Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
536585 | 2lhz RC | 17872 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ACE 1 H1 ACE 1 -3.097 -53.111 -19.183
2 H2 ACE 1 H2 ACE 1 -2.275 -51.553 -19.091
3 H3 ACE 1 H3 ACE 1 -2.430 -52.556 -17.648
4 HA PRO 2 HA PRO 2 0.449 -55.308 -20.505
5 HB2 PRO 2 HB2 PRO 2 1.304 -53.556 -22.627
6 HB3 PRO 2 HB3 PRO 2 0.418 -55.083 -22.757
7 HG2 PRO 2 HG2 PRO 2 -0.572 -52.340 -22.894
8 HG3 PRO 2 HG3 PRO 2 -1.326 -53.842 -23.446
9 HD2 PRO 2 HD2 PRO 2 -2.220 -52.429 -21.277
10 HD3 PRO 2 HD3 PRO 2 -2.416 -54.190 -21.439
11 H THR 3 H THR 3 2.841 -55.179 -20.745
12 HA THR 3 HA THR 3 4.056 -52.709 -19.724
13 HB THR 3 HB THR 3 5.311 -53.951 -18.006
14 HG21 THR 3 HG21 THR 3 2.885 -52.975 -17.700
15 HG22 THR 3 HG22 THR 3 3.591 -53.976 -16.430
16 HG23 THR 3 HG23 THR 3 2.431 -54.674 -17.561
17 H THR 4 H THR 4 6.592 -53.310 -19.473
18 HA THR 4 HA THR 4 7.414 -54.870 -21.834
19 HB THR 4 HB THR 4 8.950 -53.088 -22.522
20 HG21 THR 4 HG21 THR 4 6.361 -51.636 -22.175
21 HG22 THR 4 HG22 THR 4 6.341 -53.159 -23.066
22 HG23 THR 4 HG23 THR 4 7.354 -51.826 -23.620
23 H THR 5 H THR 5 9.596 -55.608 -21.767
24 HA THR 5 HA THR 5 10.511 -56.148 -19.070
25 HB THR 5 HB THR 5 11.070 -58.044 -20.143
26 HG1 THR 5 HG1 THR 5 13.046 -57.862 -21.404
27 HG21 THR 5 HG21 THR 5 9.655 -57.465 -22.036
28 HG22 THR 5 HG22 THR 5 11.153 -58.177 -22.637
29 HG23 THR 5 HG23 THR 5 10.918 -56.430 -22.703
30 HA PRO 6 HA PRO 6 13.656 -53.208 -18.367
31 HB2 PRO 6 HB2 PRO 6 15.894 -55.022 -18.409
32 HB3 PRO 6 HB3 PRO 6 15.077 -54.323 -17.003
33 HG2 PRO 6 HG2 PRO 6 14.801 -56.979 -18.185
34 HG3 PRO 6 HG3 PRO 6 14.354 -56.408 -16.571
35 HD2 PRO 6 HD2 PRO 6 12.513 -57.040 -18.498
36 HD3 PRO 6 HD3 PRO 6 12.211 -55.840 -17.220
37 H LEU 7 H LEU 7 13.711 -52.020 -20.267
38 HA LEU 7 HA LEU 7 14.932 -52.988 -22.676
39 HB2 LEU 7 HB2 LEU 7 13.107 -51.134 -22.333
40 HB3 LEU 7 HB3 LEU 7 14.501 -50.074 -22.123
41 HG LEU 7 HG LEU 7 15.321 -51.358 -24.324
42 HD11 LEU 7 HD11 LEU 7 13.298 -52.794 -24.392
43 HD12 LEU 7 HD12 LEU 7 13.422 -51.774 -25.825
44 HD13 LEU 7 HD13 LEU 7 12.294 -51.352 -24.536
45 HD21 LEU 7 HD21 LEU 7 13.356 -49.052 -24.178
46 HD22 LEU 7 HD22 LEU 7 14.260 -49.477 -25.632
47 HD23 LEU 7 HD23 LEU 7 15.116 -48.948 -24.184
48 H LYS 8 H LYS 8 17.053 -53.244 -22.911
49 HA LYS 8 HA LYS 8 18.869 -51.090 -22.219
50 HB2 LYS 8 HB2 LYS 8 18.564 -53.421 -20.507
51 HB3 LYS 8 HB3 LYS 8 20.209 -53.277 -21.129
52 HG2 LYS 8 HG2 LYS 8 20.405 -51.021 -20.295
53 HG3 LYS 8 HG3 LYS 8 18.695 -50.978 -19.865
54 HD2 LYS 8 HD2 LYS 8 20.101 -51.392 -17.875
55 HD3 LYS 8 HD3 LYS 8 19.056 -52.772 -18.214
56 HE2 LYS 8 HE2 LYS 8 21.793 -52.709 -19.433
57 HE3 LYS 8 HE3 LYS 8 21.634 -53.133 -17.728
58 HZ1 LYS 8 HZ1 LYS 8 20.399 -54.995 -18.211
59 HZ2 LYS 8 HZ2 LYS 8 21.489 -54.972 -19.514
60 HZ3 LYS 8 HZ3 LYS 8 19.897 -54.418 -19.725
61 HN1 NH2 9 HN1 NH2 9 19.800 -54.324 -24.569
62 HN2 NH2 9 HN2 NH2 9 18.703 -54.530 -23.291
63 H1 A2G 10 H1 A2G 10 6.453 -55.734 -18.896
64 H2 A2G 10 H2 A2G 10 6.762 -58.128 -18.436
65 HN2 A2G 10 HN2 A2G 10 4.500 -57.631 -20.282
66 H3 A2G 10 H3 A2G 10 3.786 -58.156 -17.864
67 HO3 A2G 10 HO3 A2G 10 4.064 -60.272 -17.640
68 H4 A2G 10 H4 A2G 10 4.385 -58.560 -15.548
69 HO4 A2G 10 HO4 A2G 10 6.981 -58.006 -15.581
70 H5 A2G 10 H5 A2G 10 4.230 -56.198 -16.184
71 H6 A2G 10 H6 A2G 10 6.734 -56.287 -14.538
72 H8 A2G 10 H8 A2G 10 4.973 -59.475 -22.340
73 H8A A2G 10 H8A A2G 10 6.520 -58.865 -22.927
74 H8B A2G 10 H8B A2G 10 5.212 -57.741 -22.559
75 H14 A2G 10 H14 A2G 10 5.264 -55.345 -14.286
76 H15 A2G 10 H15 A2G 10 5.619 -57.202 -12.852
77 H1 A2G 11 H1 A2G 11 10.462 -52.262 -21.126
78 H2 A2G 11 H2 A2G 11 11.172 -50.175 -20.040
79 HN2 A2G 11 HN2 A2G 11 9.143 -51.661 -18.477
80 H3 A2G 11 H3 A2G 11 8.209 -49.598 -19.773
81 HO3 A2G 11 HO3 A2G 11 9.090 -47.582 -19.023
82 H4 A2G 11 H4 A2G 11 8.578 -47.804 -21.370
83 HO4 A2G 11 HO4 A2G 11 10.813 -48.072 -22.435
84 H5 A2G 11 H5 A2G 11 8.023 -49.998 -22.323
85 H6 A2G 11 H6 A2G 11 8.822 -49.621 -24.560
86 H8 A2G 11 H8 A2G 11 10.091 -52.960 -16.787
87 H8A A2G 11 H8A A2G 11 10.239 -51.489 -15.825
88 H8B A2G 11 H8B A2G 11 11.662 -52.480 -16.144
89 H14 A2G 11 H14 A2G 11 8.648 -48.031 -23.816
90 H15 A2G 11 H15 A2G 11 10.807 -49.076 -24.880
Start of MODEL 2
1 H1 ACE 1 H1 ACE 1 -1.895 -52.504 -16.718
2 H2 ACE 1 H2 ACE 1 -2.761 -53.101 -18.134
3 H3 ACE 1 H3 ACE 1 -1.923 -51.551 -18.201
4 HA PRO 2 HA PRO 2 0.568 -55.379 -19.831
5 HB2 PRO 2 HB2 PRO 2 1.151 -53.706 -22.104
6 HB3 PRO 2 HB3 PRO 2 0.245 -55.227 -22.067
7 HG2 PRO 2 HG2 PRO 2 -0.736 -52.478 -22.165
8 HG3 PRO 2 HG3 PRO 2 -1.565 -53.989 -22.564
9 HD2 PRO 2 HD2 PRO 2 -2.159 -52.497 -20.345
10 HD3 PRO 2 HD3 PRO 2 -2.386 -54.259 -20.422
11 H THR 3 H THR 3 2.906 -55.303 -20.340
12 HA THR 3 HA THR 3 4.266 -52.809 -19.598
13 HB THR 3 HB THR 3 5.663 -53.921 -17.949
14 HG21 THR 3 HG21 THR 3 2.872 -54.801 -17.257
15 HG22 THR 3 HG22 THR 3 3.242 -53.084 -17.420
16 HG23 THR 3 HG23 THR 3 4.088 -54.058 -16.219
17 H THR 4 H THR 4 6.521 -52.784 -20.186
18 HA THR 4 HA THR 4 7.080 -54.582 -22.455
19 HB THR 4 HB THR 4 8.814 -52.816 -23.020
20 HG21 THR 4 HG21 THR 4 7.233 -51.467 -24.128
21 HG22 THR 4 HG22 THR 4 6.060 -51.610 -22.819
22 HG23 THR 4 HG23 THR 4 6.366 -52.983 -23.883
23 H THR 5 H THR 5 9.523 -54.937 -22.785
24 HA THR 5 HA THR 5 10.525 -56.215 -20.384
25 HB THR 5 HB THR 5 11.704 -57.517 -21.805
26 HG1 THR 5 HG1 THR 5 12.403 -55.822 -23.782
27 HG21 THR 5 HG21 THR 5 10.295 -56.012 -24.017
28 HG22 THR 5 HG22 THR 5 9.455 -57.131 -22.943
29 HG23 THR 5 HG23 THR 5 10.751 -57.716 -23.986
30 HA PRO 6 HA PRO 6 13.551 -53.236 -19.256
31 HB2 PRO 6 HB2 PRO 6 15.773 -55.057 -19.019
32 HB3 PRO 6 HB3 PRO 6 14.720 -54.440 -17.736
33 HG2 PRO 6 HG2 PRO 6 14.812 -57.056 -18.618
34 HG3 PRO 6 HG3 PRO 6 13.493 -56.324 -17.692
35 HD2 PRO 6 HD2 PRO 6 13.634 -56.934 -20.608
36 HD3 PRO 6 HD3 PRO 6 12.223 -56.889 -19.527
37 H LEU 7 H LEU 7 14.291 -51.781 -20.697
38 HA LEU 7 HA LEU 7 15.608 -52.527 -23.136
39 HB2 LEU 7 HB2 LEU 7 14.969 -49.916 -21.787
40 HB3 LEU 7 HB3 LEU 7 16.009 -49.964 -23.210
41 HG LEU 7 HG LEU 7 13.563 -49.607 -23.727
42 HD11 LEU 7 HD11 LEU 7 14.050 -52.201 -24.991
43 HD12 LEU 7 HD12 LEU 7 15.472 -51.158 -25.020
44 HD13 LEU 7 HD13 LEU 7 13.954 -50.598 -25.722
45 HD21 LEU 7 HD21 LEU 7 12.001 -51.374 -23.396
46 HD22 LEU 7 HD22 LEU 7 12.868 -51.242 -21.866
47 HD23 LEU 7 HD23 LEU 7 13.274 -52.529 -23.001
48 H LYS 8 H LYS 8 17.253 -53.813 -21.779
49 HA LYS 8 HA LYS 8 19.707 -52.266 -21.734
50 HB2 LYS 8 HB2 LYS 8 20.265 -53.111 -19.401
51 HB3 LYS 8 HB3 LYS 8 19.061 -51.824 -19.481
52 HG2 LYS 8 HG2 LYS 8 17.293 -53.259 -18.982
53 HG3 LYS 8 HG3 LYS 8 18.157 -54.685 -19.559
54 HD2 LYS 8 HD2 LYS 8 17.975 -54.607 -17.067
55 HD3 LYS 8 HD3 LYS 8 19.646 -54.618 -17.632
56 HE2 LYS 8 HE2 LYS 8 19.055 -52.909 -15.802
57 HE3 LYS 8 HE3 LYS 8 19.920 -52.299 -17.213
58 HZ1 LYS 8 HZ1 LYS 8 17.777 -51.645 -18.167
59 HZ2 LYS 8 HZ2 LYS 8 18.077 -50.863 -16.688
60 HZ3 LYS 8 HZ3 LYS 8 16.989 -52.165 -16.757
61 HN1 NH2 9 HN1 NH2 9 21.352 -54.199 -20.450
62 HN2 NH2 9 HN2 NH2 9 21.150 -55.736 -21.145
63 H1 A2G 10 H1 A2G 10 6.874 -55.633 -18.785
64 H2 A2G 10 H2 A2G 10 7.364 -57.999 -18.337
65 HN2 A2G 10 HN2 A2G 10 5.023 -57.626 -20.110
66 H3 A2G 10 H3 A2G 10 4.421 -58.221 -17.649
67 HO3 A2G 10 HO3 A2G 10 5.152 -60.112 -18.482
68 H4 A2G 10 H4 A2G 10 5.149 -58.595 -15.361
69 HO4 A2G 10 HO4 A2G 10 7.718 -57.825 -15.630
70 H5 A2G 10 H5 A2G 10 4.780 -56.255 -16.004
71 H6 A2G 10 H6 A2G 10 7.315 -56.443 -14.352
72 H8 A2G 10 H8 A2G 10 5.348 -59.409 -22.094
73 H8A A2G 10 H8A A2G 10 6.945 -59.060 -22.756
74 H8B A2G 10 H8B A2G 10 5.803 -57.747 -22.470
75 H14 A2G 10 H14 A2G 10 6.069 -55.198 -14.257
76 H15 A2G 10 H15 A2G 10 4.749 -56.553 -13.255
77 H1 A2G 11 H1 A2G 11 10.187 -51.745 -21.791
78 H2 A2G 11 H2 A2G 11 10.699 -49.703 -20.524
79 HN2 A2G 11 HN2 A2G 11 8.940 -51.524 -18.986
80 H3 A2G 11 H3 A2G 11 7.711 -49.542 -20.039
81 HO3 A2G 11 HO3 A2G 11 8.948 -47.322 -19.473
82 H4 A2G 11 H4 A2G 11 7.734 -47.579 -21.464
83 HO4 A2G 11 HO4 A2G 11 10.416 -48.102 -22.121
84 H5 A2G 11 H5 A2G 11 7.418 -49.711 -22.634
85 H6 A2G 11 H6 A2G 11 7.927 -48.964 -24.821
86 H8 A2G 11 H8 A2G 11 10.120 -52.956 -17.574
87 H8A A2G 11 H8A A2G 11 10.327 -51.599 -16.466
88 H8B A2G 11 H8B A2G 11 11.737 -52.478 -17.058
89 H14 A2G 11 H14 A2G 11 7.807 -47.473 -23.887
90 H15 A2G 11 H15 A2G 11 9.895 -48.433 -25.237
Start of MODEL 3
1 H1 ACE 1 H1 ACE 1 -2.353 -52.212 -19.295
2 H2 ACE 1 H2 ACE 1 -2.379 -53.375 -17.970
3 H3 ACE 1 H3 ACE 1 -3.008 -53.829 -19.553
4 HA PRO 2 HA PRO 2 0.729 -55.478 -21.124
5 HB2 PRO 2 HB2 PRO 2 1.362 -53.423 -23.042
6 HB3 PRO 2 HB3 PRO 2 0.640 -55.012 -23.338
