -2.901
81 2HD1 LEU 10 2HD1 LEU 10 -1.530 -7.762 -3.560
82 3HD1 LEU 10 3HD1 LEU 10 -0.379 -8.595 -2.515
83 1HD2 LEU 10 1HD2 LEU 10 -3.355 -8.104 -0.380
84 2HD2 LEU 10 2HD2 LEU 10 -1.978 -9.190 -0.563
85 3HD2 LEU 10 3HD2 LEU 10 -3.048 -8.884 -1.931
86 H PHE 11 H PHE 11 -1.865 -4.146 2.038
87 HA PHE 11 HA PHE 11 0.575 -4.429 3.747
88 1HB PHE 11 2HB PHE 11 -0.108 -2.193 1.833
89 2HB PHE 11 1HB PHE 11 0.969 -1.933 3.183
90 HD1 PHE 11 1HD PHE 11 0.528 -3.613 -0.051
91 HD2 PHE 11 2HD PHE 11 3.150 -3.080 3.309
92 HE1 PHE 11 1HE PHE 11 2.395 -4.600 -1.351
93 HE2 PHE 11 2HE PHE 11 5.016 -4.066 2.008
94 HZ PHE 11 HZ PHE 11 4.639 -4.827 -0.323
Start of MODEL 12
1 1H ILE 1 1HT ILE 1 4.883 6.618 -1.837
2 2H ILE 1 2HT ILE 1 3.424 6.693 -0.967
3 3H ILE 1 3HT ILE 1 3.641 7.652 -2.353
4 HA ILE 1 HA ILE 1 2.702 6.074 -3.552
5 HB ILE 1 HB ILE 1 5.139 5.527 -3.833
6 1HG1 ILE 1 2HG1 ILE 1 3.248 3.151 -3.928
7 2HG1 ILE 1 1HG1 ILE 1 3.377 4.397 -5.170
8 1HG2 ILE 1 1HG2 ILE 1 6.111 3.687 -2.638
9 2HG2 ILE 1 2HG2 ILE 1 4.559 3.257 -1.917
10 3HG2 ILE 1 3HG2 ILE 1 5.378 4.741 -1.429
11 1HD1 ILE 1 1HD1 ILE 1 5.868 3.788 -5.292
12 2HD1 ILE 1 2HD1 ILE 1 4.734 2.607 -5.949
13 3HD1 ILE 1 3HD1 ILE 1 5.448 2.353 -4.356
14 H ARG 2 H ARG 2 3.032 5.616 -0.220
15 HA ARG 2 HA ARG 2 1.964 3.085 0.319
16 1HB ARG 2 2HB ARG 2 1.147 5.660 1.696
17 2HB ARG 2 1HB ARG 2 1.070 4.036 2.379
18 1HG ARG 2 2HG ARG 2 3.493 3.829 2.287
19 2HG ARG 2 1HG ARG 2 3.630 5.382 1.468
20 1HD ARG 2 2HD ARG 2 2.193 6.068 3.736
21 2HD ARG 2 1HD ARG 2 3.263 4.814 4.352
22 HE ARG 2 HE ARG 2 4.038 7.467 3.849
23 1HH1 ARG 2 1HH2 ARG 2 5.028 4.301 2.878
24 2HH1 ARG 2 2HH2 ARG 2 6.635 4.792 2.478
25 1HH2 ARG 2 1HH1 ARG 2 6.131 8.104 3.343
26 2HH2 ARG 2 2HH1 ARG 2 7.261 6.935 2.745
27 H GLU 3 H GLU 3 0.417 5.954 -0.927
28 HA GLU 3 HA GLU 3 -2.285 5.488 -0.600
29 1HB GLU 3 2HB GLU 3 -0.946 7.314 -1.951
30 2HB GLU 3 1HB GLU 3 -1.302 6.293 -3.336
31 1HG GLU 3 2HG GLU 3 -3.740 6.357 -2.654
32 2HG GLU 3 1HG GLU 3 -3.304 7.571 -1.448
33 H ASN 4 H ASN 4 -0.264 4.209 -3.267
34 HA ASN 4 HA ASN 4 -2.342 2.532 -4.343
35 1HB ASN 4 2HB ASN 4 -0.176 3.365 -5.493
36 2HB ASN 4 1HB ASN 4 0.616 2.011 -4.686
37 1HD2 ASN 4 1HD2 ASN 4 -1.127 2.869 -7.488
38 2HD2 ASN 4 2HD2 ASN 4 -1.528 1.305 -8.009
39 H LEU 5 H LEU 5 0.475 1.838 -2.233
40 HA LEU 5 HA LEU 5 0.066 -0.948 -1.975
41 1HB LEU 5 2HB LEU 5 0.960 0.982 0.192
42 2HB LEU 5 1HB LEU 5 1.177 -0.764 0.229
43 HG LEU 5 HG LEU 5 2.357 1.102 -1.855
44 1HD1 LEU 5 1HD1 LEU 5 3.295 1.173 0.529
45 2HD1 LEU 5 2HD1 LEU 5 4.450 0.794 -0.750
46 3HD1 LEU 5 3HD1 LEU 5 3.806 -0.494 0.266
47 1HD2 LEU 5 1HD2 LEU 5 2.336 -1.894 -1.497
48 2HD2 LEU 5 2HD2 LEU 5 3.735 -1.120 -2.242
49 3HD2 LEU 5 3HD2 LEU 5 2.144 -0.950 -2.975
50 H LYS 6 H LYS 6 -1.560 1.748 -0.374
51 HA LYS 6 HA LYS 6 -3.068 0.127 1.470
52 1HB LYS 6 2HB LYS 6 -3.431 2.915 0.360
53 2HB LYS 6 1HB LYS 6 -4.603 2.199 1.467
54 1HG LYS 6 2HG LYS 6 -2.846 1.851 3.145
55 2HG LYS 6 1HG LYS 6 -1.637 2.487 2.033
56 1HD LYS 6 2HD LYS 6 -2.080 4.403 3.272
57 2HD LYS 6 1HD LYS 6 -3.262 4.600 1.982
58 1HE LYS 6 2HE LYS 6 -4.543 4.959 3.916
59 2HE LYS 6 1HE LYS 6 -4.851 3.256 3.573
60 1HZ LYS 6 1HZ LYS 6 -3.399 2.578 5.235
61 2HZ LYS 6 2HZ LYS 6 -4.205 3.898 5.939
62 3HZ LYS 6 3HZ LYS 6 -2.630 4.088 5.331
63 H ASP 7 H ASP 7 -3.643 1.320 -1.816
64 HA ASP 7 HA ASP 7 -6.363 0.371 -2.002
65 1HB ASP 7 2HB ASP 7 -4.342 0.832 -4.222
66 2HB ASP 7 1HB ASP 7 -6.088 0.700 -4.423
67 H SER 8 H SER 8 -3.252 -1.147 -2.242
68 HA SER 8 HA SER 8 -4.213 -3.504 -3.673
69 1HB SER 8 2HB SER 8 -2.021 -4.277 -3.519
70 2HB SER 8 1HB SER 8 -1.755 -2.540 -3.390
71 HG SER 8 HG SER 8 -0.818 -3.103 -1.585
72 H GLY 9 H GLY 9 -3.740 -2.529 -0.298
73 1HA GLY 9 2HA GLY 9 -4.809 -3.464 1.617
74 2HA GLY 9 1HA GLY 9 -5.591 -4.630 0.555
75 H LEU 10 H LEU 10 -2.388 -4.724 -0.222
76 HA LEU 10 HA LEU 10 -1.951 -7.164 1.408
77 1HB LEU 10 2HB LEU 10 -0.219 -5.925 -0.750
78 2HB LEU 10 1HB LEU 10 -0.034 -7.535 -0.059
79 HG LEU 10 HG LEU 10 -2.523 -6.592 -1.513
80 1HD1 LEU 10 1HD1 LEU 10 -0.077 -8.079 -2.481
81 2HD1 LEU 10 2HD1 LEU 10 -0.816 -6.631 -3.165
82 3HD1 LEU 10 3HD1 LEU 10 -1.628 -8.189 -3.312
83 1HD2 LEU 10 1HD2 LEU 10 -1.593 -9.229 -0.358
84 2HD2 LEU 10 2HD2 LEU 10 -2.769 -9.186 -1.672
85 3HD2 LEU 10 3HD2 LEU 10 -3.139 -8.412 -0.135
86 H PHE 11 H PHE 11 -1.713 -4.071 2.084
87 HA PHE 11 HA PHE 11 0.743 -4.390 3.765
88 1HB PHE 11 2HB PHE 11 0.071 -2.122 1.876
89 2HB PHE 11 1HB PHE 11 1.171 -1.903 3.218
90 HD1 PHE 11 1HD PHE 11 0.606 -3.705 0.045
91 HD2 PHE 11 2HD PHE 11 3.381 -2.913 3.227
92 HE1 PHE 11 1HE PHE 11 2.427 -4.720 -1.294
93 HE2 PHE 11 2HE PHE 11 5.205 -3.930 1.889