7 HG2 PRO 2 HG2 PRO 2 -0.635 -52.391 -23.166
8 HG3 PRO 2 HG3 PRO 2 -1.235 -53.895 -23.879
9 HD2 PRO 2 HD2 PRO 2 -2.240 -52.832 -21.563
10 HD3 PRO 2 HD3 PRO 2 -2.251 -54.575 -21.918
11 H THR 3 H THR 3 3.019 -55.261 -21.011
12 HA THR 3 HA THR 3 4.087 -52.712 -20.023
13 HB THR 3 HB THR 3 5.221 -53.823 -18.147
14 HG21 THR 3 HG21 THR 3 3.374 -53.858 -16.721
15 HG22 THR 3 HG22 THR 3 2.345 -54.649 -17.914
16 HG23 THR 3 HG23 THR 3 2.743 -52.940 -18.089
17 H THR 4 H THR 4 6.610 -53.237 -19.538
18 HA THR 4 HA THR 4 7.655 -54.874 -21.753
19 HB THR 4 HB THR 4 9.187 -53.092 -22.415
20 HG21 THR 4 HG21 THR 4 7.648 -51.900 -23.658
21 HG22 THR 4 HG22 THR 4 6.576 -51.649 -22.280
22 HG23 THR 4 HG23 THR 4 6.608 -53.210 -23.100
23 H THR 5 H THR 5 9.845 -55.546 -21.481
24 HA THR 5 HA THR 5 10.548 -55.954 -18.698
25 HB THR 5 HB THR 5 12.593 -57.083 -20.013
26 HG1 THR 5 HG1 THR 5 12.037 -57.634 -22.035
27 HG21 THR 5 HG21 THR 5 11.287 -58.487 -18.692
28 HG22 THR 5 HG22 THR 5 10.920 -59.089 -20.308
29 HG23 THR 5 HG23 THR 5 9.789 -58.011 -19.490
30 HA PRO 6 HA PRO 6 13.470 -52.818 -17.885
31 HB2 PRO 6 HB2 PRO 6 15.721 -54.562 -17.453
32 HB3 PRO 6 HB3 PRO 6 14.711 -53.758 -16.243
33 HG2 PRO 6 HG2 PRO 6 14.640 -56.520 -17.189
34 HG3 PRO 6 HG3 PRO 6 13.970 -55.814 -15.711
35 HD2 PRO 6 HD2 PRO 6 12.416 -56.675 -17.795
36 HD3 PRO 6 HD3 PRO 6 11.925 -55.371 -16.692
37 H LEU 7 H LEU 7 13.836 -51.758 -19.803
38 HA LEU 7 HA LEU 7 15.316 -52.913 -21.975
39 HB2 LEU 7 HB2 LEU 7 13.646 -50.678 -21.608
40 HB3 LEU 7 HB3 LEU 7 15.220 -50.031 -22.067
41 HG LEU 7 HG LEU 7 15.264 -51.678 -23.968
42 HD11 LEU 7 HD11 LEU 7 13.703 -53.295 -24.102
43 HD12 LEU 7 HD12 LEU 7 12.411 -52.094 -24.075
44 HD13 LEU 7 HD13 LEU 7 13.049 -52.738 -22.561
45 HD21 LEU 7 HD21 LEU 7 13.240 -50.473 -25.168
46 HD22 LEU 7 HD22 LEU 7 14.662 -49.544 -24.689
47 HD23 LEU 7 HD23 LEU 7 13.207 -49.509 -23.692
48 H LYS 8 H LYS 8 17.445 -52.845 -22.377
49 HA LYS 8 HA LYS 8 19.210 -51.739 -20.356
50 HB2 LYS 8 HB2 LYS 8 20.945 -52.666 -22.120
51 HB3 LYS 8 HB3 LYS 8 20.044 -53.771 -21.081
52 HG2 LYS 8 HG2 LYS 8 18.784 -52.970 -23.667
53 HG3 LYS 8 HG3 LYS 8 20.130 -54.107 -23.731
54 HD2 LYS 8 HD2 LYS 8 17.968 -54.586 -21.718
55 HD3 LYS 8 HD3 LYS 8 17.639 -54.970 -23.408
56 HE2 LYS 8 HE2 LYS 8 20.008 -55.992 -21.815
57 HE3 LYS 8 HE3 LYS 8 18.562 -56.926 -22.200
58 HZ1 LYS 8 HZ1 LYS 8 19.136 -56.239 -24.613
59 HZ2 LYS 8 HZ2 LYS 8 19.983 -57.519 -23.885
60 HZ3 LYS 8 HZ3 LYS 8 20.693 -55.981 -23.993
61 HN1 NH2 9 HN1 NH2 9 21.139 -50.299 -21.109
62 HN2 NH2 9 HN2 NH2 9 21.059 -49.500 -22.604
63 H1 A2G 10 H1 A2G 10 6.512 -55.589 -18.809
64 H2 A2G 10 H2 A2G 10 6.863 -57.948 -18.209
65 HN2 A2G 10 HN2 A2G 10 4.810 -57.584 -20.310
66 H3 A2G 10 H3 A2G 10 3.848 -58.070 -17.937
67 HO3 A2G 10 HO3 A2G 10 4.269 -60.178 -17.341
68 H4 A2G 10 H4 A2G 10 4.235 -58.369 -15.557
69 HO4 A2G 10 HO4 A2G 10 6.975 -57.933 -16.124
70 H5 A2G 10 H5 A2G 10 4.031 -56.049 -16.330
71 H6 A2G 10 H6 A2G 10 6.341 -55.992 -14.406
72 H8 A2G 10 H8 A2G 10 5.468 -59.667 -22.111
73 H8A A2G 10 H8A A2G 10 7.040 -59.062 -22.633
74 H8B A2G 10 H8B A2G 10 5.675 -57.956 -22.482
75 H14 A2G 10 H14 A2G 10 4.862 -55.032 -14.393
76 H15 A2G 10 H15 A2G 10 3.720 -56.903 -13.819
77 H1 A2G 11 H1 A2G 11 10.602 -52.216 -20.940
78 H2 A2G 11 H2 A2G 11 11.232 -50.084 -19.891
79 HN2 A2G 11 HN2 A2G 11 9.107 -51.521 -18.413
80 H3 A2G 11 H3 A2G 11 8.256 -49.510 -19.835
81 HO3 A2G 11 HO3 A2G 11 10.342 -47.709 -19.311
82 H4 A2G 11 H4 A2G 11 8.706 -47.790 -21.486
83 HO4 A2G 11 HO4 A2G 11 10.961 -47.940 -22.401
84 H5 A2G 11 H5 A2G 11 8.249 -50.018 -22.404
85 H6 A2G 11 H6 A2G 11 9.033 -49.611 -24.574
86 H8 A2G 11 H8 A2G 11 9.766 -52.587 -16.556
87 H8A A2G 11 H8A A2G 11 10.199 -51.153 -15.626
88 H8B A2G 11 H8B A2G 11 11.415 -52.382 -15.969
89 H14 A2G 11 H14 A2G 11 9.156 -48.012 -23.840
90 H15 A2G 11 H15 A2G 11 11.227 -49.931 -24.096
Start of MODEL 4
1 H1 ACE 1 H1 ACE 1 -2.622 -55.887 -18.184
2 H2 ACE 1 H2 ACE 1 -2.319 -54.216 -17.706
3 H3 ACE 1 H3 ACE 1 -1.795 -55.540 -16.665
4 HA PRO 2 HA PRO 2 0.977 -56.209 -20.653
5 HB2 PRO 2 HB2 PRO 2 0.697 -53.784 -22.183
6 HB3 PRO 2 HB3 PRO 2 0.315 -55.441 -22.677
7 HG2 PRO 2 HG2 PRO 2 -1.466 -53.316 -21.761
8 HG3 PRO 2 HG3 PRO 2 -1.838 -54.794 -22.661
9 HD2 PRO 2 HD2 PRO 2 -2.548 -54.418 -20.041
10 HD3 PRO 2 HD3 PRO 2 -2.231 -56.021 -20.742
11 H THR 3 H THR 3 3.129 -55.508 -20.733
12 HA THR 3 HA THR 3 3.783 -52.898 -19.560
13 HB THR 3 HB THR 3 5.421 -53.923 -18.025
14 HG21 THR 3 HG21 THR 3 3.870 -54.455 -16.368
15 HG22 THR 3 HG22 THR 3 2.830 -55.339 -17.485
16 HG23 THR 3 HG23 THR 3 2.858 -53.576 -17.513
17 H THR 4 H THR 4 6.253 -52.580 -19.657
18 HA THR 4 HA THR 4 7.410 -53.919 -22.012
19 HB THR 4 HB THR 4 8.130 -51.787 -22.945
20 HG21 THR 4 HG21 THR 4 5.298 -51.122 -22.399
21 HG22 THR 4 HG22 THR 4 5.582 -52.749 -23.019
22 HG23 THR 4 HG23 THR 4 6.125 -51.346 -23.940
23 H THR 5 H THR 5 9.583 -54.261 -21.901
24 HA THR 5 HA THR 5 11.235 -52.868 -19.970
25 HB THR 5 HB THR 5 10.157 -54.594 -18.567
26 HG1 THR 5 HG1 THR 5 12.380 -53.982 -18.277
27 HG21 THR 5 HG21 THR 5 11.570 -56.832 -19.830
28 HG22 THR 5 HG22 THR 5 10.296 -56.151 -20.842
29 HG23 THR 5 HG23 THR 5 9.916 -56.745 -19.225
30 HA PRO 6 HA PRO 6 13.392 -54.491 -23.735
31 HB2 PRO 6 HB2 PRO 6 14.282 -51.804 -24.277
32 HB3 PRO 6 HB3 PRO 6 13.170 -52.802 -25.224
33 HG2 PRO 6 HG2 PRO 6 12.486 -50.522 -23.824
34 HG3 PRO 6 HG3 PRO 6 11.359 -51.766 -24.384
35 HD2 PRO 6 HD2 PRO 6 12.434 -51.297 -21.642
36 HD3 PRO 6 HD3 PRO 6 10.871 -51.983 -22.144
37 H LEU 7 H LEU 7 14.160 -53.662 -20.775
38 HA LEU 7 HA LEU 7 16.885 -52.788 -20.986
39 HB2 LEU 7 HB2 LEU 7 15.166 -53.839 -18.753
40 HB3 LEU 7 HB3 LEU 7 16.899 -53.608 -18.523
41 HG LEU 7 HG LEU 7 15.493 -51.617 -17.864
42 HD11 LEU 7 HD11 LEU 7 17.288 -50.330 -18.353
43 HD12 LEU 7 HD12 LEU 7 17.045 -50.520 -20.089
44 HD13 LEU 7 HD13 LEU 7 17.936 -51.744 -19.185
45 HD21 LEU 7 HD21 LEU 7 15.149 -51.229 -20.843
46 HD22 LEU 7 HD22 LEU 7 14.384 -50.331 -19.534
47 HD23 LEU 7 HD23 LEU 7 13.908 -51.998 -19.854
48 H LYS 8 H LYS 8 18.559 -54.220 -19.696
49 HA LYS 8 HA LYS 8 18.820 -56.669 -21.232
50 HB2 LYS 8 HB2 LYS 8 20.647 -55.471 -19.134
51 HB3 LYS 8 HB3 LYS 8 21.047 -56.800 -20.223
52 HG2 LYS 8 HG2 LYS 8 21.853 -55.169 -21.583
53 HG3 LYS 8 HG3 LYS 8 20.158 -54.893 -21.985
54 HD2 LYS 8 HD2 LYS 8 20.951 -52.753 -21.366
55 HD3 LYS 8 HD3 LYS 8 20.125 -53.336 -19.921
56 HE2 LYS 8 HE2 LYS 8 22.069 -52.823 -18.860
57 HE3 LYS 8 HE3 LYS 8 22.650 -54.339 -19.548
58 HZ1 LYS 8 HZ1 LYS 8 24.219 -52.985 -20.395
59 HZ2 LYS 8 HZ2 LYS 8 23.239 -51.599 -20.324
60 HZ3 LYS 8 HZ3 LYS 8 23.052 -52.712 -21.596
61 HN1 NH2 9 HN1 NH2 9 18.581 -56.523 -17.316
62 HN2 NH2 9 HN2 NH2 9 19.860 -57.561 -17.726
63 H1 A2G 10 H1 A2G 10 6.875 -55.326 -19.135
64 H2 A2G 10 H2 A2G 10 7.761 -57.604 -18.876
65 HN2 A2G 10 HN2 A2G 10 5.310 -57.540 -20.538
66 H3 A2G 10 H3 A2G 10 4.924 -58.353 -18.116
67 HO3 A2G 10 HO3 A2G 10 6.701 -59.767 -19.234
68 H4 A2G 10 H4 A2G 10 5.798 -58.756 -15.885
69 HO4 A2G 10 HO4 A2G 10 8.055 -57.885 -15.601
70 H5 A2G 10 H5 A2G 10 5.028 -56.470 -16.344
71 H6 A2G 10 H6 A2G 10 7.581 -56.001 -14.856
72 H8 A2G 10 H8 A2G 10 6.145 -59.132 -22.812
73 H8A A2G 10 H8A A2G 10 7.337 -57.966 -23.386
74 H8B A2G 10 H8B A2G 10 5.768 -57.409 -22.805
75 H14 A2G 10 H14 A2G 10 5.935 -55.530 -14.432
76 H15 A2G 10 H15 A2G 10 7.312 -57.832 -13.871
77 H1 A2G 11 H1 A2G 11 9.313 -50.351 -22.101
78 H2 A2G 11 H2 A2G 11 9.654 -48.278 -20.829
79 HN2 A2G 11 HN2 A2G 11 8.681 -50.461 -19.082
80 H3 A2G 11 H3 A2G 11 6.871 -48.778 -19.742
81 HO3 A2G 11 HO3 A2G 11 8.297 -47.772 -18.300
82 H4 A2G 11 H4 A2G 11 6.200 -46.806 -20.993
83 HO4 A2G 11 HO4 A2G 11 8.435 -45.936 -20.856
84 H5 A2G 11 H5 A2G 11 6.070 -48.941 -22.197
85 H6 A2G 11 H6 A2G 11 5.949 -48.068 -24.408
86 H8 A2G 11 H8 A2G 11 10.415 -51.638 -18.031
87 H8A A2G 11 H8A A2G 11 10.546 -50.273 -16.921
88 H8B A2G 11 H8B A2G 11 11.962 -50.819 -17.818
89 H14 A2G 11 H14 A2G 11 5.671 -46.676 -23.362
90 H15 A2G 11 H15 A2G 11 7.540 -46.966 -25.181
Start of MODEL 5
1 H1 ACE 1 H1 ACE 1 -2.210 -51.675 -20.161
2 H2 ACE 1 H2 ACE 1 -2.532 -52.353 -18.566
3 H3 ACE 1 H3 ACE 1 -3.054 -53.216 -20.013
4 HA PRO 2 HA PRO 2 0.556 -55.643 -20.482
5 HB2 PRO 2 HB2 PRO 2 1.663 -54.369 -22.816
6 HB3 PRO 2 HB3 PRO 2 0.760 -55.888 -22.723
7 HG2 PRO 2 HG2 PRO 2 -0.146 -53.229 -23.521
8 HG3 PRO 2 HG3 PRO 2 -0.875 -54.812 -23.830
9 HD2 PRO 2 HD2 PRO 2 -1.952 -52.980 -22.101
10 HD3 PRO 2 HD3 PRO 2 -2.172 -54.736 -21.919
11 H THR 3 H THR 3 3.039 -55.466 -20.796
12 HA THR 3 HA THR 3 4.101 -52.871 -19.928
13 HB THR 3 HB THR 3 5.352 -53.905 -18.085
14 HG21 THR 3 HG21 THR 3 3.580 -53.958 -16.567
15 HG22 THR 3 HG22 THR 3 2.514 -54.802 -17.690
16 HG23 THR 3 HG23 THR 3 2.858 -53.089 -17.920
17 H THR 4 H THR 4 6.654 -53.319 -19.574
18 HA THR 4 HA THR 4 7.620 -54.999 -21.792
19 HB THR 4 HB THR 4 9.101 -53.183 -22.548
20 HG21 THR 4 HG21 THR 4 6.547 -53.482 -23.224
21 HG22 THR 4 HG22 THR 4 7.486 -52.110 -23.815
22 HG23 THR 4 HG23 THR 4 6.396 -51.908 -22.443
23 H THR 5 H THR 5 9.920 -55.471 -21.663
24 HA THR 5 HA THR 5 10.747 -55.898 -18.919
25 HB THR 5 HB THR 5 11.205 -57.174 -21.399
26 HG1 THR 5 HG1 THR 5 11.868 -58.741 -20.063
27 HG21 THR 5 HG21 THR 5 13.156 -55.645 -21.636
28 HG22 THR 5 HG22 THR 5 13.640 -57.333 -21.471
29 HG23 THR 5 HG23 THR 5 13.776 -56.238 -20.095
30 HA PRO 6 HA PRO 6 13.419 -52.545 -18.111
31 HB2 PRO 6 HB2 PRO 6 15.806 -54.115 -17.747
32 HB3 PRO 6 HB3 PRO 6 14.759 -53.409 -16.506
33 HG2 PRO 6 HG2 PRO 6 14.884 -56.154 -17.494
34 HG3 PRO 6 HG3 PRO 6 14.190 -55.523 -15.994
35 HD2 PRO 6 HD2 PRO 6 12.667 -56.474 -18.064
36 HD3 PRO 6 HD3 PRO 6 12.098 -55.227 -16.931
37 H LEU 7 H LEU 7 14.385 -51.160 -19.483
38 HA LEU 7 HA LEU 7 15.296 -52.032 -22.061
39 HB2 LEU 7 HB2 LEU 7 15.644 -49.302 -20.805
40 HB3 LEU 7 HB3 LEU 7 15.649 -49.700 -22.524
41 HG LEU 7 HG LEU 7 13.292 -50.027 -20.644
42 HD11 LEU 7 HD11 LEU 7 14.268 -47.817 -22.277
43 HD12 LEU 7 HD12 LEU 7 12.970 -47.836 -21.084
44 HD13 LEU 7 HD13 LEU 7 12.643 -48.310 -22.751
45 HD21 LEU 7 HD21 LEU 7 12.978 -51.692 -22.255
46 HD22 LEU 7 HD22 LEU 7 13.809 -50.772 -23.511
47 HD23 LEU 7 HD23 LEU 7 12.180 -50.315 -23.015
48 H LYS 8 H LYS 8 17.183 -53.058 -22.272
49 HA LYS 8 HA LYS 8 19.399 -52.539 -20.471
50 HB2 LYS 8 HB2 LYS 8 20.364 -54.167 -22.484
51 HB3 LYS 8 HB3 LYS 8 19.658 -54.722 -20.966
52 HG2 LYS 8 HG2 LYS 8 17.459 -54.879 -21.980
53 HG3 LYS 8 HG3 LYS 8 18.054 -54.157 -23.475
54 HD2 LYS 8 HD2 LYS 8 18.888 -56.125 -24.210
55 HD3 LYS 8 HD3 LYS 8 19.632 -56.479 -22.650
56 HE2 LYS 8 HE2 LYS 8 17.856 -58.127 -23.285
57 HE3 LYS 8 HE3 LYS 8 17.516 -57.292 -21.769
58 HZ1 LYS 8 HZ1 LYS 8 15.880 -57.430 -23.966
59 HZ2 LYS 8 HZ2 LYS 8 16.507 -55.852 -24.008
60 HZ3 LYS 8 HZ3 LYS 8 15.688 -56.407 -22.627
61 HN1 NH2 9 HN1 NH2 9 19.695 -52.860 -24.026
62 HN2 NH2 9 HN2 NH2 9 20.579 -51.425 -24.231
63 H1 A2G 10 H1 A2G 10 6.657 -55.653 -18.771
64 H2 A2G 10 H2 A2G 10 7.105 -57.984 -18.138
65 HN2 A2G 10 HN2 A2G 10 4.939 -57.725 -20.140
66 H3 A2G 10 H3 A2G 10 4.112 -58.183 -17.710
67 HO3 A2G 10 HO3 A2G 10 6.002 -60.072 -16.903
68 H4 A2G 10 H4 A2G 10 4.626 -58.415 -15.346
69 HO4 A2G 10 HO4 A2G 10 7.053 -58.919 -16.299
70 H5 A2G 10 H5 A2G 10 4.318 -56.119 -16.160
71 H6 A2G 10 H6 A2G 10 6.675 -56.253 -14.253
72 H8 A2G 10 H8 A2G 10 5.398 -59.531 -22.003
73 H8A A2G 10 H8A A2G 10 7.084 -59.356 -22.492
74 H8B A2G 10 H8B A2G 10 6.036 -57.940 -22.420
75 H14 A2G 10 H14 A2G 10 5.505 -54.941 -14.389
76 H15 A2G 10 H15 A2G 10 3.943 -56.225 -13.562
77 H1 A2G 11 H1 A2G 11 10.479 -52.124 -21.188
78 H2 A2G 11 H2 A2G 11 10.984 -49.918 -20.232
79 HN2 A2G 11 HN2 A2G 11 9.016 -51.447 -18.635
80 H3 A2G 11 H3 A2G 11 7.978 -49.560 -20.107
81 HO3 A2G 11 HO3 A2G 11 9.122 -48.543 -18.445
82 H4 A2G 11 H4 A2G 11 8.270 -47.858 -21.815
83 HO4 A2G 11 HO4 A2G 11 10.987 -48.638 -21.915
84 H5 A2G 11 H5 A2G 11 7.923 -50.149 -22.626
85 H6 A2G 11 H6 A2G 11 8.813 -49.877 -24.858
86 H8 A2G 11 H8 A2G 11 9.993 -52.502 -16.760
87 H8A A2G 11 H8A A2G 11 9.915 -50.913 -16.000
88 H8B A2G 11 H8B A2G 11 11.451 -51.775 -16.084
89 H14 A2G 11 H14 A2G 11 8.425 -48.269 -24.247
90 H15 A2G 11 H15 A2G 11 10.984 -49.474 -24.098
Start of MODEL 6
1 H1 ACE 1 H1 ACE 1 -1.354 -50.752 -19.086
2 H2 ACE 1 H2 ACE 1 -1.983 -51.199 -20.673
3 H3 ACE 1 H3 ACE 1 -0.815 -49.886 -20.524
4 HA PRO 2 HA PRO 2 1.024 -54.252 -21.561
5 HB2 PRO 2 HB2 PRO 2 2.490 -52.863 -23.615
6 HB3 PRO 2 HB3 PRO 2 1.271 -54.132 -23.809
7 HG2 PRO 2 HG2 PRO 2 1.008 -51.240 -24.107
8 HG3 PRO 2 HG3 PRO 2 -0.035 -52.537 -24.706
9 HD2 PRO 2 HD2 PRO 2 -0.762 -50.850 -22.674
10 HD3 PRO 2 HD3 PRO 2 -1.370 -52.516 -22.819
11 H THR 3 H THR 3 2.744 -54.734 -20.330
12 HA THR 3 HA THR 3 4.575 -52.587 -19.524
13 HB THR 3 HB THR 3 5.295 -54.112 -17.767
14 HG21 THR 3 HG21 THR 3 2.403 -54.662 -17.624
15 HG22 THR 3 HG22 THR 3 2.802 -52.976 -17.957
16 HG23 THR 3 HG23 THR 3 3.433 -53.764 -16.510
17 H THR 4 H THR 4 6.917 -53.479 -19.139
18 HA THR 4 HA THR 4 7.756 -55.154 -21.414
19 HB THR 4 HB THR 4 9.574 -53.578 -21.931
20 HG21 THR 4 HG21 THR 4 7.130 -51.854 -21.897
21 HG22 THR 4 HG22 THR 4 7.062 -53.377 -22.785
22 HG23 THR 4 HG23 THR 4 8.266 -52.160 -23.211
23 H THR 5 H THR 5 9.862 -56.102 -21.157
24 HA THR 5 HA THR 5 10.422 -56.771 -18.392
25 HB THR 5 HB THR 5 10.889 -58.699 -19.454
26 HG1 THR 5 HG1 THR 5 13.092 -57.471 -20.690
27 HG21 THR 5 HG21 THR 5 11.202 -57.031 -21.964
28 HG22 THR 5 HG22 THR 5 9.775 -57.948 -21.479
29 HG23 THR 5 HG23 THR 5 11.257 -58.794 -21.927
30 HA PRO 6 HA PRO 6 13.753 -54.179 -17.290
31 HB2 PRO 6 HB2 PRO 6 15.786 -56.214 -17.137
32 HB3 PRO 6 HB3 PRO 6 14.898 -55.452 -15.809
33 HG2 PRO 6 HG2 PRO 6 14.483 -58.050 -17.076
34 HG3 PRO 6 HG3 PRO 6 13.925 -57.456 -15.506
35 HD2 PRO 6 HD2 PRO 6 12.249 -57.870 -17.631
36 HD3 PRO 6 HD3 PRO 6 11.933 -56.662 -16.366
37 H LEU 7 H LEU 7 14.135 -52.978 -19.142
38 HA LEU 7 HA LEU 7 16.566 -53.513 -20.565
39 HB2 LEU 7 HB2 LEU 7 14.641 -54.936 -21.664
40 HB3 LEU 7 HB3 LEU 7 14.187 -53.387 -22.378
41 HG LEU 7 HG LEU 7 16.803 -53.273 -22.888
42 HD11 LEU 7 HD11 LEU 7 17.270 -55.420 -21.741
43 HD12 LEU 7 HD12 LEU 7 17.672 -55.503 -23.456
44 HD13 LEU 7 HD13 LEU 7 16.186 -56.244 -22.862
45 HD21 LEU 7 HD21 LEU 7 15.344 -53.095 -24.714
46 HD22 LEU 7 HD22 LEU 7 14.574 -54.644 -24.373
47 HD23 LEU 7 HD23 LEU 7 16.194 -54.599 -25.069
48 H LYS 8 H LYS 8 15.537 -51.975 -22.917
49 HA LYS 8 HA LYS 8 14.747 -49.403 -21.835
50 HB2 LYS 8 HB2 LYS 8 16.784 -48.279 -22.858
51 HB3 LYS 8 HB3 LYS 8 17.079 -49.193 -21.378
52 HG2 LYS 8 HG2 LYS 8 18.039 -51.012 -22.561
53 HG3 LYS 8 HG3 LYS 8 17.406 -50.445 -24.107
54 HD2 LYS 8 HD2 LYS 8 19.022 -48.803 -24.326
55 HD3 LYS 8 HD3 LYS 8 19.241 -48.638 -22.583
56 HE2 LYS 8 HE2 LYS 8 20.424 -50.765 -22.485
57 HE3 LYS 8 HE3 LYS 8 20.113 -51.052 -24.197
58 HZ1 LYS 8 HZ1 LYS 8 21.905 -49.883 -24.701
59 HZ2 LYS 8 HZ2 LYS 8 22.234 -49.657 -23.049
60 HZ3 LYS 8 HZ3 LYS 8 21.292 -48.523 -23.894
61 HN1 NH2 9 HN1 NH2 9 16.173 -49.499 -25.432
62 HN2 NH2 9 HN2 NH2 9 15.510 -48.051 -24.846
63 H1 A2G 10 H1 A2G 10 6.351 -55.962 -18.745
64 H2 A2G 10 H2 A2G 10 6.308 -58.396 -18.408
65 HN2 A2G 10 HN2 A2G 10 4.333 -57.549 -20.446
66 H3 A2G 10 H3 A2G 10 3.307 -58.057 -18.153
67 HO3 A2G 10 HO3 A2G 10 5.080 -60.196 -18.373
68 H4 A2G 10 H4 A2G 10 3.596 -58.672 -15.820
69 HO4 A2G 10 HO4 A2G 10 5.686 -58.969 -14.999
70 H5 A2G 10 H5 A2G 10 3.783 -56.280 -16.333
71 H6 A2G 10 H6 A2G 10 6.050 -56.699 -14.430
72 H8 A2G 10 H8 A2G 10 5.019 -59.389 -22.618
73 H8A A2G 10 H8A A2G 10 6.563 -58.602 -22.945
74 H8B A2G 10 H8B A2G 10 5.134 -57.630 -22.596
75 H14 A2G 10 H14 A2G 10 4.630 -55.665 -14.270
76 H15 A2G 10 H15 A2G 10 4.823 -58.464 -13.944
77 H1 A2G 11 H1 A2G 11 11.005 -52.876 -20.401
78 H2 A2G 11 H2 A2G 11 11.807 -50.860 -19.249
79 HN2 A2G 11 HN2 A2G 11 9.481 -52.102 -17.901
80 H3 A2G 11 H3 A2G 11 8.907 -49.981 -19.294
81 HO3 A2G 11 HO3 A2G 11 9.564 -48.669 -17.821
82 H4 A2G 11 H4 A2G 11 9.622 -48.253 -20.845
83 HO4 A2G 11 HO4 A2G 11 11.897 -48.511 -19.860
84 H5 A2G 11 H5 A2G 11 8.949 -50.389 -21.850
85 H6 A2G 11 H6 A2G 11 10.008 -50.119 -23.991
86 H8 A2G 11 H8 A2G 11 10.103 -53.440 -16.059
87 H8A A2G 11 H8A A2G 11 10.274 -51.921 -15.182
88 H8B A2G 11 H8B A2G 11 11.621 -53.057 -15.247
89 H14 A2G 11 H14 A2G 11 9.927 -48.512 -23.270
90 H15 A2G 11 H15 A2G 11 12.150 -49.534 -22.404
Start of MODEL 7
1 H1 ACE 1 H1 ACE 1 -1.387 -51.582 -18.491
2 H2 ACE 1 H2 ACE 1 -2.101 -52.025 -20.041
3 H3 ACE 1 H3 ACE 1 -1.062 -50.604 -19.921
4 HA PRO 2 HA PRO 2 1.109 -54.710 -21.322
5 HB2 PRO 2 HB2 PRO 2 2.243 -53.092 -23.417
6 HB3 PRO 2 HB3 PRO 2 1.147 -54.473 -23.573
7 HG2 PRO 2 HG2 PRO 2 0.569 -51.613 -23.705
8 HG3 PRO 2 HG3 PRO 2 -0.386 -52.988 -24.280
9 HD2 PRO 2 HD2 PRO 2 -1.100 -51.470 -22.114
10 HD3 PRO 2 HD3 PRO 2 -1.548 -53.182 -22.292
11 H THR 3 H THR 3 2.859 -54.993 -20.072
12 HA THR 3 HA THR 3 4.610 -52.711 -19.484
13 HB THR 3 HB THR 3 5.501 -54.093 -17.690
14 HG21 THR 3 HG21 THR 3 2.832 -53.231 -17.902
15 HG22 THR 3 HG22 THR 3 3.711 -53.591 -16.417
16 HG23 THR 3 HG23 THR 3 2.747 -54.846 -17.197
17 H THR 4 H THR 4 7.013 -53.443 -19.193
18 HA THR 4 HA THR 4 7.823 -55.206 -21.410
19 HB THR 4 HB THR 4 9.719 -53.354 -21.682
20 HG21 THR 4 HG21 THR 4 8.192 -54.141 -23.457
21 HG22 THR 4 HG22 THR 4 8.379 -52.389 -23.515
22 HG23 THR 4 HG23 THR 4 6.920 -53.097 -22.823
23 H THR 5 H THR 5 10.044 -55.949 -21.241