94 HZ PHE 11 HZ PHE 11 4.728 -4.834 -0.372
Start of MODEL 13
1 1H ILE 1 1HT ILE 1 1.015 6.371 -3.041
2 2H ILE 1 2HT ILE 1 1.846 6.488 -4.520
3 3H ILE 1 3HT ILE 1 2.063 7.675 -3.323
4 HA ILE 1 HA ILE 1 3.502 5.313 -3.715
5 HB ILE 1 HB ILE 1 3.598 7.473 -1.579
6 1HG1 ILE 1 2HG1 ILE 1 4.950 7.158 -4.278
7 2HG1 ILE 1 1HG1 ILE 1 3.768 8.380 -3.817
8 1HG2 ILE 1 1HG2 ILE 1 5.826 5.629 -2.503
9 2HG2 ILE 1 2HG2 ILE 1 4.888 5.329 -1.043
10 3HG2 ILE 1 3HG2 ILE 1 5.875 6.776 -1.169
11 1HD1 ILE 1 1HD1 ILE 1 5.440 9.040 -1.966
12 2HD1 ILE 1 2HD1 ILE 1 5.876 9.466 -3.620
13 3HD1 ILE 1 3HD1 ILE 1 6.613 8.063 -2.849
14 H ARG 2 H ARG 2 2.866 6.296 -0.415
15 HA ARG 2 HA ARG 2 2.477 3.610 0.511
16 1HB ARG 2 2HB ARG 2 1.815 6.297 1.766
17 2HB ARG 2 1HB ARG 2 1.588 4.766 2.602
18 1HG ARG 2 2HG ARG 2 3.725 5.230 3.349
19 2HG ARG 2 1HG ARG 2 4.163 4.420 1.850
20 1HD ARG 2 2HD ARG 2 4.147 6.714 0.743
21 2HD ARG 2 1HD ARG 2 3.993 7.401 2.357
22 HE ARG 2 HE ARG 2 6.184 5.688 2.525
23 1HH1 ARG 2 1HH2 ARG 2 5.186 8.364 0.593
24 2HH1 ARG 2 2HH2 ARG 2 6.801 8.898 0.263
25 1HH2 ARG 2 1HH1 ARG 2 8.296 6.370 2.105
26 2HH2 ARG 2 2HH1 ARG 2 8.561 7.770 1.120
27 H GLU 3 H GLU 3 0.433 5.875 -1.030
28 HA GLU 3 HA GLU 3 -2.063 4.672 -0.034
29 1HB GLU 3 2HB GLU 3 -1.857 7.130 -0.646
30 2HB GLU 3 1HB GLU 3 -1.709 6.623 -2.330
31 1HG GLU 3 2HG GLU 3 -3.902 5.490 -2.178
32 2HG GLU 3 1HG GLU 3 -4.055 6.021 -0.503
33 H ASN 4 H ASN 4 0.174 4.234 -2.650
34 HA ASN 4 HA ASN 4 -1.665 2.857 -4.420
35 1HB ASN 4 2HB ASN 4 1.337 3.025 -4.165
36 2HB ASN 4 1HB ASN 4 0.631 1.779 -5.194
37 1HD2 ASN 4 1HD2 ASN 4 1.080 5.270 -4.821
38 2HD2 ASN 4 2HD2 ASN 4 0.530 5.686 -6.371
39 H LEU 5 H LEU 5 0.734 1.793 -1.989
40 HA LEU 5 HA LEU 5 0.083 -0.990 -2.142
41 1HB LEU 5 2HB LEU 5 1.047 0.569 0.279
42 2HB LEU 5 1HB LEU 5 1.166 -1.174 0.053
43 HG LEU 5 HG LEU 5 2.413 0.741 -1.923
44 1HD1 LEU 5 1HD1 LEU 5 3.409 1.387 0.158
45 2HD1 LEU 5 2HD1 LEU 5 4.562 0.313 -0.633
46 3HD1 LEU 5 3HD1 LEU 5 3.553 -0.290 0.683
47 1HD2 LEU 5 1HD2 LEU 5 2.268 -1.555 -2.680
48 2HD2 LEU 5 2HD2 LEU 5 2.891 -2.153 -1.143
49 3HD2 LEU 5 3HD2 LEU 5 3.943 -1.247 -2.228
50 H LYS 6 H LYS 6 -1.148 1.644 -0.097
51 HA LYS 6 HA LYS 6 -2.878 0.233 1.583
52 1HB LYS 6 2HB LYS 6 -2.432 2.734 1.538
53 2HB LYS 6 1HB LYS 6 -3.631 2.837 0.249
54 1HG LYS 6 2HG LYS 6 -5.329 1.845 1.701
55 2HG LYS 6 1HG LYS 6 -4.143 1.634 2.989
56 1HD LYS 6 2HD LYS 6 -4.566 4.392 1.847
57 2HD LYS 6 1HD LYS 6 -5.757 3.749 2.976
58 1HE LYS 6 2HE LYS 6 -2.777 3.939 3.525
59 2HE LYS 6 1HE LYS 6 -3.996 5.056 4.138
60 1HZ LYS 6 1HZ LYS 6 -3.734 2.163 4.731
61 2HZ LYS 6 2HZ LYS 6 -5.109 3.074 5.136
62 3HZ LYS 6 3HZ LYS 6 -3.602 3.460 5.818
63 H ASP 7 H ASP 7 -3.293 1.125 -1.817
64 HA ASP 7 HA ASP 7 -6.073 0.356 -1.991
65 1HB ASP 7 2HB ASP 7 -3.938 0.588 -4.131
66 2HB ASP 7 1HB ASP 7 -5.654 0.341 -4.455
67 H SER 8 H SER 8 -3.023 -1.338 -2.819
68 HA SER 8 HA SER 8 -4.162 -3.736 -3.763
69 1HB SER 8 2HB SER 8 -2.059 -4.700 -3.415
70 2HB SER 8 1HB SER 8 -1.650 -2.987 -3.479
71 HG SER 8 HG SER 8 -1.376 -4.737 -1.455
72 H GLY 9 H GLY 9 -3.777 -2.569 -0.447
73 1HA GLY 9 2HA GLY 9 -4.990 -3.279 1.462
74 2HA GLY 9 1HA GLY 9 -5.806 -4.471 0.451
75 H LEU 10 H LEU 10 -2.699 -4.974 -0.289
76 HA LEU 10 HA LEU 10 -2.471 -7.247 1.588
77 1HB LEU 10 2HB LEU 10 -0.472 -6.456 -0.542
78 2HB LEU 10 1HB LEU 10 -0.743 -8.051 0.158
79 HG LEU 10 HG LEU 10 -2.711 -6.532 -1.582
80 1HD1 LEU 10 1HD1 LEU 10 -2.170 -8.090 -3.308
81 2HD1 LEU 10 2HD1 LEU 10 -1.248 -9.107 -2.200
82 3HD1 LEU 10 3HD1 LEU 10 -0.623 -7.528 -2.675
83 1HD2 LEU 10 1HD2 LEU 10 -2.816 -9.197 -0.152
84 2HD2 LEU 10 2HD2 LEU 10 -3.839 -8.852 -1.547
85 3HD2 LEU 10 3HD2 LEU 10 -3.983 -7.876 -0.085
86 H PHE 11 H PHE 11 -1.966 -4.161 2.036
87 HA PHE 11 HA PHE 11 0.480 -4.555 3.719
88 1HB PHE 11 2HB PHE 11 -0.041 -2.342 1.717
89 2HB PHE 11 1HB PHE 11 1.132 -2.186 2.999
90 HD1 PHE 11 1HD PHE 11 0.329 -3.821 -0.171
91 HD2 PHE 11 2HD PHE 11 3.133 -3.656 3.079
92 HE1 PHE 11 1HE PHE 11 1.981 -5.076 -1.531
93 HE2 PHE 11 2HE PHE 11 4.784 -4.910 1.718
94 HZ PHE 11 HZ PHE 11 4.208 -5.618 -0.588
Start of MODEL 14
1 1H ILE 1 1HT ILE 1 3.561 6.640 -1.069
2 2H ILE 1 2HT ILE 1 3.592 7.603 -2.467
3 3H ILE 1 3HT ILE 1 4.923 6.620 -2.079
4 HA ILE 1 HA ILE 1 2.706 5.993 -3.648
5 HB ILE 1 HB ILE 1 5.112 5.352 -3.925
6 1HG1 ILE 1 2HG1 ILE 1 3.188 3.000 -3.856
7 2HG1 ILE 1 1HG1 ILE 1 3.226 4.208 -5.136
8 1HG2 ILE 1 1HG2 ILE 1 5.322 4.671 -1.466
9 2HG2 ILE 1 2HG2 ILE 1 6.057 3.568 -2.629
10 3HG2 ILE 1 3HG2 ILE 1 4.496 3.177 -1.907
11 1HD1 ILE 1 1HD1 ILE 1 5.383 3.528 -5.860
12 2HD1 ILE 1 2HD1 ILE 1 4.519 2.023 -5.556