24 HA THR 5 HA THR 5 10.770 -56.476 -18.484
25 HB THR 5 HB THR 5 11.368 -58.392 -19.499
26 HG1 THR 5 HG1 THR 5 13.429 -58.342 -20.468
27 HG21 THR 5 HG21 THR 5 11.409 -56.804 -22.080
28 HG22 THR 5 HG22 THR 5 10.089 -57.812 -21.485
29 HG23 THR 5 HG23 THR 5 11.610 -58.554 -21.981
30 HA PRO 6 HA PRO 6 13.916 -53.582 -17.608
31 HB2 PRO 6 HB2 PRO 6 16.120 -55.433 -17.494
32 HB3 PRO 6 HB3 PRO 6 15.229 -54.707 -16.148
33 HG2 PRO 6 HG2 PRO 6 14.983 -57.369 -17.322
34 HG3 PRO 6 HG3 PRO 6 14.445 -56.775 -15.745
35 HD2 PRO 6 HD2 PRO 6 12.719 -57.395 -17.779
36 HD3 PRO 6 HD3 PRO 6 12.357 -56.180 -16.533
37 H LEU 7 H LEU 7 14.297 -52.318 -19.371
38 HA LEU 7 HA LEU 7 15.482 -53.309 -21.790
39 HB2 LEU 7 HB2 LEU 7 14.929 -50.501 -20.809
40 HB3 LEU 7 HB3 LEU 7 15.538 -50.885 -22.420
41 HG LEU 7 HG LEU 7 13.112 -52.348 -21.483
42 HD11 LEU 7 HD11 LEU 7 13.253 -49.408 -22.090
43 HD12 LEU 7 HD12 LEU 7 12.308 -50.243 -20.857
44 HD13 LEU 7 HD13 LEU 7 11.820 -50.327 -22.550
45 HD21 LEU 7 HD21 LEU 7 14.182 -52.787 -23.679
46 HD22 LEU 7 HD22 LEU 7 13.935 -51.098 -24.124
47 HD23 LEU 7 HD23 LEU 7 12.546 -52.155 -23.870
48 H LYS 8 H LYS 8 17.286 -51.388 -22.532
49 HA LYS 8 HA LYS 8 19.364 -51.144 -20.523
50 HB2 LYS 8 HB2 LYS 8 21.037 -52.422 -21.775
51 HB3 LYS 8 HB3 LYS 8 19.686 -53.460 -21.317
52 HG2 LYS 8 HG2 LYS 8 18.729 -52.721 -23.669
53 HG3 LYS 8 HG3 LYS 8 20.428 -52.401 -24.022
54 HD2 LYS 8 HD2 LYS 8 20.336 -54.624 -24.636
55 HD3 LYS 8 HD3 LYS 8 20.728 -54.817 -22.927
56 HE2 LYS 8 HE2 LYS 8 18.249 -54.942 -22.460
57 HE3 LYS 8 HE3 LYS 8 17.987 -54.989 -24.203
58 HZ1 LYS 8 HZ1 LYS 8 19.641 -56.915 -24.157
59 HZ2 LYS 8 HZ2 LYS 8 18.068 -57.209 -23.587
60 HZ3 LYS 8 HZ3 LYS 8 19.343 -56.973 -22.489
61 HN1 NH2 9 HN1 NH2 9 18.221 -48.932 -21.764
62 HN2 NH2 9 HN2 NH2 9 18.800 -48.624 -23.330
63 H1 A2G 10 H1 A2G 10 6.614 -55.902 -18.599
64 H2 A2G 10 H2 A2G 10 6.746 -58.328 -18.232
65 HN2 A2G 10 HN2 A2G 10 4.659 -57.614 -20.208
66 H3 A2G 10 H3 A2G 10 3.741 -58.187 -17.866
67 HO3 A2G 10 HO3 A2G 10 5.665 -60.254 -17.878
68 H4 A2G 10 H4 A2G 10 4.160 -58.748 -15.539
69 HO4 A2G 10 HO4 A2G 10 6.415 -58.702 -14.858
70 H5 A2G 10 H5 A2G 10 4.165 -56.354 -16.088
71 H6 A2G 10 H6 A2G 10 6.523 -56.645 -14.259
72 H8 A2G 10 H8 A2G 10 5.261 -59.485 -22.328
73 H8A A2G 10 H8A A2G 10 6.803 -58.750 -22.765
74 H8B A2G 10 H8B A2G 10 5.411 -57.729 -22.402
75 H14 A2G 10 H14 A2G 10 5.090 -55.634 -14.079
76 H15 A2G 10 H15 A2G 10 3.906 -57.412 -13.523
77 H1 A2G 11 H1 A2G 11 10.297 -51.425 -21.130
78 H2 A2G 11 H2 A2G 11 9.876 -49.149 -20.306
79 HN2 A2G 11 HN2 A2G 11 8.800 -51.200 -18.460
80 H3 A2G 11 H3 A2G 11 7.016 -50.079 -19.934
81 HO3 A2G 11 HO3 A2G 11 7.341 -48.558 -18.465
82 H4 A2G 11 H4 A2G 11 6.451 -48.537 -21.726
83 HO4 A2G 11 HO4 A2G 11 9.245 -48.072 -21.860
84 H5 A2G 11 H5 A2G 11 7.060 -50.814 -22.416
85 H6 A2G 11 H6 A2G 11 7.616 -50.352 -24.725
86 H8 A2G 11 H8 A2G 11 10.237 -51.689 -16.671
87 H8A A2G 11 H8A A2G 11 9.726 -50.155 -15.966
88 H8B A2G 11 H8B A2G 11 11.441 -50.481 -16.222
89 H14 A2G 11 H14 A2G 11 6.613 -49.021 -24.147
90 H15 A2G 11 H15 A2G 11 8.977 -48.269 -23.541
Start of MODEL 8
1 H1 ACE 1 H1 ACE 1 -2.553 -51.321 -18.590
2 H2 ACE 1 H2 ACE 1 -1.401 -49.994 -18.445
3 H3 ACE 1 H3 ACE 1 -1.739 -51.024 -17.054
4 HA PRO 2 HA PRO 2 0.376 -54.164 -20.168
5 HB2 PRO 2 HB2 PRO 2 1.546 -52.518 -22.222
6 HB3 PRO 2 HB3 PRO 2 0.338 -53.798 -22.401
7 HG2 PRO 2 HG2 PRO 2 -0.015 -50.901 -22.349
8 HG3 PRO 2 HG3 PRO 2 -1.100 -52.160 -22.953
9 HD2 PRO 2 HD2 PRO 2 -1.600 -50.723 -20.676
10 HD3 PRO 2 HD3 PRO 2 -2.188 -52.382 -20.927
11 H THR 3 H THR 3 2.749 -54.517 -20.564
12 HA THR 3 HA THR 3 4.488 -52.464 -19.388
13 HB THR 3 HB THR 3 5.500 -54.065 -17.843
14 HG21 THR 3 HG21 THR 3 2.543 -54.357 -17.397
15 HG22 THR 3 HG22 THR 3 3.280 -52.756 -17.344
16 HG23 THR 3 HG23 THR 3 3.814 -54.010 -16.224
17 H THR 4 H THR 4 6.853 -53.531 -19.368
18 HA THR 4 HA THR 4 7.252 -55.015 -21.881
19 HB THR 4 HB THR 4 9.133 -53.484 -22.453
20 HG21 THR 4 HG21 THR 4 7.765 -51.852 -23.453
21 HG22 THR 4 HG22 THR 4 6.642 -51.831 -22.093
22 HG23 THR 4 HG23 THR 4 6.655 -53.201 -23.204
23 H THR 5 H THR 5 9.488 -55.878 -22.061
24 HA THR 5 HA THR 5 10.285 -57.036 -19.526
25 HB THR 5 HB THR 5 11.183 -58.684 -20.784
26 HG1 THR 5 HG1 THR 5 12.471 -58.134 -22.669
27 HG21 THR 5 HG21 THR 5 10.025 -57.213 -23.157
28 HG22 THR 5 HG22 THR 5 9.018 -58.029 -21.961
29 HG23 THR 5 HG23 THR 5 10.167 -58.956 -22.927
30 HA PRO 6 HA PRO 6 13.818 -54.548 -18.740
31 HB2 PRO 6 HB2 PRO 6 15.675 -56.704 -18.280
32 HB3 PRO 6 HB3 PRO 6 14.774 -55.758 -17.084
33 HG2 PRO 6 HG2 PRO 6 14.373 -58.432 -17.650
34 HG3 PRO 6 HG3 PRO 6 13.226 -57.370 -16.825
35 HD2 PRO 6 HD2 PRO 6 13.205 -58.330 -19.647
36 HD3 PRO 6 HD3 PRO 6 11.843 -57.902 -18.586
37 H LEU 7 H LEU 7 14.808 -53.428 -20.322
38 HA LEU 7 HA LEU 7 17.043 -54.533 -21.738
39 HB2 LEU 7 HB2 LEU 7 14.948 -55.347 -23.007
40 HB3 LEU 7 HB3 LEU 7 14.766 -53.665 -23.505
41 HG LEU 7 HG LEU 7 17.385 -53.990 -24.048
42 HD11 LEU 7 HD11 LEU 7 17.824 -56.197 -24.930
43 HD12 LEU 7 HD12 LEU 7 16.159 -56.700 -24.635
44 HD13 LEU 7 HD13 LEU 7 17.241 -56.391 -23.277
45 HD21 LEU 7 HD21 LEU 7 15.065 -54.842 -25.812
46 HD22 LEU 7 HD22 LEU 7 16.681 -54.441 -26.395
47 HD23 LEU 7 HD23 LEU 7 15.686 -53.201 -25.632
48 H LYS 8 H LYS 8 18.030 -52.732 -20.720
49 HA LYS 8 HA LYS 8 17.860 -50.298 -22.288
50 HB2 LYS 8 HB2 LYS 8 16.152 -50.291 -20.250
51 HB3 LYS 8 HB3 LYS 8 17.605 -49.865 -19.346
52 HG2 LYS 8 HG2 LYS 8 16.537 -48.417 -21.789
53 HG3 LYS 8 HG3 LYS 8 16.481 -47.830 -20.126
54 HD2 LYS 8 HD2 LYS 8 19.044 -48.106 -20.131
55 HD3 LYS 8 HD3 LYS 8 18.901 -48.232 -21.885
56 HE2 LYS 8 HE2 LYS 8 17.957 -45.914 -20.173
57 HE3 LYS 8 HE3 LYS 8 19.338 -45.907 -21.271
58 HZ1 LYS 8 HZ1 LYS 8 17.545 -46.653 -22.983
59 HZ2 LYS 8 HZ2 LYS 8 17.722 -45.010 -22.589
60 HZ3 LYS 8 HZ3 LYS 8 16.471 -45.924 -21.891
61 HN1 NH2 9 HN1 NH2 9 20.026 -51.915 -19.536
62 HN2 NH2 9 HN2 NH2 9 19.918 -50.311 -18.990
63 H1 A2G 10 H1 A2G 10 6.340 -55.901 -18.907
64 H2 A2G 10 H2 A2G 10 6.257 -58.351 -18.721
65 HN2 A2G 10 HN2 A2G 10 4.146 -57.250 -20.483
66 H3 A2G 10 H3 A2G 10 3.314 -57.957 -18.113
67 HO3 A2G 10 HO3 A2G 10 4.053 -59.866 -19.283
68 H4 A2G 10 H4 A2G 10 3.838 -58.731 -15.870
69 HO4 A2G 10 HO4 A2G 10 6.207 -59.350 -17.099
70 H5 A2G 10 H5 A2G 10 4.042 -56.314 -16.250
71 H6 A2G 10 H6 A2G 10 6.382 -57.286 -14.582
72 H8 A2G 10 H8 A2G 10 4.151 -58.771 -22.688
73 H8A A2G 10 H8A A2G 10 5.826 -58.782 -23.239
74 H8B A2G 10 H8B A2G 10 5.048 -57.258 -22.812
75 H14 A2G 10 H14 A2G 10 5.492 -55.776 -14.383
76 H15 A2G 10 H15 A2G 10 4.897 -57.591 -12.968
77 H1 A2G 11 H1 A2G 11 10.715 -52.707 -21.255
78 H2 A2G 11 H2 A2G 11 11.613 -50.824 -19.956
79 HN2 A2G 11 HN2 A2G 11 9.632 -52.362 -18.382
80 H3 A2G 11 H3 A2G 11 8.714 -50.183 -19.349
81 HO3 A2G 11 HO3 A2G 11 11.190 -49.355 -18.408
82 H4 A2G 11 H4 A2G 11 9.038 -48.193 -20.708
83 HO4 A2G 11 HO4 A2G 11 11.363 -48.156 -20.212
84 H5 A2G 11 H5 A2G 11 8.301 -50.206 -21.904
85 H6 A2G 11 H6 A2G 11 8.792 -49.462 -24.085
86 H8 A2G 11 H8 A2G 11 10.578 -54.004 -17.041
87 H8A A2G 11 H8A A2G 11 11.126 -52.744 -15.935
88 H8B A2G 11 H8B A2G 11 12.288 -53.875 -16.629
89 H14 A2G 11 H14 A2G 11 9.043 -48.013 -23.111
90 H15 A2G 11 H15 A2G 11 11.055 -48.048 -23.649
Start of MODEL 9
1 H1 ACE 1 H1 ACE 1 -2.038 -51.673 -19.104
2 H2 ACE 1 H2 ACE 1 -0.926 -50.348 -19.448
3 H3 ACE 1 H3 ACE 1 -1.131 -50.921 -17.792
4 HA PRO 2 HA PRO 2 0.872 -54.821 -19.983
5 HB2 PRO 2 HB2 PRO 2 1.830 -53.855 -22.521
6 HB3 PRO 2 HB3 PRO 2 0.660 -55.146 -22.213
7 HG2 PRO 2 HG2 PRO 2 0.205 -52.372 -23.002
8 HG3 PRO 2 HG3 PRO 2 -0.874 -53.770 -23.113
9 HD2 PRO 2 HD2 PRO 2 -1.260 -51.719 -21.338
10 HD3 PRO 2 HD3 PRO 2 -1.804 -53.386 -21.034
11 H THR 3 H THR 3 2.957 -55.191 -19.399
12 HA THR 3 HA THR 3 4.718 -52.860 -19.109
13 HB THR 3 HB THR 3 6.002 -54.248 -17.580
14 HG21 THR 3 HG21 THR 3 4.493 -53.986 -15.913
15 HG22 THR 3 HG22 THR 3 3.355 -55.106 -16.660
16 HG23 THR 3 HG23 THR 3 3.392 -53.419 -17.168
17 H THR 4 H THR 4 6.869 -52.870 -19.856
18 HA THR 4 HA THR 4 7.298 -54.632 -22.180
19 HB THR 4 HB THR 4 9.231 -52.785 -22.443
20 HG21 THR 4 HG21 THR 4 7.458 -53.292 -24.084
21 HG22 THR 4 HG22 THR 4 7.668 -51.551 -23.900
22 HG23 THR 4 HG23 THR 4 6.307 -52.362 -23.126
23 H THR 5 H THR 5 9.588 -55.263 -22.598
24 HA THR 5 HA THR 5 10.709 -56.440 -20.196
25 HB THR 5 HB THR 5 12.462 -57.150 -22.097
26 HG1 THR 5 HG1 THR 5 10.078 -56.908 -23.564
27 HG21 THR 5 HG21 THR 5 10.671 -58.993 -22.654
28 HG22 THR 5 HG22 THR 5 9.739 -58.191 -21.390
29 HG23 THR 5 HG23 THR 5 11.324 -58.873 -21.020
30 HA PRO 6 HA PRO 6 13.870 -53.660 -19.049
31 HB2 PRO 6 HB2 PRO 6 16.076 -55.453 -19.511
32 HB3 PRO 6 HB3 PRO 6 15.318 -55.026 -17.970
33 HG2 PRO 6 HG2 PRO 6 14.961 -57.406 -19.622
34 HG3 PRO 6 HG3 PRO 6 14.577 -57.147 -17.915
35 HD2 PRO 6 HD2 PRO 6 12.663 -57.386 -19.861
36 HD3 PRO 6 HD3 PRO 6 12.422 -56.448 -18.370
37 H LEU 7 H LEU 7 14.893 -52.059 -20.128
38 HA LEU 7 HA LEU 7 15.231 -52.226 -22.974
39 HB2 LEU 7 HB2 LEU 7 15.772 -50.119 -20.896
40 HB3 LEU 7 HB3 LEU 7 16.330 -49.913 -22.556
41 HG LEU 7 HG LEU 7 14.053 -48.924 -22.101
42 HD11 LEU 7 HD11 LEU 7 13.587 -49.275 -24.287
43 HD12 LEU 7 HD12 LEU 7 13.400 -51.012 -24.044
44 HD13 LEU 7 HD13 LEU 7 15.004 -50.325 -24.305
45 HD21 LEU 7 HD21 LEU 7 13.433 -50.897 -20.570
46 HD22 LEU 7 HD22 LEU 7 13.124 -51.801 -22.052
47 HD23 LEU 7 HD23 LEU 7 12.189 -50.350 -21.694
48 H LYS 8 H LYS 8 16.866 -54.010 -21.194
49 HA LYS 8 HA LYS 8 19.377 -53.641 -22.596
50 HB2 LYS 8 HB2 LYS 8 20.715 -53.721 -20.475
51 HB3 LYS 8 HB3 LYS 8 19.816 -52.219 -20.697
52 HG2 LYS 8 HG2 LYS 8 17.994 -53.142 -19.262
53 HG3 LYS 8 HG3 LYS 8 18.985 -54.571 -18.973
54 HD2 LYS 8 HD2 LYS 8 19.618 -53.320 -17.143
55 HD3 LYS 8 HD3 LYS 8 20.792 -52.715 -18.312
56 HE2 LYS 8 HE2 LYS 8 19.251 -50.846 -18.861
57 HE3 LYS 8 HE3 LYS 8 18.130 -51.431 -17.633
58 HZ1 LYS 8 HZ1 LYS 8 20.308 -51.306 -16.178
59 HZ2 LYS 8 HZ2 LYS 8 19.299 -49.956 -16.396
60 HZ3 LYS 8 HZ3 LYS 8 20.719 -50.116 -17.315
61 HN1 NH2 9 HN1 NH2 9 20.258 -56.095 -20.140
62 HN2 NH2 9 HN2 NH2 9 20.731 -56.367 -21.748
63 H1 A2G 10 H1 A2G 10 6.983 -55.992 -18.745
64 H2 A2G 10 H2 A2G 10 7.277 -58.415 -18.464
65 HN2 A2G 10 HN2 A2G 10 4.785 -57.846 -19.958
66 H3 A2G 10 H3 A2G 10 4.398 -58.403 -17.515
67 HO3 A2G 10 HO3 A2G 10 4.545 -60.442 -17.899
68 H4 A2G 10 H4 A2G 10 5.284 -58.978 -15.327
69 HO4 A2G 10 HO4 A2G 10 7.117 -60.029 -15.600
70 H5 A2G 10 H5 A2G 10 5.092 -56.579 -15.815
71 H6 A2G 10 H6 A2G 10 7.760 -56.653 -14.506
72 H8 A2G 10 H8 A2G 10 5.188 -59.506 -22.287
73 H8A A2G 10 H8A A2G 10 6.501 -58.538 -22.958
74 H8B A2G 10 H8B A2G 10 5.089 -57.745 -22.258
75 H14 A2G 10 H14 A2G 10 6.254 -55.924 -13.948
76 H15 A2G 10 H15 A2G 10 7.304 -58.298 -13.320
77 H1 A2G 11 H1 A2G 11 9.920 -50.959 -21.700
78 H2 A2G 11 H2 A2G 11 9.668 -48.834 -20.492
79 HN2 A2G 11 HN2 A2G 11 8.812 -51.130 -18.827
80 H3 A2G 11 H3 A2G 11 6.871 -49.816 -19.856
81 HO3 A2G 11 HO3 A2G 11 6.837 -47.518 -19.134
82 H4 A2G 11 H4 A2G 11 6.088 -48.021 -21.296
83 HO4 A2G 11 HO4 A2G 11 7.793 -46.948 -22.569
84 H5 A2G 11 H5 A2G 11 6.546 -50.166 -22.399
85 H6 A2G 11 H6 A2G 11 6.594 -49.369 -24.622
86 H8 A2G 11 H8 A2G 11 10.478 -51.939 -17.429
87 H8A A2G 11 H8A A2G 11 10.244 -50.536 -16.386
88 H8B A2G 11 H8B A2G 11 11.841 -50.889 -17.044
89 H14 A2G 11 H14 A2G 11 5.994 -47.985 -23.708
90 H15 A2G 11 H15 A2G 11 8.589 -48.452 -24.712
Start of MODEL 10
1 H1 ACE 1 H1 ACE 1 -2.440 -51.891 -18.738
2 H2 ACE 1 H2 ACE 1 -1.427 -50.499 -18.362
3 H3 ACE 1 H3 ACE 1 -1.658 -51.771 -17.163
4 HA PRO 2 HA PRO 2 0.756 -54.133 -20.716
5 HB2 PRO 2 HB2 PRO 2 1.755 -52.064 -22.454
6 HB3 PRO 2 HB3 PRO 2 0.679 -53.410 -22.860
7 HG2 PRO 2 HG2 PRO 2 0.040 -50.609 -22.338
8 HG3 PRO 2 HG3 PRO 2 -0.915 -51.853 -23.158
9 HD2 PRO 2 HD2 PRO 2 -1.553 -50.866 -20.683
10 HD3 PRO 2 HD3 PRO 2 -1.973 -52.511 -21.212
11 H THR 3 H THR 3 3.057 -54.409 -20.798
12 HA THR 3 HA THR 3 4.697 -52.301 -19.580
13 HB THR 3 HB THR 3 5.677 -53.902 -17.975
14 HG21 THR 3 HG21 THR 3 3.980 -53.685 -16.393
15 HG22 THR 3 HG22 THR 3 2.710 -54.066 -17.557
16 HG23 THR 3 HG23 THR 3 3.487 -52.483 -17.586
17 H THR 4 H THR 4 7.069 -53.408 -19.366
18 HA THR 4 HA THR 4 7.621 -54.885 -21.855
19 HB THR 4 HB THR 4 9.467 -53.386 -22.400
20 HG21 THR 4 HG21 THR 4 6.894 -52.855 -22.877
21 HG22 THR 4 HG22 THR 4 8.166 -51.724 -23.337
22 HG23 THR 4 HG23 THR 4 7.247 -51.464 -21.854
23 H THR 5 H THR 5 9.568 -56.087 -21.835
24 HA THR 5 HA THR 5 10.335 -56.982 -19.186
25 HB THR 5 HB THR 5 10.478 -58.881 -20.383
26 HG1 THR 5 HG1 THR 5 12.464 -59.250 -21.132
27 HG21 THR 5 HG21 THR 5 10.541 -58.868 -22.881
28 HG22 THR 5 HG22 THR 5 10.687 -57.111 -22.833
29 HG23 THR 5 HG23 THR 5 9.229 -57.893 -22.222
30 HA PRO 6 HA PRO 6 14.035 -54.836 -18.331
31 HB2 PRO 6 HB2 PRO 6 15.831 -57.080 -18.509
32 HB3 PRO 6 HB3 PRO 6 15.178 -56.313 -17.053
33 HG2 PRO 6 HG2 PRO 6 14.344 -58.767 -18.399
34 HG3 PRO 6 HG3 PRO 6 14.024 -58.218 -16.747
35 HD2 PRO 6 HD2 PRO 6 12.096 -58.316 -18.692
36 HD3 PRO 6 HD3 PRO 6 12.054 -57.163 -17.338
37 H LEU 7 H LEU 7 14.348 -53.568 -20.153
38 HA LEU 7 HA LEU 7 16.543 -54.264 -21.861
39 HB2 LEU 7 HB2 LEU 7 13.897 -54.945 -22.747
40 HB3 LEU 7 HB3 LEU 7 14.545 -53.664 -23.771
41 HG LEU 7 HG LEU 7 16.044 -56.205 -23.074
42 HD11 LEU 7 HD11 LEU 7 14.106 -55.529 -25.227
43 HD12 LEU 7 HD12 LEU 7 14.499 -57.095 -24.517
44 HD13 LEU 7 HD13 LEU 7 15.565 -56.384 -25.728
45 HD21 LEU 7 HD21 LEU 7 16.867 -53.702 -24.132
46 HD22 LEU 7 HD22 LEU 7 16.869 -54.843 -25.477
47 HD23 LEU 7 HD23 LEU 7 17.814 -55.186 -24.028
48 H LYS 8 H LYS 8 17.497 -52.343 -21.353
49 HA LYS 8 HA LYS 8 16.422 -49.970 -22.627
50 HB2 LYS 8 HB2 LYS 8 15.653 -50.328 -20.040
51 HB3 LYS 8 HB3 LYS 8 17.159 -49.434 -19.821
52 HG2 LYS 8 HG2 LYS 8 14.916 -48.583 -21.676
53 HG3 LYS 8 HG3 LYS 8 15.170 -47.936 -20.054
54 HD2 LYS 8 HD2 LYS 8 17.453 -47.211 -20.733
55 HD3 LYS 8 HD3 LYS 8 17.122 -47.779 -22.370
56 HE2 LYS 8 HE2 LYS 8 16.619 -45.466 -22.448
57 HE3 LYS 8 HE3 LYS 8 15.046 -46.247 -22.283
58 HZ1 LYS 8 HZ1 LYS 8 14.902 -45.675 -20.057
59 HZ2 LYS 8 HZ2 LYS 8 15.600 -44.291 -20.753
60 HZ3 LYS 8 HZ3 LYS 8 16.568 -45.398 -19.903
61 HN1 NH2 9 HN1 NH2 9 18.940 -51.704 -22.744
62 HN2 NH2 9 HN2 NH2 9 20.074 -50.449 -22.885
63 H1 A2G 10 H1 A2G 10 6.433 -55.812 -19.033
64 H2 A2G 10 H2 A2G 10 6.247 -58.244 -18.732
65 HN2 A2G 10 HN2 A2G 10 4.068 -57.254 -20.475
66 H3 A2G 10 H3 A2G 10 3.337 -57.692 -18.088
67 HO3 A2G 10 HO3 A2G 10 4.649 -60.116 -17.661
68 H4 A2G 10 H4 A2G 10 3.874 -58.387 -15.822
69 HO4 A2G 10 HO4 A2G 10 6.546 -58.339 -15.952
70 H5 A2G 10 H5 A2G 10 4.175 -56.001 -16.317
71 H6 A2G 10 H6 A2G 10 6.634 -56.414 -14.750
72 H8 A2G 10 H8 A2G 10 4.471 -59.095 -22.762
73 H8A A2G 10 H8A A2G 10 5.908 -58.219 -23.285
74 H8B A2G 10 H8B A2G 10 4.499 -57.333 -22.703
75 H14 A2G 10 H14 A2G 10 5.138 -55.599 -14.296
76 H15 A2G 10 H15 A2G 10 5.567 -57.563 -13.125
77 H1 A2G 11 H1 A2G 11 11.117 -53.052 -20.945
78 H2 A2G 11 H2 A2G 11 12.255 -51.275 -19.685
79 HN2 A2G 11 HN2 A2G 11 9.939 -52.345 -18.179
80 H3 A2G 11 H3 A2G 11 9.483 -50.102 -19.321
81 HO3 A2G 11 HO3 A2G 11 11.871 -48.786 -18.745
82 H4 A2G 11 H4 A2G 11 10.236 -48.291 -20.756
83 HO4 A2G 11 HO4 A2G 11 12.319 -48.037 -20.704
84 H5 A2G 11 H5 A2G 11 9.228 -50.218 -21.894
85 H6 A2G 11 H6 A2G 11 9.977 -49.713 -24.071
86 H8 A2G 11 H8 A2G 11 10.497 -54.021 -16.674
87 H8A A2G 11 H8A A2G 11 11.188 -52.796 -15.612
88 H8B A2G 11 H8B A2G 11 12.173 -54.158 -16.145
89 H14 A2G 11 H14 A2G 11 10.418 -48.269 -23.159
90 H15 A2G 11 H15 A2G 11 12.120 -50.472 -23.698
Start of MODEL 11
1 H1 ACE 1 H1 ACE 1 -1.083 -55.828 -18.272
2 H2 ACE 1 H2 ACE 1 -0.335 -54.807 -17.043
3 H3 ACE 1 H3 ACE 1 0.372 -56.374 -17.438
4 HA PRO 2 HA PRO 2 0.954 -53.891 -21.626
5 HB2 PRO 2 HB2 PRO 2 0.433 -51.140 -20.949
6 HB3 PRO 2 HB3 PRO 2 -0.392 -52.147 -22.146
7 HG2 PRO 2 HG2 PRO 2 -1.213 -51.426 -19.439
8 HG3 PRO 2 HG3 PRO 2 -2.180 -52.041 -20.787
9 HD2 PRO 2 HD2 PRO 2 -1.594 -53.530 -18.564
10 HD3 PRO 2 HD3 PRO 2 -1.885 -54.246 -20.165
11 H THR 3 H THR 3 3.061 -54.491 -20.814
12 HA THR 3 HA THR 3 4.673 -52.152 -20.083
13 HB THR 3 HB THR 3 5.869 -53.448 -18.343
14 HG21 THR 3 HG21 THR 3 4.307 -53.023 -16.664
15 HG22 THR 3 HG22 THR 3 2.955 -53.602 -17.638
16 HG23 THR 3 HG23 THR 3 3.679 -52.030 -17.980
17 H THR 4 H THR 4 7.059 -52.708 -20.222
18 HA THR 4 HA THR 4 7.471 -54.412 -22.592
19 HB THR 4 HB THR 4 9.794 -53.078 -22.384
20 HG21 THR 4 HG21 THR 4 8.264 -53.060 -24.322
21 HG22 THR 4 HG22 THR 4 8.838 -51.434 -23.956
22 HG23 THR 4 HG23 THR 4 7.212 -51.923 -23.479
23 H THR 5 H THR 5 9.510 -55.635 -22.695
24 HA THR 5 HA THR 5 9.933 -57.092 -20.225
25 HB THR 5 HB THR 5 11.696 -58.215 -21.901
26 HG1 THR 5 HG1 THR 5 11.074 -57.954 -23.984
27 HG21 THR 5 HG21 THR 5 9.592 -59.517 -22.787
28 HG22 THR 5 HG22 THR 5 8.723 -58.510 -21.627
29 HG23 THR 5 HG23 THR 5 10.005 -59.588 -21.074
30 HA PRO 6 HA PRO 6 13.508 -55.255 -18.524
31 HB2 PRO 6 HB2 PRO 6 15.218 -57.559 -18.771
32 HB3 PRO 6 HB3 PRO 6 14.382 -56.966 -17.327
33 HG2 PRO 6 HG2 PRO 6 13.664 -59.149 -19.129
34 HG3 PRO 6 HG3 PRO 6 13.118 -58.820 -17.479
35 HD2 PRO 6 HD2 PRO 6 11.509 -58.523 -19.676
36 HD3 PRO 6 HD3 PRO 6 11.306 -57.572 -18.185
37 H LEU 7 H LEU 7 14.229 -53.756 -19.997
38 HA LEU 7 HA LEU 7 16.582 -54.386 -21.510
39 HB2 LEU 7 HB2 LEU 7 14.440 -55.086 -22.909