13 3HD1 ILE 1 3HD1 ILE 1 5.686 2.619 -4.381
14 H ARG 2 H ARG 2 3.050 5.661 -0.298
15 HA ARG 2 HA ARG 2 1.919 3.197 0.365
16 1HB ARG 2 2HB ARG 2 2.620 5.132 1.923
17 2HB ARG 2 1HB ARG 2 0.995 5.769 1.661
18 1HG ARG 2 2HG ARG 2 0.019 3.679 2.488
19 2HG ARG 2 1HG ARG 2 1.629 2.994 2.705
20 1HD ARG 2 2HD ARG 2 2.126 4.955 4.248
21 2HD ARG 2 1HD ARG 2 0.398 5.326 4.183
22 HE ARG 2 HE ARG 2 0.441 2.668 4.901
23 1HH1 ARG 2 1HH2 ARG 2 1.990 5.543 6.003
24 2HH1 ARG 2 2HH2 ARG 2 2.044 5.039 7.660
25 1HH2 ARG 2 1HH1 ARG 2 0.497 1.994 7.062
26 2HH2 ARG 2 2HH1 ARG 2 1.198 3.032 8.259
27 H GLU 3 H GLU 3 0.420 6.007 -1.072
28 HA GLU 3 HA GLU 3 -2.296 5.515 -0.720
29 1HB GLU 3 2HB GLU 3 -2.674 6.885 -2.585
30 2HB GLU 3 1HB GLU 3 -1.097 7.403 -1.971
31 1HG GLU 3 2HG GLU 3 -0.034 5.869 -3.680
32 2HG GLU 3 1HG GLU 3 -1.641 5.629 -4.370
33 H ASN 4 H ASN 4 -0.158 4.172 -3.244
34 HA ASN 4 HA ASN 4 -2.162 2.470 -4.421
35 1HB ASN 4 2HB ASN 4 0.860 2.512 -4.504
36 2HB ASN 4 1HB ASN 4 -0.072 1.268 -5.339
37 1HD2 ASN 4 1HD2 ASN 4 0.583 4.770 -5.251
38 2HD2 ASN 4 2HD2 ASN 4 -0.064 5.095 -6.786
39 H LEU 5 H LEU 5 0.493 1.857 -2.114
40 HA LEU 5 HA LEU 5 0.058 -0.907 -1.736
41 1HB LEU 5 2HB LEU 5 0.814 1.036 0.465
42 2HB LEU 5 1HB LEU 5 1.218 -0.676 0.368
43 HG LEU 5 HG LEU 5 2.243 1.548 -1.420
44 1HD1 LEU 5 1HD1 LEU 5 3.536 -0.346 0.559
45 2HD1 LEU 5 2HD1 LEU 5 3.428 1.411 0.676
46 3HD1 LEU 5 3HD1 LEU 5 4.446 0.670 -0.558
47 1HD2 LEU 5 1HD2 LEU 5 1.956 -0.258 -2.922
48 2HD2 LEU 5 2HD2 LEU 5 2.360 -1.460 -1.696
49 3HD2 LEU 5 3HD2 LEU 5 3.625 -0.440 -2.382
50 H LYS 6 H LYS 6 -1.548 1.855 -0.152
51 HA LYS 6 HA LYS 6 -3.105 0.279 1.664
52 1HB LYS 6 2HB LYS 6 -3.371 3.043 0.495
53 2HB LYS 6 1HB LYS 6 -4.716 2.370 1.413
54 1HG LYS 6 2HG LYS 6 -3.440 2.196 3.394
55 2HG LYS 6 1HG LYS 6 -1.911 2.357 2.528
56 1HD LYS 6 2HD LYS 6 -2.159 4.670 2.235
57 2HD LYS 6 1HD LYS 6 -3.911 4.610 2.425
58 1HE LYS 6 2HE LYS 6 -2.693 5.610 4.393
59 2HE LYS 6 1HE LYS 6 -3.716 4.233 4.798
60 1HZ LYS 6 1HZ LYS 6 -1.950 2.943 5.274
61 2HZ LYS 6 2HZ LYS 6 -1.188 4.435 5.551
62 3HZ LYS 6 3HZ LYS 6 -0.967 3.628 4.073
63 H ASP 7 H ASP 7 -3.624 1.268 -1.701
64 HA ASP 7 HA ASP 7 -6.345 0.325 -1.878
65 1HB ASP 7 2HB ASP 7 -4.198 0.835 -3.947
66 2HB ASP 7 1HB ASP 7 -5.810 0.265 -4.383
67 H SER 8 H SER 8 -3.251 -1.191 -2.881
68 HA SER 8 HA SER 8 -4.341 -3.628 -3.778
69 1HB SER 8 2HB SER 8 -2.175 -4.525 -3.594
70 2HB SER 8 1HB SER 8 -1.878 -2.800 -3.786
71 HG SER 8 HG SER 8 -1.470 -4.455 -1.624
72 H GLY 9 H GLY 9 -3.654 -2.544 -0.471
73 1HA GLY 9 2HA GLY 9 -4.650 -3.372 1.522
74 2HA GLY 9 1HA GLY 9 -5.521 -4.550 0.546
75 H LEU 10 H LEU 10 -2.335 -4.788 -0.359
76 HA LEU 10 HA LEU 10 -1.976 -7.209 1.296
77 1HB LEU 10 2HB LEU 10 0.036 -6.051 -0.650
78 2HB LEU 10 1HB LEU 10 -0.128 -7.725 -0.122
79 HG LEU 10 HG LEU 10 -2.145 -6.198 -1.799
80 1HD1 LEU 10 1HD1 LEU 10 -0.462 -8.582 -2.600
81 2HD1 LEU 10 2HD1 LEU 10 0.065 -6.922 -2.878
82 3HD1 LEU 10 3HD1 LEU 10 -1.407 -7.520 -3.643
83 1HD2 LEU 10 1HD2 LEU 10 -2.093 -8.991 -0.636
84 2HD2 LEU 10 2HD2 LEU 10 -3.077 -8.593 -2.045
85 3HD2 LEU 10 3HD2 LEU 10 -3.368 -7.779 -0.509
86 H PHE 11 H PHE 11 -1.755 -4.142 2.039
87 HA PHE 11 HA PHE 11 0.572 -4.502 3.876
88 1HB PHE 11 2HB PHE 11 0.152 -2.232 1.915
89 2HB PHE 11 1HB PHE 11 1.199 -2.087 3.305
90 HD1 PHE 11 1HD PHE 11 0.780 -3.518 -0.010
91 HD2 PHE 11 2HD PHE 11 3.205 -3.588 3.534
92 HE1 PHE 11 1HE PHE 11 2.586 -4.651 -1.272
93 HE2 PHE 11 2HE PHE 11 5.014 -4.724 2.273
94 HZ PHE 11 HZ PHE 11 4.705 -5.257 -0.130
Start of MODEL 15
1 1H ILE 1 1HT ILE 1 2.033 7.200 -3.006
2 2H ILE 1 2HT ILE 1 1.365 5.694 -3.424
3 3H ILE 1 3HT ILE 1 2.549 6.406 -4.414
4 HA ILE 1 HA ILE 1 3.929 5.031 -3.337
5 HB ILE 1 HB ILE 1 3.496 7.280 -1.340
6 1HG1 ILE 1 2HG1 ILE 1 5.696 8.021 -2.407
7 2HG1 ILE 1 1HG1 ILE 1 5.403 6.823 -3.655
8 1HG2 ILE 1 1HG2 ILE 1 5.987 6.573 -0.782
9 2HG2 ILE 1 2HG2 ILE 1 5.464 5.000 -1.377
10 3HG2 ILE 1 3HG2 ILE 1 4.643 5.742 -0.005
11 1HD1 ILE 1 1HD1 ILE 1 3.225 8.801 -3.003
12 2HD1 ILE 1 2HD1 ILE 1 3.538 7.937 -4.507
13 3HD1 ILE 1 3HD1 ILE 1 4.570 9.281 -4.034
14 H ARG 2 H ARG 2 2.655 6.039 -0.245
15 HA ARG 2 HA ARG 2 2.178 3.279 0.557
16 1HB ARG 2 2HB ARG 2 3.014 5.010 2.141
17 2HB ARG 2 1HB ARG 2 1.482 5.868 1.981
18 1HG ARG 2 2HG ARG 2 0.266 3.958 2.878
19 2HG ARG 2 1HG ARG 2 1.749 3.004 2.937
20 1HD ARG 2 2HD ARG 2 2.687 4.862 4.452
21 2HD ARG 2 1HD ARG 2 1.016 5.418 4.597
22 HE ARG 2 HE ARG 2 0.813 2.759 5.231
23 1HH1 ARG 2 1HH2 ARG 2 2.881 5.342 6.191
24 2HH1 ARG 2 2HH2 ARG 2 3.071 4.765 7.813
25 1HH2 ARG 2 1HH1 ARG 2 1.046 1.989 7.342
26 2HH2 ARG 2 2HH1 ARG 2 2.033 2.865 8.465
27 H GLU 3 H GLU 3 0.366 5.825 -0.876
28 HA GLU 3 HA GLU 3 -2.249 4.788 -0.045
29 1HB GLU 3 2HB GLU 3 -1.680 7.246 -0.712
30 2HB GLU 3 1HB GLU 3 -1.757 6.662 -2.373
31 1HG GLU 3 2HG GLU 3 -4.057 5.841 -1.974
32 2HG GLU 3 1HG GLU 3 -3.981 6.452 -0.321
33 H ASN 4 H ASN 4 0.035 4.340 -2.634
34 HA ASN 4 HA ASN 4 -1.785 3.019 -4.457
35 1HB ASN 4 2HB ASN 4 0.590 3.959 -4.946
36 2HB ASN 4 1HB ASN 4 1.183 2.448 -4.261
37 1HD2 ASN 4 1HD2 ASN 4 0.944 3.626 -7.183
38 2HD2 ASN 4 2HD2 ASN 4 0.306 2.318 -8.056
39 H LEU 5 H LEU 5 0.643 1.825 -2.103
40 HA LEU 5 HA LEU 5 -0.076 -0.935 -2.335
41 1HB LEU 5 2HB LEU 5 1.004 0.554 0.082
42 2HB LEU 5 1HB LEU 5 0.984 -1.195 -0.111
43 HG LEU 5 HG LEU 5 2.436 0.715 -1.963
44 1HD1 LEU 5 1HD1 LEU 5 3.332 0.569 0.399
45 2HD1 LEU 5 2HD1 LEU 5 4.464 0.026 -0.840
46 3HD1 LEU 5 3HD1 LEU 5 3.581 -1.156 0.130
47 1HD2 LEU 5 1HD2 LEU 5 2.116 -2.289 -1.827
48 2HD2 LEU 5 2HD2 LEU 5 3.587 -1.591 -2.506
49 3HD2 LEU 5 3HD2 LEU 5 2.027 -1.226 -3.232
50 H LYS 6 H LYS 6 -1.289 1.693 -0.315
51 HA LYS 6 HA LYS 6 -2.998 0.292 1.411
52 1HB LYS 6 2HB LYS 6 -2.605 2.764 1.438
53 2HB LYS 6 1HB LYS 6 -3.660 2.906 0.030
54 1HG LYS 6 2HG LYS 6 -5.543 2.049 1.256
55 2HG LYS 6 1HG LYS 6 -4.522 1.618 2.630
56 1HD LYS 6 2HD LYS 6 -4.107 3.912 3.160
57 2HD LYS 6 1HD LYS 6 -4.798 4.457 1.632
58 1HE LYS 6 2HE LYS 6 -7.001 3.948 2.305
59 2HE LYS 6 1HE LYS 6 -6.454 2.909 3.622
60 1HZ LYS 6 1HZ LYS 6 -5.842 5.800 3.546
61 2HZ LYS 6 2HZ LYS 6 -5.760 4.738 4.872
62 3HZ LYS 6 3HZ LYS 6 -7.270 5.204 4.242
63 H ASP 7 H ASP 7 -3.434 1.191 -1.989
64 HA ASP 7 HA ASP 7 -6.199 0.345 -2.138
65 1HB ASP 7 2HB ASP 7 -4.144 0.586 -4.360
66 2HB ASP 7 1HB ASP 7 -5.892 0.466 -4.572
67 H SER 8 H SER 8 -3.058 -1.235 -2.564
68 HA SER 8 HA SER 8 -4.099 -3.679 -3.680
69 1HB SER 8 2HB SER 8 -1.953 -4.612 -3.182
70 2HB SER 8 1HB SER 8 -1.652 -2.925 -3.597
71 HG SER 8 HG SER 8 -2.134 -3.718 -0.934
72 H GLY 9 H GLY 9 -3.669 -2.467 -0.385
73 1HA GLY 9 2HA GLY 9 -4.792 -3.168 1.571
74 2HA GLY 9 1HA GLY 9 -5.650 -4.365 0.602
75 H LEU 10 H LEU 10 -2.589 -4.933 -0.244
76 HA LEU 10 HA LEU 10 -2.327 -7.172 1.668
77 1HB LEU 10 2HB LEU 10 -0.526 -6.387 -0.640
78 2HB LEU 10 1HB LEU 10 -0.526 -7.928 0.215
79 HG LEU 10 HG LEU 10 -2.844 -6.809 -1.392
80 1HD1 LEU 10 1HD1 LEU 10 -2.266 -8.930 -2.789
81 2HD1 LEU 10 2HD1 LEU 10 -0.695 -8.842 -1.993
82 3HD1 LEU 10 3HD1 LEU 10 -1.258 -7.498 -2.988
83 1HD2 LEU 10 1HD2 LEU 10 -2.478 -9.269 0.318
84 2HD2 LEU 10 2HD2 LEU 10 -3.569 -9.321 -1.067
85 3HD2 LEU 10 3HD2 LEU 10 -3.854 -8.168 0.233
86 H PHE 11 H PHE 11 -1.835 -4.153 2.193
87 HA PHE 11 HA PHE 11 0.626 -4.554 3.817
88 1HB PHE 11 2HB PHE 11 0.258 -2.356 1.768
89 2HB PHE 11 1HB PHE 11 1.500 -2.349 2.990
90 HD1 PHE 11 1HD PHE 11 0.413 -3.786 -0.181
91 HD2 PHE 11 2HD PHE 11 3.281 -4.115 3.002
92 HE1 PHE 11 1HE PHE 11 1.858 -5.192 -1.630
93 HE2 PHE 11 2HE PHE 11 4.718 -5.527 1.559
94 HZ PHE 11 HZ PHE 11 4.009 -6.062 -0.756
Start of MODEL 16
1 1H ILE 1 1HT ILE 1 1.193 6.217 -3.639
2 2H ILE 1 2HT ILE 1 2.349 7.393 -4.047
3 3H ILE 1 3HT ILE 1 1.597 7.432 -2.525
4 HA ILE 1 HA ILE 1 3.542 5.446 -3.536
5 HB ILE 1 HB ILE 1 4.589 6.185 -1.245
6 1HG1 ILE 1 2HG1 ILE 1 2.842 8.579 -1.924
7 2HG1 ILE 1 1HG1 ILE 1 2.539 7.481 -0.582
8 1HG2 ILE 1 1HG2 ILE 1 5.660 6.661 -3.384
9 2HG2 ILE 1 2HG2 ILE 1 5.704 8.123 -2.405
10 3HG2 ILE 1 3HG2 ILE 1 4.523 7.970 -3.704
11 1HD1 ILE 1 1HD1 ILE 1 5.078 9.092 -0.944
12 2HD1 ILE 1 2HD1 ILE 1 4.671 8.072 0.435
13 3HD1 ILE 1 3HD1 ILE 1 3.749 9.543 0.122
14 H ARG 2 H ARG 2 3.138 5.808 -0.167
15 HA ARG 2 HA ARG 2 2.425 3.099 0.265
16 1HB ARG 2 2HB ARG 2 2.090 5.558 2.002
17 2HB ARG 2 1HB ARG 2 1.685 3.936 2.567
18 1HG ARG 2 2HG ARG 2 3.936 3.174 2.297
19 2HG ARG 2 1HG ARG 2 4.389 4.617 1.394
20 1HD ARG 2 2HD ARG 2 3.637 4.498 4.327
21 2HD ARG 2 1HD ARG 2 5.240 4.803 3.668
22 HE ARG 2 HE ARG 2 3.590 6.773 2.551
23 1HH1 ARG 2 1HH2 ARG 2 4.503 5.655 5.683
24 2HH1 ARG 2 2HH2 ARG 2 4.301 7.199 6.440
25 1HH2 ARG 2 1HH1 ARG 2 3.315 8.796 3.522
26 2HH2 ARG 2 2HH1 ARG 2 3.628 8.979 5.216
27 H GLU 3 H GLU 3 0.576 5.712 -0.884
28 HA GLU 3 HA GLU 3 -2.014 4.692 0.032
29 1HB GLU 3 2HB GLU 3 -1.681 7.125 -0.450
30 2HB GLU 3 1HB GLU 3 -1.367 6.725 -2.138
31 1HG GLU 3 2HG GLU 3 -3.609 5.851 -2.414
32 2HG GLU 3 1HG GLU 3 -3.939 6.033 -0.690
33 H ASN 4 H ASN 4 0.145 4.254 -2.652
34 HA ASN 4 HA ASN 4 -1.775 3.012 -4.432
35 1HB ASN 4 2HB ASN 4 0.536 3.890 -5.078
36 2HB ASN 4 1HB ASN 4 1.203 2.459 -4.290
37 1HD2 ASN 4 1HD2 ASN 4 0.215 0.294 -5.119
38 2HD2 ASN 4 2HD2 ASN 4 -0.120 0.197 -6.780
39 H LEU 5 H LEU 5 0.667 1.775 -2.142
40 HA LEU 5 HA LEU 5 -0.063 -0.985 -2.383