40 HB3 LEU 7 HB3 LEU 7 14.386 -53.358 -23.255
41 HG LEU 7 HG LEU 7 15.716 -54.451 -24.972
42 HD11 LEU 7 HD11 LEU 7 16.448 -52.222 -23.918
43 HD12 LEU 7 HD12 LEU 7 17.667 -53.099 -24.843
44 HD13 LEU 7 HD13 LEU 7 17.686 -53.158 -23.080
45 HD21 LEU 7 HD21 LEU 7 17.154 -56.155 -24.548
46 HD22 LEU 7 HD22 LEU 7 16.413 -56.206 -22.949
47 HD23 LEU 7 HD23 LEU 7 17.902 -55.296 -23.201
48 H LYS 8 H LYS 8 17.625 -52.693 -20.574
49 HA LYS 8 HA LYS 8 16.392 -50.070 -20.412
50 HB2 LYS 8 HB2 LYS 8 18.777 -49.483 -19.575
51 HB3 LYS 8 HB3 LYS 8 17.766 -50.519 -18.566
52 HG2 LYS 8 HG2 LYS 8 18.954 -52.454 -19.131
53 HG3 LYS 8 HG3 LYS 8 19.584 -51.750 -20.621
54 HD2 LYS 8 HD2 LYS 8 20.343 -50.416 -18.067
55 HD3 LYS 8 HD3 LYS 8 21.090 -51.975 -18.411
56 HE2 LYS 8 HE2 LYS 8 22.047 -51.194 -20.438
57 HE3 LYS 8 HE3 LYS 8 21.015 -49.765 -20.466
58 HZ1 LYS 8 HZ1 LYS 8 22.187 -49.311 -18.195
59 HZ2 LYS 8 HZ2 LYS 8 22.942 -48.887 -19.657
60 HZ3 LYS 8 HZ3 LYS 8 23.396 -50.307 -18.844
61 HN1 NH2 9 HN1 NH2 9 16.152 -49.432 -22.695
62 HN2 NH2 9 HN2 NH2 9 17.449 -49.465 -23.790
63 H1 A2G 10 H1 A2G 10 6.667 -55.457 -18.869
64 H2 A2G 10 H2 A2G 10 6.530 -57.823 -18.221
65 HN2 A2G 10 HN2 A2G 10 4.499 -57.069 -20.239
66 H3 A2G 10 H3 A2G 10 3.575 -57.285 -17.817
67 HO3 A2G 10 HO3 A2G 10 3.521 -59.355 -18.054
68 H4 A2G 10 H4 A2G 10 4.002 -57.620 -15.448
69 HO4 A2G 10 HO4 A2G 10 5.836 -59.047 -15.889
70 H5 A2G 10 H5 A2G 10 4.267 -55.323 -16.275
71 H6 A2G 10 H6 A2G 10 6.579 -55.873 -14.406
72 H8 A2G 10 H8 A2G 10 4.719 -59.420 -21.996
73 H8A A2G 10 H8A A2G 10 6.268 -58.892 -22.654
74 H8B A2G 10 H8B A2G 10 4.980 -57.718 -22.377
75 H14 A2G 10 H14 A2G 10 5.531 -54.456 -14.452
76 H15 A2G 10 H15 A2G 10 5.171 -56.270 -12.826
77 H1 A2G 11 H1 A2G 11 10.748 -51.516 -21.380
78 H2 A2G 11 H2 A2G 11 10.790 -49.455 -20.044
79 HN2 A2G 11 HN2 A2G 11 9.134 -51.533 -18.736
80 H3 A2G 11 H3 A2G 11 7.775 -49.749 -19.950
81 HO3 A2G 11 HO3 A2G 11 9.487 -48.577 -18.353
82 H4 A2G 11 H4 A2G 11 7.697 -47.751 -21.331
83 HO4 A2G 11 HO4 A2G 11 10.376 -47.735 -20.701
84 H5 A2G 11 H5 A2G 11 7.828 -49.887 -22.534
85 H6 A2G 11 H6 A2G 11 8.412 -49.009 -24.635
86 H8 A2G 11 H8 A2G 11 10.274 -52.785 -17.140
87 H8A A2G 11 H8A A2G 11 10.219 -51.386 -16.068
88 H8B A2G 11 H8B A2G 11 11.767 -52.132 -16.467
89 H14 A2G 11 H14 A2G 11 8.071 -47.554 -23.699
90 H15 A2G 11 H15 A2G 11 10.480 -48.553 -24.638
Start of MODEL 12
1 H1 ACE 1 H1 ACE 1 -2.274 -52.235 -18.989
2 H2 ACE 1 H2 ACE 1 -1.124 -50.914 -18.771
3 H3 ACE 1 H3 ACE 1 -1.290 -52.152 -17.527
4 HA PRO 2 HA PRO 2 0.973 -54.263 -21.200
5 HB2 PRO 2 HB2 PRO 2 1.715 -52.271 -23.146
6 HB3 PRO 2 HB3 PRO 2 0.612 -53.641 -23.346
7 HG2 PRO 2 HG2 PRO 2 -0.117 -50.977 -23.343
8 HG3 PRO 2 HG3 PRO 2 -1.208 -52.345 -23.084
9 HD2 PRO 2 HD2 PRO 2 -0.043 -50.461 -21.086
10 HD3 PRO 2 HD3 PRO 2 -1.592 -51.334 -21.050
11 H THR 3 H THR 3 2.743 -54.556 -19.901
12 HA THR 3 HA THR 3 4.703 -52.387 -19.636
13 HB THR 3 HB THR 3 5.691 -53.742 -17.873
14 HG21 THR 3 HG21 THR 3 3.098 -52.683 -17.833
15 HG22 THR 3 HG22 THR 3 4.086 -53.091 -16.430
16 HG23 THR 3 HG23 THR 3 2.945 -54.269 -17.078
17 H THR 4 H THR 4 6.992 -52.868 -19.930
18 HA THR 4 HA THR 4 7.402 -54.693 -22.208
19 HB THR 4 HB THR 4 9.492 -53.361 -22.567
20 HG21 THR 4 HG21 THR 4 7.259 -51.380 -22.382
21 HG22 THR 4 HG22 THR 4 7.030 -52.797 -23.406
22 HG23 THR 4 HG23 THR 4 8.370 -51.692 -23.715
23 H THR 5 H THR 5 9.556 -55.773 -22.299
24 HA THR 5 HA THR 5 10.044 -57.138 -19.788
25 HB THR 5 HB THR 5 11.880 -58.210 -21.406
26 HG1 THR 5 HG1 THR 5 9.983 -56.924 -23.061
27 HG21 THR 5 HG21 THR 5 9.980 -59.398 -20.406
28 HG22 THR 5 HG22 THR 5 10.137 -59.823 -22.111
29 HG23 THR 5 HG23 THR 5 8.892 -58.685 -21.597
30 HA PRO 6 HA PRO 6 13.472 -55.032 -18.103
31 HB2 PRO 6 HB2 PRO 6 15.320 -57.236 -18.249
32 HB3 PRO 6 HB3 PRO 6 14.428 -56.648 -16.838
33 HG2 PRO 6 HG2 PRO 6 13.868 -58.928 -18.574
34 HG3 PRO 6 HG3 PRO 6 13.278 -58.576 -16.945
35 HD2 PRO 6 HD2 PRO 6 11.688 -58.449 -19.171
36 HD3 PRO 6 HD3 PRO 6 11.406 -57.463 -17.718
37 H LEU 7 H LEU 7 14.151 -53.538 -19.596
38 HA LEU 7 HA LEU 7 16.548 -54.090 -21.070
39 HB2 LEU 7 HB2 LEU 7 14.443 -54.916 -22.469
40 HB3 LEU 7 HB3 LEU 7 14.341 -53.200 -22.868
41 HG LEU 7 HG LEU 7 16.934 -53.465 -23.298
42 HD11 LEU 7 HD11 LEU 7 17.713 -55.596 -23.770
43 HD12 LEU 7 HD12 LEU 7 16.107 -56.209 -24.163
44 HD13 LEU 7 HD13 LEU 7 16.569 -55.968 -22.479
45 HD21 LEU 7 HD21 LEU 7 15.317 -52.827 -25.017
46 HD22 LEU 7 HD22 LEU 7 14.777 -54.499 -25.166
47 HD23 LEU 7 HD23 LEU 7 16.406 -54.050 -25.671
48 H LYS 8 H LYS 8 15.968 -51.956 -23.022
49 HA LYS 8 HA LYS 8 15.408 -49.586 -21.444
50 HB2 LYS 8 HB2 LYS 8 18.187 -50.190 -22.472
51 HB3 LYS 8 HB3 LYS 8 17.652 -48.575 -22.004
52 HG2 LYS 8 HG2 LYS 8 16.954 -49.633 -19.767
53 HG3 LYS 8 HG3 LYS 8 17.914 -51.027 -20.261
54 HD2 LYS 8 HD2 LYS 8 19.556 -49.840 -19.165
55 HD3 LYS 8 HD3 LYS 8 19.722 -49.120 -20.767
56 HE2 LYS 8 HE2 LYS 8 18.037 -47.365 -20.024
57 HE3 LYS 8 HE3 LYS 8 18.217 -48.005 -18.390
58 HZ1 LYS 8 HZ1 LYS 8 20.016 -46.370 -19.931
59 HZ2 LYS 8 HZ2 LYS 8 20.773 -47.703 -19.199
60 HZ3 LYS 8 HZ3 LYS 8 19.914 -46.584 -18.251
61 HN1 NH2 9 HN1 NH2 9 17.257 -48.325 -24.081
62 HN2 NH2 9 HN2 NH2 9 16.761 -49.468 -25.234
63 H1 A2G 10 H1 A2G 10 6.573 -55.685 -18.809
64 H2 A2G 10 H2 A2G 10 6.584 -58.083 -18.268
65 HN2 A2G 10 HN2 A2G 10 4.333 -57.346 -20.047
66 H3 A2G 10 H3 A2G 10 3.660 -57.685 -17.575
67 HO3 A2G 10 HO3 A2G 10 5.407 -59.914 -17.423
68 H4 A2G 10 H4 A2G 10 4.314 -58.110 -15.274
69 HO4 A2G 10 HO4 A2G 10 6.055 -59.275 -15.135
70 H5 A2G 10 H5 A2G 10 4.416 -55.769 -16.007
71 H6 A2G 10 H6 A2G 10 6.951 -55.890 -14.491
72 H8 A2G 10 H8 A2G 10 4.740 -59.513 -22.162
73 H8A A2G 10 H8A A2G 10 6.107 -58.564 -22.745
74 H8B A2G 10 H8B A2G 10 4.635 -57.753 -22.208
75 H14 A2G 10 H14 A2G 10 5.438 -55.076 -14.089
76 H15 A2G 10 H15 A2G 10 5.135 -56.672 -12.781
77 H1 A2G 11 H1 A2G 11 10.967 -52.981 -20.963
78 H2 A2G 11 H2 A2G 11 11.980 -51.184 -19.627
79 HN2 A2G 11 HN2 A2G 11 9.501 -52.265 -18.423
80 H3 A2G 11 H3 A2G 11 9.206 -49.965 -19.618
81 HO3 A2G 11 HO3 A2G 11 10.052 -48.549 -18.266
82 H4 A2G 11 H4 A2G 11 10.149 -48.204 -21.003
83 HO4 A2G 11 HO4 A2G 11 12.270 -48.259 -21.628
84 H5 A2G 11 H5 A2G 11 9.247 -50.149 -22.200
85 H6 A2G 11 H6 A2G 11 10.483 -49.896 -24.299
86 H8 A2G 11 H8 A2G 11 9.927 -53.811 -16.701
87 H8A A2G 11 H8A A2G 11 10.247 -52.411 -15.677
88 H8B A2G 11 H8B A2G 11 11.461 -53.681 -15.840
89 H14 A2G 11 H14 A2G 11 10.356 -48.328 -23.502
90 H15 A2G 11 H15 A2G 11 12.439 -48.428 -22.917
Start of MODEL 13
1 H1 ACE 1 H1 ACE 1 -1.480 -51.886 -17.256
2 H2 ACE 1 H2 ACE 1 -2.359 -52.982 -18.322
3 H3 ACE 1 H3 ACE 1 -1.587 -51.541 -18.982
4 HA PRO 2 HA PRO 2 1.012 -55.626 -19.214
5 HB2 PRO 2 HB2 PRO 2 1.468 -54.874 -21.958
6 HB3 PRO 2 HB3 PRO 2 0.625 -56.303 -21.339
7 HG2 PRO 2 HG2 PRO 2 -0.467 -53.805 -22.385
8 HG3 PRO 2 HG3 PRO 2 -1.245 -55.380 -22.180
9 HD2 PRO 2 HD2 PRO 2 -1.841 -53.203 -20.627
10 HD3 PRO 2 HD3 PRO 2 -1.998 -54.879 -20.054
11 H THR 3 H THR 3 3.232 -55.579 -19.067
12 HA THR 3 HA THR 3 4.484 -52.925 -19.146
13 HB THR 3 HB THR 3 6.274 -53.944 -17.830
14 HG21 THR 3 HG21 THR 3 5.032 -53.748 -15.956
15 HG22 THR 3 HG22 THR 3 4.083 -55.178 -16.361
16 HG23 THR 3 HG23 THR 3 3.625 -53.602 -17.007
17 H THR 4 H THR 4 7.002 -53.229 -19.679
18 HA THR 4 HA THR 4 7.270 -54.838 -22.134
19 HB THR 4 HB THR 4 8.643 -52.678 -22.909
20 HG21 THR 4 HG21 THR 4 6.628 -51.983 -24.156
21 HG22 THR 4 HG22 THR 4 5.627 -52.952 -23.075
22 HG23 THR 4 HG23 THR 4 6.789 -53.739 -24.143
23 H THR 5 H THR 5 9.632 -54.793 -22.887
24 HA THR 5 HA THR 5 11.276 -55.530 -20.616
25 HB THR 5 HB THR 5 12.515 -55.432 -23.290
26 HG1 THR 5 HG1 THR 5 10.570 -57.401 -22.845
27 HG21 THR 5 HG21 THR 5 13.379 -57.538 -22.618
28 HG22 THR 5 HG22 THR 5 12.088 -57.778 -21.441
29 HG23 THR 5 HG23 THR 5 13.340 -56.574 -21.141
30 HA PRO 6 HA PRO 6 13.018 -51.406 -20.532
31 HB2 PRO 6 HB2 PRO 6 14.473 -52.182 -18.168
32 HB3 PRO 6 HB3 PRO 6 13.043 -51.144 -18.284
33 HG2 PRO 6 HG2 PRO 6 13.114 -53.657 -17.139
34 HG3 PRO 6 HG3 PRO 6 11.658 -52.807 -17.673
35 HD2 PRO 6 HD2 PRO 6 13.131 -55.033 -19.002
36 HD3 PRO 6 HD3 PRO 6 11.401 -54.629 -19.056
37 H LEU 7 H LEU 7 15.436 -50.693 -19.859
38 HA LEU 7 HA LEU 7 17.143 -51.896 -21.826
39 HB2 LEU 7 HB2 LEU 7 18.020 -49.947 -19.700
40 HB3 LEU 7 HB3 LEU 7 18.673 -50.165 -21.325
41 HG LEU 7 HG LEU 7 15.968 -49.024 -20.579
42 HD11 LEU 7 HD11 LEU 7 17.618 -47.526 -22.438
43 HD12 LEU 7 HD12 LEU 7 18.494 -47.848 -20.941
44 HD13 LEU 7 HD13 LEU 7 16.941 -47.014 -20.892
45 HD21 LEU 7 HD21 LEU 7 17.097 -49.980 -23.209
46 HD22 LEU 7 HD22 LEU 7 15.878 -48.706 -23.157
47 HD23 LEU 7 HD23 LEU 7 15.511 -50.305 -22.510