41 1HB LEU 5 2HB LEU 5 1.153 0.560 -0.072
42 2HB LEU 5 1HB LEU 5 0.999 -1.194 -0.096
43 HG LEU 5 HG LEU 5 2.462 0.398 -2.224
44 1HD1 LEU 5 1HD1 LEU 5 3.598 0.697 -0.091
45 2HD1 LEU 5 2HD1 LEU 5 4.530 -0.424 -1.083
46 3HD1 LEU 5 3HD1 LEU 5 3.523 -1.036 0.228
47 1HD2 LEU 5 1HD2 LEU 5 2.047 -2.536 -1.652
48 2HD2 LEU 5 2HD2 LEU 5 3.536 -2.015 -2.435
49 3HD2 LEU 5 3HD2 LEU 5 1.983 -1.683 -3.193
50 H LYS 6 H LYS 6 -1.224 1.654 -0.357
51 HA LYS 6 HA LYS 6 -2.896 0.267 1.422
52 1HB LYS 6 2HB LYS 6 -2.464 2.722 1.450
53 2HB LYS 6 1HB LYS 6 -3.521 2.888 0.050
54 1HG LYS 6 2HG LYS 6 -5.418 2.064 1.279
55 2HG LYS 6 1HG LYS 6 -4.407 1.642 2.661
56 1HD LYS 6 2HD LYS 6 -4.392 4.498 1.701
57 2HD LYS 6 1HD LYS 6 -5.784 3.933 2.619
58 1HE LYS 6 2HE LYS 6 -2.942 3.548 3.587
59 2HE LYS 6 1HE LYS 6 -3.907 4.966 3.998
60 1HZ LYS 6 1HZ LYS 6 -5.569 2.864 4.479
61 2HZ LYS 6 2HZ LYS 6 -4.706 3.741 5.651
62 3HZ LYS 6 3HZ LYS 6 -4.064 2.300 5.020
63 H ASP 7 H ASP 7 -3.419 1.161 -1.964
64 HA ASP 7 HA ASP 7 -6.200 0.366 -2.031
65 1HB ASP 7 2HB ASP 7 -4.265 0.452 -4.359
66 2HB ASP 7 1HB ASP 7 -6.023 0.572 -4.428
67 H SER 8 H SER 8 -3.131 -1.293 -2.801
68 HA SER 8 HA SER 8 -4.295 -3.690 -3.804
69 1HB SER 8 2HB SER 8 -1.727 -3.162 -2.300
70 2HB SER 8 1HB SER 8 -2.154 -4.756 -2.910
71 HG SER 8 HG SER 8 -2.575 -3.278 -4.930
72 H GLY 9 H GLY 9 -3.706 -2.575 -0.484
73 1HA GLY 9 2HA GLY 9 -4.908 -3.266 1.460
74 2HA GLY 9 1HA GLY 9 -5.736 -4.464 0.475
75 H LEU 10 H LEU 10 -2.484 -4.795 -0.146
76 HA LEU 10 HA LEU 10 -2.312 -7.134 1.675
77 1HB LEU 10 2HB LEU 10 -0.302 -6.262 -0.415
78 2HB LEU 10 1HB LEU 10 -0.490 -7.864 0.293
79 HG LEU 10 HG LEU 10 -2.615 -6.504 -1.396
80 1HD1 LEU 10 1HD1 LEU 10 -1.897 -7.854 -3.235
81 2HD1 LEU 10 2HD1 LEU 10 -0.774 -8.755 -2.218
82 3HD1 LEU 10 3HD1 LEU 10 -0.449 -7.067 -2.606
83 1HD2 LEU 10 1HD2 LEU 10 -2.281 -9.271 -0.214
84 2HD2 LEU 10 2HD2 LEU 10 -3.406 -8.937 -1.532
85 3HD2 LEU 10 3HD2 LEU 10 -3.616 -8.145 0.030
86 H PHE 11 H PHE 11 -1.798 -4.021 2.142
87 HA PHE 11 HA PHE 11 0.636 -4.448 3.858
88 1HB PHE 11 2HB PHE 11 0.017 -2.192 1.938
89 2HB PHE 11 1HB PHE 11 1.084 -1.936 3.296
90 HD1 PHE 11 1HD PHE 11 0.550 -4.028 0.274
91 HD2 PHE 11 2HD PHE 11 3.337 -2.739 3.274
92 HE1 PHE 11 1HE PHE 11 2.403 -5.053 -1.014
93 HE2 PHE 11 2HE PHE 11 5.195 -3.767 1.989
94 HZ PHE 11 HZ PHE 11 4.727 -4.924 -0.155
Start of MODEL 17
1 1H ILE 1 1HT ILE 1 4.918 6.032 -2.248
2 2H ILE 1 2HT ILE 1 3.657 7.045 -1.726
3 3H ILE 1 3HT ILE 1 4.322 7.242 -3.276
4 HA ILE 1 HA ILE 1 2.312 6.124 -3.648
5 HB ILE 1 HB ILE 1 3.002 4.034 -4.575
6 1HG1 ILE 1 2HG1 ILE 1 5.379 4.180 -2.676
7 2HG1 ILE 1 1HG1 ILE 1 4.062 3.013 -2.631
8 1HG2 ILE 1 1HG2 ILE 1 4.900 4.715 -5.872
9 2HG2 ILE 1 2HG2 ILE 1 5.476 5.781 -4.590
10 3HG2 ILE 1 3HG2 ILE 1 4.013 6.189 -5.486
11 1HD1 ILE 1 1HD1 ILE 1 6.193 3.336 -4.749
12 2HD1 ILE 1 2HD1 ILE 1 4.726 2.398 -5.028
13 3HD1 ILE 1 3HD1 ILE 1 5.858 1.915 -3.761
14 H ARG 2 H ARG 2 2.752 6.303 -0.658
15 HA ARG 2 HA ARG 2 2.216 3.795 0.582
16 1HB ARG 2 2HB ARG 2 1.316 6.562 1.432
17 2HB ARG 2 1HB ARG 2 1.321 5.132 2.462
18 1HG ARG 2 2HG ARG 2 3.752 4.940 2.234
19 2HG ARG 2 1HG ARG 2 3.775 6.322 1.138
20 1HD ARG 2 2HD ARG 2 2.954 6.337 4.056
21 2HD ARG 2 1HD ARG 2 4.378 7.106 3.355
22 HE ARG 2 HE ARG 2 2.285 8.259 1.970
23 1HH1 ARG 2 1HH2 ARG 2 3.068 7.744 5.289
24 2HH1 ARG 2 2HH2 ARG 2 2.281 9.187 5.837
25 1HH2 ARG 2 1HH1 ARG 2 1.255 10.148 2.667
26 2HH2 ARG 2 2HH1 ARG 2 1.258 10.548 4.353
27 H GLU 3 H GLU 3 0.086 6.064 -1.054
28 HA GLU 3 HA GLU 3 -2.343 4.707 -0.124
29 1HB GLU 3 2HB GLU 3 -2.116 7.193 -0.786
30 2HB GLU 3 1HB GLU 3 -2.155 6.623 -2.454
31 1HG GLU 3 2HG GLU 3 -4.423 7.090 -1.997
32 2HG GLU 3 1HG GLU 3 -4.310 5.348 -1.750
33 H ASN 4 H ASN 4 -0.086 4.318 -2.678
34 HA ASN 4 HA ASN 4 -1.836 2.933 -4.523
35 1HB ASN 4 2HB ASN 4 0.478 3.917 -5.040
36 2HB ASN 4 1HB ASN 4 1.151 2.512 -4.214
37 1HD2 ASN 4 1HD2 ASN 4 -0.640 3.557 -7.087
38 2HD2 ASN 4 2HD2 ASN 4 -0.494 2.091 -7.930
39 H LEU 5 H LEU 5 0.592 1.833 -2.141
40 HA LEU 5 HA LEU 5 -0.076 -0.946 -2.338
41 1HB LEU 5 2HB LEU 5 1.169 0.659 -0.085
42 2HB LEU 5 1HB LEU 5 1.075 -1.102 -0.097
43 HG LEU 5 HG LEU 5 2.305 0.324 -2.455
44 1HD1 LEU 5 1HD1 LEU 5 3.456 1.295 -0.539
45 2HD1 LEU 5 2HD1 LEU 5 4.520 0.131 -1.329
46 3HD1 LEU 5 3HD1 LEU 5 3.692 -0.305 0.166
47 1HD2 LEU 5 1HD2 LEU 5 2.780 -2.350 -1.095
48 2HD2 LEU 5 2HD2 LEU 5 3.649 -1.775 -2.517
49 3HD2 LEU 5 3HD2 LEU 5 1.920 -2.095 -2.612
50 H LYS 6 H LYS 6 -1.291 1.702 -0.336
51 HA LYS 6 HA LYS 6 -2.832 0.218 1.509
52 1HB LYS 6 2HB LYS 6 -2.434 2.740 1.482
53 2HB LYS 6 1HB LYS 6 -3.700 2.834 0.256
54 1HG LYS 6 2HG LYS 6 -5.146 1.506 1.964
55 2HG LYS 6 1HG LYS 6 -3.932 1.997 3.145
56 1HD LYS 6 2HD LYS 6 -4.292 4.388 2.338
57 2HD LYS 6 1HD LYS 6 -5.696 3.786 1.456
58 1HE LYS 6 2HE LYS 6 -5.243 3.586 4.449
59 2HE LYS 6 1HE LYS 6 -6.400 4.644 3.637
60 1HZ LYS 6 1HZ LYS 6 -7.416 2.602 2.686
61 2HZ LYS 6 2HZ LYS 6 -7.554 2.717 4.376
62 3HZ LYS 6 3HZ LYS 6 -6.403 1.677 3.682
63 H ASP 7 H ASP 7 -3.551 1.205 -1.818
64 HA ASP 7 HA ASP 7 -6.289 0.279 -1.786
65 1HB ASP 7 2HB ASP 7 -4.308 0.835 -4.004
66 2HB ASP 7 1HB ASP 7 -5.932 0.228 -4.334
67 H SER 8 H SER 8 -3.216 -1.234 -2.866
68 HA SER 8 HA SER 8 -4.304 -3.659 -3.784
69 1HB SER 8 2HB SER 8 -1.751 -3.398 -2.178
70 2HB SER 8 1HB SER 8 -2.143 -4.654 -3.348
71 HG SER 8 HG SER 8 -1.006 -2.301 -3.778
72 H GLY 9 H GLY 9 -3.659 -2.607 -0.450
73 1HA GLY 9 2HA GLY 9 -4.741 -3.403 1.514
74 2HA GLY 9 1HA GLY 9 -5.614 -4.555 0.514
75 H LEU 10 H LEU 10 -2.362 -4.855 -0.221
76 HA LEU 10 HA LEU 10 -2.170 -7.312 1.402
77 1HB LEU 10 2HB LEU 10 -0.145 -6.083 -0.503
78 2HB LEU 10 1HB LEU 10 -0.098 -7.722 0.146
79 HG LEU 10 HG LEU 10 -2.354 -6.638 -1.568
80 1HD1 LEU 10 1HD1 LEU 10 0.120 -8.232 -2.276
81 2HD1 LEU 10 2HD1 LEU 10 -0.409 -6.697 -2.965
82 3HD1 LEU 10 3HD1 LEU 10 -1.305 -8.177 -3.314
83 1HD2 LEU 10 1HD2 LEU 10 -3.210 -8.466 -0.351
84 2HD2 LEU 10 2HD2 LEU 10 -1.675 -9.334 -0.380
85 3HD2 LEU 10 3HD2 LEU 10 -2.654 -9.222 -1.842
86 H PHE 11 H PHE 11 -1.732 -4.161 2.021
87 HA PHE 11 HA PHE 11 0.401 -4.658 4.076
88 1HB PHE 11 2HB PHE 11 0.180 -2.333 2.141
89 2HB PHE 11 1HB PHE 11 1.170 -2.281 3.579
90 HD1 PHE 11 1HD PHE 11 0.718 -3.865 0.285
91 HD2 PHE 11 2HD PHE 11 3.212 -3.615 3.770
92 HE1 PHE 11 1HE PHE 11 2.527 -5.044 -0.930
93 HE2 PHE 11 2HE PHE 11 5.023 -4.800 2.558
94 HZ PHE 11 HZ PHE 11 4.680 -5.516 0.207
Start of MODEL 18
1 1H ILE 1 1HT ILE 1 1.238 6.169 -3.796
2 2H ILE 1 2HT ILE 1 2.384 7.402 -4.012
3 3H ILE 1 3HT ILE 1 1.494 7.311 -2.567
4 HA ILE 1 HA ILE 1 3.494 5.342 -3.520
5 HB ILE 1 HB ILE 1 4.556 6.145 -1.263
6 1HG1 ILE 1 2HG1 ILE 1 2.840 8.544 -2.012
7 2HG1 ILE 1 1HG1 ILE 1 2.567 7.508 -0.612
8 1HG2 ILE 1 1HG2 ILE 1 5.566 6.506 -3.480
9 2HG2 ILE 1 2HG2 ILE 1 5.774 7.929 -2.466
10 3HG2 ILE 1 3HG2 ILE 1 4.541 7.922 -3.725
11 1HD1 ILE 1 1HD1 ILE 1 4.985 8.071 0.052
12 2HD1 ILE 1 2HD1 ILE 1 3.793 9.357 0.226
13 3HD1 ILE 1 3HD1 ILE 1 4.892 9.353 -1.154
14 H ARG 2 H ARG 2 3.112 5.860 -0.178
15 HA ARG 2 HA ARG 2 2.383 3.220 0.458
16 1HB ARG 2 2HB ARG 2 3.190 5.109 2.026
17 2HB ARG 2 1HB ARG 2 1.506 5.609 2.097
18 1HG ARG 2 2HG ARG 2 1.046 3.087 2.679
19 2HG ARG 2 1HG ARG 2 2.762 3.052 3.083
20 1HD ARG 2 2HD ARG 2 2.358 5.042 4.591
21 2HD ARG 2 1HD ARG 2 0.633 4.834 4.296
22 HE ARG 2 HE ARG 2 1.510 2.325 5.128
23 1HH1 ARG 2 1HH2 ARG 2 1.583 5.564 6.311
24 2HH1 ARG 2 2HH2 ARG 2 1.588 5.095 7.977
25 1HH2 ARG 2 1HH1 ARG 2 1.520 1.695 7.293
26 2HH2 ARG 2 2HH1 ARG 2 1.554 2.904 8.534
27 H GLU 3 H GLU 3 0.520 5.741 -0.891
28 HA GLU 3 HA GLU 3 -2.078 4.705 -0.012
29 1HB GLU 3 2HB GLU 3 -1.634 7.147 -0.618
30 2HB GLU 3 1HB GLU 3 -1.512 6.622 -2.296
31 1HG GLU 3 2HG GLU 3 -3.770 7.306 -2.041
32 2HG GLU 3 1HG GLU 3 -3.821 5.547 -1.960
33 H ASN 4 H ASN 4 0.160 4.227 -2.622
34 HA ASN 4 HA ASN 4 -1.697 2.933 -4.429
35 1HB ASN 4 2HB ASN 4 0.698 3.867 -4.909
36 2HB ASN 4 1HB ASN 4 1.262 2.315 -4.291
37 1HD2 ASN 4 1HD2 ASN 4 -0.734 3.804 -6.855
38 2HD2 ASN 4 2HD2 ASN 4 -0.675 2.469 -7.902
39 H LEU 5 H LEU 5 0.718 1.745 -2.080
40 HA LEU 5 HA LEU 5 0.024 -1.025 -2.319
41 1HB LEU 5 2HB LEU 5 1.051 0.400 0.158
42 2HB LEU 5 1HB LEU 5 1.188 -1.319 -0.194
43 HG LEU 5 HG LEU 5 2.402 0.819 -1.967
44 1HD1 LEU 5 1HD1 LEU 5 4.561 0.130 -0.832
45 2HD1 LEU 5 2HD1 LEU 5 3.574 -0.679 0.386
46 3HD1 LEU 5 3HD1 LEU 5 3.459 1.068 0.175
47 1HD2 LEU 5 1HD2 LEU 5 2.712 -2.187 -1.701
48 2HD2 LEU 5 2HD2 LEU 5 3.863 -1.187 -2.584
49 3HD2 LEU 5 3HD2 LEU 5 2.187 -1.277 -3.119
50 H LYS 6 H LYS 6 -1.200 1.623 -0.356
51 HA LYS 6 HA LYS 6 -2.896 0.243 1.419
52 1HB LYS 6 2HB LYS 6 -2.417 2.708 1.403
53 2HB LYS 6 1HB LYS 6 -3.542 2.860 0.055
54 1HG LYS 6 2HG LYS 6 -5.364 2.008 1.409
55 2HG LYS 6 1HG LYS 6 -4.259 1.658 2.742
56 1HD LYS 6 2HD LYS 6 -3.871 3.957 3.177
57 2HD LYS 6 1HD LYS 6 -4.539 4.451 1.621
58 1HE LYS 6 2HE LYS 6 -6.761 3.979 2.301
59 2HE LYS 6 1HE LYS 6 -6.224 3.046 3.698
60 1HZ LYS 6 1HZ LYS 6 -5.105 5.601 3.865
61 2HZ LYS 6 2HZ LYS 6 -6.251 4.888 4.894
62 3HZ LYS 6 3HZ LYS 6 -6.759 5.790 3.547
63 H ASP 7 H ASP 7 -3.353 1.148 -1.970
64 HA ASP 7 HA ASP 7 -6.145 0.450 -2.126
65 1HB ASP 7 2HB ASP 7 -4.109 0.378 -4.370
66 2HB ASP 7 1HB ASP 7 -5.855 0.577 -4.522
67 H SER 8 H SER 8 -3.151 -1.356 -2.919
68 HA SER 8 HA SER 8 -4.445 -3.748 -3.759