48 H LYS 8 H LYS 8 17.403 -54.056 -21.141
49 HA LYS 8 HA LYS 8 18.563 -54.615 -18.540
50 HB2 LYS 8 HB2 LYS 8 18.523 -56.957 -19.286
51 HB3 LYS 8 HB3 LYS 8 16.957 -56.186 -19.542
52 HG2 LYS 8 HG2 LYS 8 17.774 -55.668 -21.917
53 HG3 LYS 8 HG3 LYS 8 19.083 -56.806 -21.598
54 HD2 LYS 8 HD2 LYS 8 16.118 -57.421 -21.430
55 HD3 LYS 8 HD3 LYS 8 17.213 -57.953 -22.705
56 HE2 LYS 8 HE2 LYS 8 17.287 -59.821 -21.351
57 HE3 LYS 8 HE3 LYS 8 18.594 -58.888 -20.622
58 HZ1 LYS 8 HZ1 LYS 8 15.783 -58.712 -19.705
59 HZ2 LYS 8 HZ2 LYS 8 17.173 -58.127 -18.922
60 HZ3 LYS 8 HZ3 LYS 8 16.901 -59.800 -19.039
61 HN1 NH2 9 HN1 NH2 9 19.940 -53.316 -21.240
62 HN2 NH2 9 HN2 NH2 9 21.418 -54.151 -21.303
63 H1 A2G 10 H1 A2G 10 7.389 -55.539 -18.973
64 H2 A2G 10 H2 A2G 10 8.128 -57.872 -18.743
65 HN2 A2G 10 HN2 A2G 10 5.407 -57.764 -19.905
66 H3 A2G 10 H3 A2G 10 5.433 -58.336 -17.436
67 HO3 A2G 10 HO3 A2G 10 7.102 -60.301 -17.047
68 H4 A2G 10 H4 A2G 10 6.675 -58.714 -15.381
69 HO4 A2G 10 HO4 A2G 10 8.811 -58.778 -15.339
70 H5 A2G 10 H5 A2G 10 6.012 -56.393 -15.829
71 H6 A2G 10 H6 A2G 10 8.846 -56.175 -14.847
72 H8 A2G 10 H8 A2G 10 5.608 -59.303 -22.133
73 H8A A2G 10 H8A A2G 10 6.846 -58.489 -23.088
74 H8B A2G 10 H8B A2G 10 5.542 -57.555 -22.355
75 H14 A2G 10 H14 A2G 10 7.390 -55.396 -14.224
76 H15 A2G 10 H15 A2G 10 6.718 -57.631 -13.695
77 H1 A2G 11 H1 A2G 11 9.007 -50.663 -22.493
78 H2 A2G 11 H2 A2G 11 8.484 -48.496 -21.458
79 HN2 A2G 11 HN2 A2G 11 8.520 -50.726 -19.508
80 H3 A2G 11 H3 A2G 11 6.135 -49.944 -20.204
81 HO3 A2G 11 HO3 A2G 11 7.149 -47.306 -20.082
82 H4 A2G 11 H4 A2G 11 4.730 -48.557 -21.622
83 HO4 A2G 11 HO4 A2G 11 7.099 -47.259 -21.979
84 H5 A2G 11 H5 A2G 11 5.472 -50.687 -22.594
85 H6 A2G 11 H6 A2G 11 5.090 -50.168 -24.913
86 H8 A2G 11 H8 A2G 11 10.540 -50.852 -18.310
87 H8A A2G 11 H8A A2G 11 9.915 -49.522 -17.334
88 H8B A2G 11 H8B A2G 11 11.483 -49.373 -18.128
89 H14 A2G 11 H14 A2G 11 4.164 -48.995 -23.976
90 H15 A2G 11 H15 A2G 11 6.545 -47.969 -24.244
Start of MODEL 14
1 H1 ACE 1 H1 ACE 1 -0.323 -54.087 -16.453
2 H2 ACE 1 H2 ACE 1 0.490 -55.651 -16.427
3 H3 ACE 1 H3 ACE 1 -1.032 -55.463 -17.297
4 HA PRO 2 HA PRO 2 0.726 -54.447 -21.173
5 HB2 PRO 2 HB2 PRO 2 0.013 -51.658 -21.280
6 HB3 PRO 2 HB3 PRO 2 -0.773 -53.021 -22.092
7 HG2 PRO 2 HG2 PRO 2 -1.552 -51.603 -19.661
8 HG3 PRO 2 HG3 PRO 2 -2.513 -52.644 -20.721
9 HD2 PRO 2 HD2 PRO 2 -1.733 -53.385 -18.201
10 HD3 PRO 2 HD3 PRO 2 -2.023 -54.551 -19.512
11 H THR 3 H THR 3 2.928 -54.545 -20.856
12 HA THR 3 HA THR 3 4.301 -51.979 -20.491
13 HB THR 3 HB THR 3 5.960 -53.180 -18.964
14 HG21 THR 3 HG21 THR 3 3.133 -52.857 -17.917
15 HG22 THR 3 HG22 THR 3 4.251 -51.520 -18.190
16 HG23 THR 3 HG23 THR 3 4.623 -52.746 -16.979
17 H THR 4 H THR 4 6.889 -52.875 -20.469
18 HA THR 4 HA THR 4 7.107 -54.122 -23.134
19 HB THR 4 HB THR 4 9.452 -53.133 -23.049
20 HG21 THR 4 HG21 THR 4 8.699 -50.996 -23.780
21 HG22 THR 4 HG22 THR 4 7.270 -51.065 -22.749
22 HG23 THR 4 HG23 THR 4 7.385 -52.106 -24.168
23 H THR 5 H THR 5 10.105 -54.227 -22.094
24 HA THR 5 HA THR 5 9.995 -56.537 -20.339
25 HB THR 5 HB THR 5 9.993 -56.938 -23.135
26 HG1 THR 5 HG1 THR 5 10.085 -59.074 -22.468
27 HG21 THR 5 HG21 THR 5 12.647 -57.679 -21.874
28 HG22 THR 5 HG22 THR 5 12.421 -56.384 -23.048
29 HG23 THR 5 HG23 THR 5 12.127 -58.058 -23.516
30 HA PRO 6 HA PRO 6 13.793 -55.136 -18.722
31 HB2 PRO 6 HB2 PRO 6 15.260 -57.573 -19.170
32 HB3 PRO 6 HB3 PRO 6 14.548 -56.986 -17.660
33 HG2 PRO 6 HG2 PRO 6 13.546 -58.986 -19.535
34 HG3 PRO 6 HG3 PRO 6 13.106 -58.700 -17.845
35 HD2 PRO 6 HD2 PRO 6 11.440 -58.131 -19.944
36 HD3 PRO 6 HD3 PRO 6 11.394 -57.249 -18.400
37 H LEU 7 H LEU 7 14.425 -53.631 -20.288
38 HA LEU 7 HA LEU 7 16.742 -54.317 -21.833
39 HB2 LEU 7 HB2 LEU 7 14.174 -54.522 -23.111
40 HB3 LEU 7 HB3 LEU 7 15.087 -53.195 -23.830
41 HG LEU 7 HG LEU 7 16.199 -55.980 -23.392
42 HD11 LEU 7 HD11 LEU 7 14.559 -56.265 -25.067
43 HD12 LEU 7 HD12 LEU 7 16.038 -55.969 -25.981
44 HD13 LEU 7 HD13 LEU 7 14.863 -54.672 -25.760
45 HD21 LEU 7 HD21 LEU 7 17.468 -54.391 -25.436
46 HD22 LEU 7 HD22 LEU 7 18.177 -55.065 -23.967
47 HD23 LEU 7 HD23 LEU 7 17.417 -53.474 -23.931
48 H LYS 8 H LYS 8 17.969 -52.612 -21.364
49 HA LYS 8 HA LYS 8 16.798 -50.004 -20.863
50 HB2 LYS 8 HB2 LYS 8 18.845 -51.145 -19.679
51 HB3 LYS 8 HB3 LYS 8 19.750 -50.489 -21.043
52 HG2 LYS 8 HG2 LYS 8 19.880 -48.680 -19.617
53 HG3 LYS 8 HG3 LYS 8 18.361 -48.292 -20.425
54 HD2 LYS 8 HD2 LYS 8 17.131 -49.466 -18.598
55 HD3 LYS 8 HD3 LYS 8 18.667 -49.724 -17.769
56 HE2 LYS 8 HE2 LYS 8 17.833 -47.757 -16.772
57 HE3 LYS 8 HE3 LYS 8 18.970 -47.155 -17.979
58 HZ1 LYS 8 HZ1 LYS 8 17.087 -45.897 -18.356
59 HZ2 LYS 8 HZ2 LYS 8 16.024 -47.189 -18.063
60 HZ3 LYS 8 HZ3 LYS 8 16.922 -47.134 -19.505
61 HN1 NH2 9 HN1 NH2 9 17.718 -48.097 -23.527
62 HN2 NH2 9 HN2 NH2 9 16.307 -48.706 -22.805
63 H1 A2G 10 H1 A2G 10 6.678 -55.046 -18.477
64 H2 A2G 10 H2 A2G 10 6.433 -57.371 -17.720
65 HN2 A2G 10 HN2 A2G 10 4.934 -56.942 -20.238
66 H3 A2G 10 H3 A2G 10 3.466 -56.943 -18.171
67 HO3 A2G 10 HO3 A2G 10 4.982 -59.117 -17.162
68 H4 A2G 10 H4 A2G 10 3.239 -57.110 -15.757
69 HO4 A2G 10 HO4 A2G 10 5.126 -57.242 -14.481
70 H5 A2G 10 H5 A2G 10 3.658 -54.860 -16.647
71 H6 A2G 10 H6 A2G 10 5.474 -54.826 -14.302
72 H8 A2G 10 H8 A2G 10 6.003 -59.143 -21.808
73 H8A A2G 10 H8A A2G 10 7.593 -58.408 -22.016
74 H8B A2G 10 H8B A2G 10 6.140 -57.418 -22.150
75 H14 A2G 10 H14 A2G 10 3.982 -53.929 -14.581
76 H15 A2G 10 H15 A2G 10 2.900 -55.434 -13.611
77 H1 A2G 11 H1 A2G 11 10.926 -52.850 -21.584
78 H2 A2G 11 H2 A2G 11 11.878 -51.554 -19.725
79 HN2 A2G 11 HN2 A2G 11 9.482 -53.108 -18.941
80 H3 A2G 11 H3 A2G 11 9.047 -50.562 -19.293
81 HO3 A2G 11 HO3 A2G 11 11.498 -50.318 -17.950
82 H4 A2G 11 H4 A2G 11 9.870 -48.390 -20.007
83 HO4 A2G 11 HO4 A2G 11 11.920 -48.092 -19.794
84 H5 A2G 11 H5 A2G 11 9.039 -49.866 -21.785
85 H6 A2G 11 H6 A2G 11 10.041 -48.753 -23.639
86 H8 A2G 11 H8 A2G 11 9.968 -55.074 -17.816
87 H8A A2G 11 H8A A2G 11 10.373 -54.134 -16.380
88 H8B A2G 11 H8B A2G 11 11.554 -55.251 -17.064
89 H14 A2G 11 H14 A2G 11 10.194 -47.622 -22.294
90 H15 A2G 11 H15 A2G 11 12.211 -47.676 -22.946
Start of MODEL 15
1 H1 ACE 1 H1 ACE 1 -2.607 -52.973 -20.329
2 H2 ACE 1 H2 ACE 1 -1.850 -51.445 -19.877
3 H3 ACE 1 H3 ACE 1 -2.075 -52.709 -18.668
4 HA PRO 2 HA PRO 2 1.103 -54.803 -21.757
5 HB2 PRO 2 HB2 PRO 2 2.044 -52.662 -23.440
6 HB3 PRO 2 HB3 PRO 2 1.226 -54.156 -23.923
7 HG2 PRO 2 HG2 PRO 2 0.149 -51.459 -23.620
8 HG3 PRO 2 HG3 PRO 2 -0.507 -52.845 -24.501
9 HD2 PRO 2 HD2 PRO 2 -1.607 -51.890 -22.180
10 HD3 PRO 2 HD3 PRO 2 -1.726 -53.592 -22.685
11 H THR 3 H THR 3 3.342 -54.843 -21.359
12 HA THR 3 HA THR 3 4.573 -52.458 -20.167
13 HB THR 3 HB THR 3 5.392 -53.762 -18.240
14 HG21 THR 3 HG21 THR 3 2.425 -54.204 -18.292
15 HG22 THR 3 HG22 THR 3 3.052 -52.558 -18.383
16 HG23 THR 3 HG23 THR 3 3.434 -53.571 -16.991
17 H THR 4 H THR 4 6.958 -53.300 -19.441
18 HA THR 4 HA THR 4 8.042 -54.964 -21.616
19 HB THR 4 HB THR 4 9.837 -53.351 -22.016
20 HG21 THR 4 HG21 THR 4 7.398 -51.631 -22.109
21 HG22 THR 4 HG22 THR 4 7.361 -53.155 -22.995
22 HG23 THR 4 HG23 THR 4 8.594 -51.949 -23.365
23 H THR 5 H THR 5 10.067 -55.938 -21.146
24 HA THR 5 HA THR 5 10.430 -56.497 -18.325
25 HB THR 5 HB THR 5 10.951 -58.472 -19.268
26 HG1 THR 5 HG1 THR 5 13.233 -57.117 -20.259
27 HG21 THR 5 HG21 THR 5 9.970 -57.795 -21.388
28 HG22 THR 5 HG22 THR 5 11.461 -58.681 -21.705
29 HG23 THR 5 HG23 THR 5 11.438 -56.921 -21.825
30 HA PRO 6 HA PRO 6 13.709 -53.896 -17.101
31 HB2 PRO 6 HB2 PRO 6 15.704 -55.940 -16.729
32 HB3 PRO 6 HB3 PRO 6 14.736 -55.118 -15.497
33 HG2 PRO 6 HG2 PRO 6 14.378 -57.760 -16.686
34 HG3 PRO 6 HG3 PRO 6 13.721 -57.099 -15.182
35 HD2 PRO 6 HD2 PRO 6 12.187 -57.583 -17.400
36 HD3 PRO 6 HD3 PRO 6 11.802 -56.322 -16.206
37 H LEU 7 H LEU 7 14.226 -52.775 -18.974
38 HA LEU 7 HA LEU 7 16.743 -53.386 -20.204
39 HB2 LEU 7 HB2 LEU 7 14.340 -54.384 -21.455
40 HB3 LEU 7 HB3 LEU 7 15.118 -53.186 -22.490
41 HG LEU 7 HG LEU 7 16.722 -55.370 -21.169
42 HD11 LEU 7 HD11 LEU 7 16.475 -56.671 -23.263
43 HD12 LEU 7 HD12 LEU 7 15.308 -55.487 -23.852
44 HD13 LEU 7 HD13 LEU 7 14.928 -56.475 -22.440
45 HD21 LEU 7 HD21 LEU 7 18.309 -54.867 -22.905
46 HD22 LEU 7 HD22 LEU 7 17.777 -53.319 -22.246
47 HD23 LEU 7 HD23 LEU 7 17.130 -53.893 -23.783
48 H LYS 8 H LYS 8 16.742 -51.859 -22.397
49 HA LYS 8 HA LYS 8 16.400 -49.191 -21.307
50 HB2 LYS 8 HB2 LYS 8 17.521 -48.472 -23.396
51 HB3 LYS 8 HB3 LYS 8 18.437 -49.718 -22.548
52 HG2 LYS 8 HG2 LYS 8 16.672 -51.124 -24.219
53 HG3 LYS 8 HG3 LYS 8 17.279 -49.795 -25.207
54 HD2 LYS 8 HD2 LYS 8 19.598 -50.412 -24.603
55 HD3 LYS 8 HD3 LYS 8 18.983 -51.757 -23.642