69 1HB SER 8 2HB SER 8 -1.836 -3.509 -2.241
70 2HB SER 8 1HB SER 8 -2.342 -4.871 -3.234
71 HG SER 8 HG SER 8 -2.375 -3.429 -5.016
72 H GLY 9 H GLY 9 -3.699 -2.522 -0.519
73 1HA GLY 9 2HA GLY 9 -4.795 -3.113 1.506
74 2HA GLY 9 1HA GLY 9 -5.725 -4.308 0.608
75 H LEU 10 H LEU 10 -2.556 -4.840 -0.197
76 HA LEU 10 HA LEU 10 -2.383 -7.118 1.688
77 1HB LEU 10 2HB LEU 10 -0.370 -6.392 -0.450
78 2HB LEU 10 1HB LEU 10 -0.689 -7.976 0.259
79 HG LEU 10 HG LEU 10 -2.612 -6.408 -1.487
80 1HD1 LEU 10 1HD1 LEU 10 -2.123 -7.995 -3.204
81 2HD1 LEU 10 2HD1 LEU 10 -1.208 -9.017 -2.095
82 3HD1 LEU 10 3HD1 LEU 10 -0.564 -7.452 -2.587
83 1HD2 LEU 10 1HD2 LEU 10 -2.795 -9.059 -0.041
84 2HD2 LEU 10 2HD2 LEU 10 -3.801 -8.700 -1.443
85 3HD2 LEU 10 3HD2 LEU 10 -3.925 -7.706 0.009
86 H PHE 11 H PHE 11 -1.817 -4.052 2.130
87 HA PHE 11 HA PHE 11 0.663 -4.481 3.764
88 1HB PHE 11 2HB PHE 11 0.064 -2.272 1.784
89 2HB PHE 11 1HB PHE 11 1.175 -2.009 3.103
90 HD1 PHE 11 1HD PHE 11 0.492 -4.204 0.182
91 HD2 PHE 11 2HD PHE 11 3.402 -2.860 3.031
92 HE1 PHE 11 1HE PHE 11 2.272 -5.335 -1.115
93 HE2 PHE 11 2HE PHE 11 5.188 -3.996 1.740
94 HZ PHE 11 HZ PHE 11 4.624 -5.236 -0.333
Start of MODEL 19
1 1H ILE 1 1HT ILE 1 4.107 6.500 -1.152
2 2H ILE 1 2HT ILE 1 2.979 7.508 -1.926
3 3H ILE 1 3HT ILE 1 4.501 7.238 -2.627
4 HA ILE 1 HA ILE 1 2.575 5.984 -3.626
5 HB ILE 1 HB ILE 1 5.031 5.428 -3.907
6 1HG1 ILE 1 2HG1 ILE 1 3.102 3.091 -3.746
7 2HG1 ILE 1 1HG1 ILE 1 3.317 4.162 -5.129
8 1HG2 ILE 1 1HG2 ILE 1 4.529 3.320 -1.801
9 2HG2 ILE 1 2HG2 ILE 1 5.268 4.874 -1.412
10 3HG2 ILE 1 3HG2 ILE 1 6.063 3.778 -2.543
11 1HD1 ILE 1 1HD1 ILE 1 4.614 2.216 -5.604
12 2HD1 ILE 1 2HD1 ILE 1 5.295 2.187 -3.977
13 3HD1 ILE 1 3HD1 ILE 1 5.774 3.450 -5.110
14 H ARG 2 H ARG 2 3.164 5.681 -0.273
15 HA ARG 2 HA ARG 2 2.145 3.211 0.469
16 1HB ARG 2 2HB ARG 2 2.179 5.923 1.707
17 2HB ARG 2 1HB ARG 2 1.034 4.790 2.415
18 1HG ARG 2 2HG ARG 2 3.061 4.556 3.647
19 2HG ARG 2 1HG ARG 2 2.962 3.135 2.616
20 1HD ARG 2 2HD ARG 2 4.337 4.815 0.967
21 2HD ARG 2 1HD ARG 2 4.891 5.406 2.528
22 HE ARG 2 HE ARG 2 5.819 3.061 1.262
23 1HH1 ARG 2 1HH2 ARG 2 4.509 3.997 4.320
24 2HH1 ARG 2 2HH2 ARG 2 5.144 2.621 5.150
25 1HH2 ARG 2 1HH1 ARG 2 6.663 1.286 2.345
26 2HH2 ARG 2 2HH1 ARG 2 6.365 1.094 4.040
27 H GLU 3 H GLU 3 0.360 5.844 -0.985
28 HA GLU 3 HA GLU 3 -2.239 4.810 -0.153
29 1HB GLU 3 2HB GLU 3 -1.793 7.229 -0.839
30 2HB GLU 3 1HB GLU 3 -1.687 6.652 -2.502
31 1HG GLU 3 2HG GLU 3 -3.982 5.642 -2.212
32 2HG GLU 3 1HG GLU 3 -4.081 6.460 -0.653
33 H ASN 4 H ASN 4 -0.120 4.309 -2.922
34 HA ASN 4 HA ASN 4 -2.088 2.902 -4.507
35 1HB ASN 4 2HB ASN 4 0.901 3.179 -4.523
36 2HB ASN 4 1HB ASN 4 0.217 1.811 -5.397
37 1HD2 ASN 4 1HD2 ASN 4 -0.250 2.278 -7.538
38 2HD2 ASN 4 2HD2 ASN 4 -0.648 3.813 -8.144
39 H LEU 5 H LEU 5 0.520 1.802 -2.314
40 HA LEU 5 HA LEU 5 -0.154 -0.974 -2.430
41 1HB LEU 5 2HB LEU 5 1.077 0.618 -0.159
42 2HB LEU 5 1HB LEU 5 1.048 -1.141 -0.250
43 HG LEU 5 HG LEU 5 2.300 0.625 -2.374
44 1HD1 LEU 5 1HD1 LEU 5 3.650 -0.871 -0.108
45 2HD1 LEU 5 2HD1 LEU 5 3.431 0.878 -0.173
46 3HD1 LEU 5 3HD1 LEU 5 4.457 0.074 -1.360
47 1HD2 LEU 5 1HD2 LEU 5 3.536 -1.656 -2.751
48 2HD2 LEU 5 2HD2 LEU 5 1.894 -1.480 -3.357
49 3HD2 LEU 5 3HD2 LEU 5 2.186 -2.351 -1.853
50 H LYS 6 H LYS 6 -1.326 1.687 -0.431
51 HA LYS 6 HA LYS 6 -2.882 0.271 1.444
52 1HB LYS 6 2HB LYS 6 -2.510 2.733 1.449
53 2HB LYS 6 1HB LYS 6 -3.602 2.872 0.072
54 1HG LYS 6 2HG LYS 6 -5.428 1.903 1.413
55 2HG LYS 6 1HG LYS 6 -4.336 1.758 2.792
56 1HD LYS 6 2HD LYS 6 -3.989 4.202 2.777
57 2HD LYS 6 1HD LYS 6 -5.092 4.350 1.409
58 1HE LYS 6 2HE LYS 6 -5.885 3.120 4.057
59 2HE LYS 6 1HE LYS 6 -6.142 4.819 3.659
60 1HZ LYS 6 1HZ LYS 6 -7.860 2.814 3.097
61 2HZ LYS 6 2HZ LYS 6 -7.040 2.998 1.621
62 3HZ LYS 6 3HZ LYS 6 -7.838 4.324 2.322
63 H ASP 7 H ASP 7 -3.549 1.141 -1.920
64 HA ASP 7 HA ASP 7 -6.308 0.285 -1.920
65 1HB ASP 7 2HB ASP 7 -4.339 0.513 -4.218
66 2HB ASP 7 1HB ASP 7 -6.087 0.332 -4.383
67 H SER 8 H SER 8 -3.241 -1.314 -2.806
68 HA SER 8 HA SER 8 -4.357 -3.750 -3.734
69 1HB SER 8 2HB SER 8 -1.777 -3.188 -2.261
70 2HB SER 8 1HB SER 8 -2.172 -4.754 -2.960
71 HG SER 8 HG SER 8 -2.658 -3.160 -4.879
72 H GLY 9 H GLY 9 -3.698 -2.619 -0.433
73 1HA GLY 9 2HA GLY 9 -4.841 -3.339 1.535
74 2HA GLY 9 1HA GLY 9 -5.639 -4.582 0.579
75 H LEU 10 H LEU 10 -2.449 -4.863 -0.191
76 HA LEU 10 HA LEU 10 -2.105 -7.123 1.699
77 1HB LEU 10 2HB LEU 10 -0.192 -6.243 -0.476
78 2HB LEU 10 1HB LEU 10 -0.317 -7.832 0.278
79 HG LEU 10 HG LEU 10 -2.449 -6.535 -1.451
80 1HD1 LEU 10 1HD1 LEU 10 -0.715 -8.949 -2.042
81 2HD1 LEU 10 2HD1 LEU 10 -0.346 -7.326 -2.624
82 3HD1 LEU 10 3HD1 LEU 10 -1.826 -8.132 -3.142
83 1HD2 LEU 10 1HD2 LEU 10 -3.339 -8.967 -1.346
84 2HD2 LEU 10 2HD2 LEU 10 -3.576 -7.956 0.079
85 3HD2 LEU 10 3HD2 LEU 10 -2.281 -9.154 0.054
86 H PHE 11 H PHE 11 -1.739 -3.986 2.068
87 HA PHE 11 HA PHE 11 0.722 -4.241 3.760
88 1HB PHE 11 2HB PHE 11 0.083 -2.137 1.682
89 2HB PHE 11 1HB PHE 11 1.149 -1.774 3.019
90 HD1 PHE 11 1HD PHE 11 0.635 -4.067 0.146
91 HD2 PHE 11 2HD PHE 11 3.405 -2.568 3.059
92 HE1 PHE 11 1HE PHE 11 2.491 -5.168 -1.063
93 HE2 PHE 11 2HE PHE 11 5.270 -3.674 1.854
94 HZ PHE 11 HZ PHE 11 4.814 -4.975 -0.209
Start of MODEL 20
1 1H ILE 1 1HT ILE 1 4.962 6.477 -2.928
2 2H ILE 1 2HT ILE 1 3.799 6.803 -1.731
3 3H ILE 1 3HT ILE 1 3.720 7.590 -3.235
4 HA ILE 1 HA ILE 1 2.335 6.020 -3.908
5 HB ILE 1 HB ILE 1 3.319 4.038 -4.751
6 1HG1 ILE 1 2HG1 ILE 1 5.406 4.308 -2.547
7 2HG1 ILE 1 1HG1 ILE 1 4.174 3.060 -2.695
8 1HG2 ILE 1 1HG2 ILE 1 5.292 4.828 -5.818
9 2HG2 ILE 1 2HG2 ILE 1 5.703 5.875 -4.461
10 3HG2 ILE 1 3HG2 ILE 1 4.333 6.272 -5.497
11 1HD1 ILE 1 1HD1 ILE 1 5.236 2.573 -5.006
12 2HD1 ILE 1 2HD1 ILE 1 6.118 2.049 -3.572
13 3HD1 ILE 1 3HD1 ILE 1 6.602 3.520 -4.419
14 H ARG 2 H ARG 2 2.993 6.266 -0.842
15 HA ARG 2 HA ARG 2 2.479 3.793 0.417
16 1HB ARG 2 2HB ARG 2 1.601 6.529 1.373
17 2HB ARG 2 1HB ARG 2 1.863 5.101 2.374
18 1HG ARG 2 2HG ARG 2 4.229 5.078 1.827
19 2HG ARG 2 1HG ARG 2 4.016 6.391 0.672
20 1HD ARG 2 2HD ARG 2 3.067 7.705 2.742
21 2HD ARG 2 1HD ARG 2 3.938 6.490 3.678
22 HE ARG 2 HE ARG 2 5.801 7.387 1.824
23 1HH1 ARG 2 1HH2 ARG 2 3.735 8.783 4.207
24 2HH1 ARG 2 2HH2 ARG 2 4.780 10.128 4.515
25 1HH2 ARG 2 1HH1 ARG 2 7.173 9.137 2.209
26 2HH2 ARG 2 2HH1 ARG 2 6.726 10.331 3.383
27 H GLU 3 H GLU 3 0.196 6.115 -0.978
28 HA GLU 3 HA GLU 3 -2.110 4.702 0.135
29 1HB GLU 3 2HB GLU 3 -2.083 7.178 -0.454
30 2HB GLU 3 1HB GLU 3 -2.112 6.694 -2.150
31 1HG GLU 3 2HG GLU 3 -4.202 5.386 -1.681
32 2HG GLU 3 1HG GLU 3 -4.204 6.057 -0.049
33 H ASN 4 H ASN 4 -0.223 4.455 -2.785
34 HA ASN 4 HA ASN 4 -2.189 3.018 -4.322
35 1HB ASN 4 2HB ASN 4 0.051 4.030 -5.143
36 2HB ASN 4 1HB ASN 4 0.792 2.550 -4.529
37 1HD2 ASN 4 1HD2 ASN 4 1.301 1.749 -6.685
38 2HD2 ASN 4 2HD2 ASN 4 0.089 1.210 -7.742
39 H LEU 5 H LEU 5 0.422 1.989 -2.123
40 HA LEU 5 HA LEU 5 -0.072 -0.821 -2.371
41 1HB LEU 5 2HB LEU 5 1.088 0.792 -0.081
42 2HB LEU 5 1HB LEU 5 1.110 -0.966 -0.156
43 HG LEU 5 HG LEU 5 2.245 0.723 -2.393
44 1HD1 LEU 5 1HD1 LEU 5 3.405 1.409 -0.361
45 2HD1 LEU 5 2HD1 LEU 5 4.473 0.385 -1.321
46 3HD1 LEU 5 3HD1 LEU 5 3.658 -0.275 0.096
47 1HD2 LEU 5 1HD2 LEU 5 2.001 -1.553 -3.057
48 2HD2 LEU 5 2HD2 LEU 5 2.531 -2.155 -1.489
49 3HD2 LEU 5 3HD2 LEU 5 3.689 -1.408 -2.585
50 H LYS 6 H LYS 6 -1.310 1.626 -0.086
51 HA LYS 6 HA LYS 6 -2.811 -0.041 1.605
52 1HB LYS 6 2HB LYS 6 -3.317 2.747 0.568
53 2HB LYS 6 1HB LYS 6 -4.439 1.968 1.679
54 1HG LYS 6 2HG LYS 6 -2.497 1.563 3.243
55 2HG LYS 6 1HG LYS 6 -1.501 2.549 2.174
56 1HD LYS 6 2HD LYS 6 -2.819 4.498 2.590
57 2HD LYS 6 1HD LYS 6 -4.098 3.555 3.354
58 1HE LYS 6 2HE LYS 6 -1.281 3.701 4.451
59 2HE LYS 6 1HE LYS 6 -2.571 4.789 4.966
60 1HZ LYS 6 1HZ LYS 6 -3.777 3.055 5.885
61 2HZ LYS 6 2HZ LYS 6 -2.177 2.655 6.296
62 3HZ LYS 6 3HZ LYS 6 -2.949 1.862 5.007
63 H ASP 7 H ASP 7 -3.536 1.141 -1.652
64 HA ASP 7 HA ASP 7 -6.243 0.155 -1.764
65 1HB ASP 7 2HB ASP 7 -4.354 0.489 -4.109
66 2HB ASP 7 1HB ASP 7 -6.117 0.567 -4.129
67 H SER 8 H SER 8 -3.113 -1.226 -2.791
68 HA SER 8 HA SER 8 -4.066 -3.626 -3.914
69 1HB SER 8 2HB SER 8 -1.608 -3.143 -2.214
70 2HB SER 8 1HB SER 8 -1.897 -4.613 -3.138
71 HG SER 8 HG SER 8 -1.986 -2.036 -4.305
72 H GLY 9 H GLY 9 -3.762 -2.678 -0.521
73 1HA GLY 9 2HA GLY 9 -4.983 -3.605 1.308
74 2HA GLY 9 1HA GLY 9 -5.632 -4.811 0.208
75 H LEU 10 H LEU 10 -2.343 -4.816 -0.250
76 HA LEU 10 HA LEU 10 -2.039 -7.220 1.457
77 1HB LEU 10 2HB LEU 10 -0.134 -5.946 -0.535
78 2HB LEU 10 1HB LEU 10 0.100 -7.504 0.252
79 HG LEU 10 HG LEU 10 -2.391 -6.932 -1.364
80 1HD1 LEU 10 1HD1 LEU 10 0.238 -8.046 -2.384
81 2HD1 LEU 10 2HD1 LEU 10 -0.469 -6.493 -2.832
82 3HD1 LEU 10 3HD1 LEU 10 -1.272 -7.995 -3.294
83 1HD2 LEU 10 1HD2 LEU 10 -0.914 -9.439 -0.495
84 2HD2 LEU 10 2HD2 LEU 10 -2.228 -9.448 -1.667
85 3HD2 LEU 10 3HD2 LEU 10 -2.530 -8.925 -0.014
86 H PHE 11 H PHE 11 -2.053 -4.209 2.255
87 HA PHE 11 HA PHE 11 0.276 -4.416 4.121
88 1HB PHE 11 2HB PHE 11 -0.413 -2.154 2.236
89 2HB PHE 11 1HB PHE 11 0.471 -1.834 3.708
90 HD1 PHE 11 1HD PHE 11 0.519 -3.727 0.524
91 HD2 PHE 11 2HD PHE 11 2.779 -2.472 3.950
92 HE1 PHE 11 1HE PHE 11 2.603 -4.475 -0.585
93 HE2 PHE 11 2HE PHE 11 4.869 -3.223 2.846
94 HZ PHE 11 HZ PHE 11 4.782 -4.224 0.577