56 HE2 LYS 8 HE2 LYS 8 19.691 -52.520 -25.883
57 HE3 LYS 8 HE3 LYS 8 17.956 -52.737 -25.656
58 HZ1 LYS 8 HZ1 LYS 8 17.490 -50.850 -26.946
59 HZ2 LYS 8 HZ2 LYS 8 18.677 -51.699 -27.816
60 HZ3 LYS 8 HZ3 LYS 8 19.100 -50.319 -26.921
61 HN1 NH2 9 HN1 NH2 9 13.644 -50.737 -23.422
62 HN2 NH2 9 HN2 NH2 9 14.860 -50.510 -24.583
63 H1 A2G 10 H1 A2G 10 6.492 -55.675 -18.883
64 H2 A2G 10 H2 A2G 10 6.472 -58.070 -18.330
65 HN2 A2G 10 HN2 A2G 10 4.613 -57.456 -20.553
66 H3 A2G 10 H3 A2G 10 3.456 -57.782 -18.289
67 HO3 A2G 10 HO3 A2G 10 5.283 -59.903 -18.083
68 H4 A2G 10 H4 A2G 10 3.611 -58.179 -15.896
69 HO4 A2G 10 HO4 A2G 10 5.341 -59.359 -15.514
70 H5 A2G 10 H5 A2G 10 3.785 -55.837 -16.613
71 H6 A2G 10 H6 A2G 10 5.927 -56.110 -14.526
72 H8 A2G 10 H8 A2G 10 5.300 -59.411 -22.443
73 H8A A2G 10 H8A A2G 10 6.954 -58.907 -22.791
74 H8B A2G 10 H8B A2G 10 5.671 -57.703 -22.678
75 H14 A2G 10 H14 A2G 10 4.564 -54.992 -14.583
76 H15 A2G 10 H15 A2G 10 3.217 -56.900 -14.302
77 H1 A2G 11 H1 A2G 11 11.159 -52.685 -20.356
78 H2 A2G 11 H2 A2G 11 11.888 -50.669 -19.153
79 HN2 A2G 11 HN2 A2G 11 9.431 -51.772 -17.923
80 H3 A2G 11 H3 A2G 11 9.005 -49.770 -19.420
81 HO3 A2G 11 HO3 A2G 11 9.560 -48.307 -18.028
82 H4 A2G 11 H4 A2G 11 9.849 -48.053 -20.919
83 HO4 A2G 11 HO4 A2G 11 12.026 -48.271 -19.775
84 H5 A2G 11 H5 A2G 11 9.236 -50.190 -21.963
85 H6 A2G 11 H6 A2G 11 10.381 -49.887 -24.024
86 H8 A2G 11 H8 A2G 11 9.994 -53.422 -16.195
87 H8A A2G 11 H8A A2G 11 10.085 -51.916 -15.283
88 H8B A2G 11 H8B A2G 11 11.444 -53.039 -15.267
89 H14 A2G 11 H14 A2G 11 10.404 -48.293 -23.270
90 H15 A2G 11 H15 A2G 11 12.474 -50.228 -23.234
Start of MODEL 16
1 H1 ACE 1 H1 ACE 1 -1.634 -51.174 -17.250
2 H2 ACE 1 H2 ACE 1 -2.622 -52.105 -18.375
3 H3 ACE 1 H3 ACE 1 -1.680 -50.734 -18.958
4 HA PRO 2 HA PRO 2 0.427 -55.078 -19.382
5 HB2 PRO 2 HB2 PRO 2 1.006 -54.247 -22.078
6 HB3 PRO 2 HB3 PRO 2 -0.008 -55.595 -21.542
7 HG2 PRO 2 HG2 PRO 2 -0.784 -52.935 -22.464
8 HG3 PRO 2 HG3 PRO 2 -1.745 -54.416 -22.348
9 HD2 PRO 2 HD2 PRO 2 -2.102 -52.267 -20.687
10 HD3 PRO 2 HD3 PRO 2 -2.464 -53.940 -20.204
11 H THR 3 H THR 3 2.612 -55.271 -19.117
12 HA THR 3 HA THR 3 4.179 -52.788 -19.136
13 HB THR 3 HB THR 3 5.787 -54.026 -17.767
14 HG21 THR 3 HG21 THR 3 3.196 -53.319 -17.025
15 HG22 THR 3 HG22 THR 3 4.525 -53.682 -15.925
16 HG23 THR 3 HG23 THR 3 3.389 -54.951 -16.384
17 H THR 4 H THR 4 6.680 -53.477 -19.537
18 HA THR 4 HA THR 4 6.812 -55.046 -22.028
19 HB THR 4 HB THR 4 8.338 -53.268 -22.962
20 HG21 THR 4 HG21 THR 4 6.560 -52.243 -23.980
21 HG22 THR 4 HG22 THR 4 5.760 -51.885 -22.449
22 HG23 THR 4 HG23 THR 4 5.650 -53.502 -23.145
23 H THR 5 H THR 5 9.247 -55.222 -22.684
24 HA THR 5 HA THR 5 10.602 -56.395 -20.407
25 HB THR 5 HB THR 5 11.602 -56.141 -23.249
26 HG1 THR 5 HG1 THR 5 9.726 -57.812 -22.041
27 HG21 THR 5 HG21 THR 5 13.201 -56.786 -21.391
28 HG22 THR 5 HG22 THR 5 13.026 -57.987 -22.672
29 HG23 THR 5 HG23 THR 5 12.202 -58.216 -21.130
30 HA PRO 6 HA PRO 6 12.887 -52.863 -19.103
31 HB2 PRO 6 HB2 PRO 6 15.228 -54.468 -18.612
32 HB3 PRO 6 HB3 PRO 6 14.067 -53.837 -17.434
33 HG2 PRO 6 HG2 PRO 6 14.286 -56.513 -18.580
34 HG3 PRO 6 HG3 PRO 6 13.450 -55.976 -17.116
35 HD2 PRO 6 HD2 PRO 6 12.135 -56.782 -19.379
36 HD3 PRO 6 HD3 PRO 6 11.459 -55.607 -18.229
37 H LEU 7 H LEU 7 13.830 -51.413 -20.411
38 HA LEU 7 HA LEU 7 15.103 -52.185 -22.864
39 HB2 LEU 7 HB2 LEU 7 13.746 -50.035 -22.338
40 HB3 LEU 7 HB3 LEU 7 15.263 -49.431 -21.671
41 HG LEU 7 HG LEU 7 16.199 -50.393 -23.996
42 HD11 LEU 7 HD11 LEU 7 14.596 -49.968 -25.796
43 HD12 LEU 7 HD12 LEU 7 13.367 -49.503 -24.621
44 HD13 LEU 7 HD13 LEU 7 13.935 -51.171 -24.689
45 HD21 LEU 7 HD21 LEU 7 16.619 -48.137 -23.403
46 HD22 LEU 7 HD22 LEU 7 14.901 -47.738 -23.372
47 HD23 LEU 7 HD23 LEU 7 15.714 -48.021 -24.912
48 H LYS 8 H LYS 8 16.475 -53.408 -20.802
49 HA LYS 8 HA LYS 8 18.838 -51.851 -20.157
50 HB2 LYS 8 HB2 LYS 8 17.563 -54.123 -19.079
51 HB3 LYS 8 HB3 LYS 8 19.138 -54.671 -19.654
52 HG2 LYS 8 HG2 LYS 8 18.673 -52.274 -17.856
53 HG3 LYS 8 HG3 LYS 8 19.261 -53.848 -17.320
54 HD2 LYS 8 HD2 LYS 8 20.888 -53.096 -19.512
55 HD3 LYS 8 HD3 LYS 8 20.752 -51.671 -18.480
56 HE2 LYS 8 HE2 LYS 8 22.647 -53.043 -17.751
57 HE3 LYS 8 HE3 LYS 8 21.385 -53.060 -16.517
58 HZ1 LYS 8 HZ1 LYS 8 20.731 -55.195 -17.104
59 HZ2 LYS 8 HZ2 LYS 8 22.426 -55.272 -17.192
60 HZ3 LYS 8 HZ3 LYS 8 21.505 -55.137 -18.613
61 HN1 NH2 9 HN1 NH2 9 19.515 -55.253 -21.446
62 HN2 NH2 9 HN2 NH2 9 19.040 -54.711 -22.983
63 H1 A2G 10 H1 A2G 10 6.748 -55.745 -18.808
64 H2 A2G 10 H2 A2G 10 7.152 -58.160 -18.593
65 HN2 A2G 10 HN2 A2G 10 4.588 -57.560 -19.947
66 H3 A2G 10 H3 A2G 10 4.339 -58.280 -17.471
67 HO3 A2G 10 HO3 A2G 10 5.913 -60.428 -17.114
68 H4 A2G 10 H4 A2G 10 5.381 -58.857 -15.353
69 HO4 A2G 10 HO4 A2G 10 7.690 -58.804 -16.944
70 H5 A2G 10 H5 A2G 10 5.066 -56.460 -15.780
71 H6 A2G 10 H6 A2G 10 7.826 -56.555 -14.629
72 H8 A2G 10 H8 A2G 10 4.739 -59.346 -22.223
73 H8A A2G 10 H8A A2G 10 6.077 -58.499 -22.999
74 H8B A2G 10 H8B A2G 10 4.762 -57.584 -22.259
75 H14 A2G 10 H14 A2G 10 6.389 -55.731 -14.024
76 H15 A2G 10 H15 A2G 10 6.685 -57.453 -12.705
77 H1 A2G 11 H1 A2G 11 9.936 -52.385 -21.568
78 H2 A2G 11 H2 A2G 11 10.622 -50.168 -20.761
79 HN2 A2G 11 HN2 A2G 11 8.625 -51.358 -18.927
80 H3 A2G 11 H3 A2G 11 7.653 -49.620 -20.494
81 HO3 A2G 11 HO3 A2G 11 9.980 -48.067 -20.043
82 H4 A2G 11 H4 A2G 11 7.946 -48.028 -22.307
83 HO4 A2G 11 HO4 A2G 11 9.857 -47.381 -22.842
84 H5 A2G 11 H5 A2G 11 7.421 -50.333 -22.971
85 H6 A2G 11 H6 A2G 11 8.173 -50.221 -25.257
86 H8 A2G 11 H8 A2G 11 9.562 -52.610 -17.214
87 H8A A2G 11 H8A A2G 11 10.041 -51.112 -16.414
88 H8B A2G 11 H8B A2G 11 11.253 -52.335 -16.793
89 H14 A2G 11 H14 A2G 11 7.958 -48.558 -24.712
90 H15 A2G 11 H15 A2G 11 10.379 -49.132 -24.046
Start of MODEL 17
1 H1 ACE 1 H1 ACE 1 0.001 -56.763 -17.334
2 H2 ACE 1 H2 ACE 1 -1.507 -56.343 -18.147
3 H3 ACE 1 H3 ACE 1 -0.837 -55.266 -16.922
4 HA PRO 2 HA PRO 2 0.309 -54.215 -21.516
5 HB2 PRO 2 HB2 PRO 2 -0.441 -51.524 -20.815
6 HB3 PRO 2 HB3 PRO 2 -1.193 -52.595 -22.008
7 HG2 PRO 2 HG2 PRO 2 -2.036 -51.959 -19.285
8 HG3 PRO 2 HG3 PRO 2 -2.964 -52.651 -20.624
9 HD2 PRO 2 HD2 PRO 2 -2.220 -54.093 -18.417
10 HD3 PRO 2 HD3 PRO 2 -2.470 -54.825 -20.019
11 H THR 3 H THR 3 2.485 -54.596 -20.816
12 HA THR 3 HA THR 3 3.877 -52.138 -20.022
13 HB THR 3 HB THR 3 5.262 -53.403 -18.389
14 HG21 THR 3 HG21 THR 3 2.975 -52.175 -17.906
15 HG22 THR 3 HG22 THR 3 3.747 -53.130 -16.642
16 HG23 THR 3 HG23 THR 3 2.407 -53.810 -17.566
17 H THR 4 H THR 4 6.419 -53.170 -19.790
18 HA THR 4 HA THR 4 6.913 -54.618 -22.309
19 HB THR 4 HB THR 4 8.769 -53.037 -22.823
20 HG21 THR 4 HG21 THR 4 6.237 -51.440 -22.504
21 HG22 THR 4 HG22 THR 4 6.298 -52.802 -23.622
22 HG23 THR 4 HG23 THR 4 7.387 -51.433 -23.841
23 H THR 5 H THR 5 9.198 -55.391 -22.447
24 HA THR 5 HA THR 5 9.949 -56.587 -19.916
25 HB THR 5 HB THR 5 11.899 -57.283 -21.746
26 HG1 THR 5 HG1 THR 5 11.034 -56.516 -23.535
27 HG21 THR 5 HG21 THR 5 10.417 -59.346 -22.032
28 HG22 THR 5 HG22 THR 5 9.234 -58.510 -21.029
29 HG23 THR 5 HG23 THR 5 10.823 -58.906 -20.374
30 HA PRO 6 HA PRO 6 13.292 -53.918 -18.925
31 HB2 PRO 6 HB2 PRO 6 15.119 -56.013 -18.166
32 HB3 PRO 6 HB3 PRO 6 14.095 -55.022 -17.118
33 HG2 PRO 6 HG2 PRO 6 13.783 -57.728 -17.572
34 HG3 PRO 6 HG3 PRO 6 12.548 -56.642 -16.923
35 HD2 PRO 6 HD2 PRO 6 12.815 -57.753 -19.676
36 HD3 PRO 6 HD3 PRO 6 11.351 -57.292 -18.779
37 H LEU 7 H LEU 7 14.656 -52.850 -20.230
38 HA LEU 7 HA LEU 7 16.880 -54.127 -21.513
39 HB2 LEU 7 HB2 LEU 7 14.699 -54.515 -22.972
40 HB3 LEU 7 HB3 LEU 7 15.036 -52.863 -23.492
41 HG LEU 7 HG LEU 7 16.169 -54.398 -25.000
42 HD11 LEU 7 HD11 LEU 7 17.320 -52.268 -24.130
43 HD12 LEU 7 HD12 LEU 7 18.359 -53.481 -24.879
44 HD13 LEU 7 HD13 LEU 7 18.289 -53.343 -23.123
45 HD21 LEU 7 HD21 LEU 7 16.383 -56.021 -22.768
46 HD22 LEU 7 HD22 LEU 7 18.044 -55.478 -23.013
47 HD23 LEU 7 HD23 LEU 7 17.185 -56.307 -24.312
48 H LYS 8 H LYS 8 18.273 -52.613 -20.782
49 HA LYS 8 HA LYS 8 17.620 -49.786 -20.880
50 HB2 LYS 8 HB2 LYS 8 19.897 -49.504 -19.917
51 HB3 LYS 8 HB3 LYS 8 18.895 -50.617 -18.983
52 HG2 LYS 8 HG2 LYS 8 19.956 -52.534 -20.120
53 HG3 LYS 8 HG3 LYS 8 20.961 -51.423 -21.053
54 HD2 LYS 8 HD2 LYS 8 21.174 -50.754 -18.266
55 HD3 LYS 8 HD3 LYS 8 21.485 -52.478 -18.468
56 HE2 LYS 8 HE2 LYS 8 23.125 -51.961 -20.254
57 HE3 LYS 8 HE3 LYS 8 22.837 -50.239 -20.005
58 HZ1 LYS 8 HZ1 LYS 8 24.777 -51.481 -18.786
59 HZ2 LYS 8 HZ2 LYS 8 23.545 -51.877 -17.684
60 HZ3 LYS 8 HZ3 LYS 8 23.904 -50.249 -18.012
61 HN1 NH2 9 HN1 NH2 9 20.375 -48.806 -23.030
62 HN2 NH2 9 HN2 NH2 9 18.975 -48.193 -22.293
63 H1 A2G 10 H1 A2G 10 6.180 -55.346 -19.073
64 H2 A2G 10 H2 A2G 10 6.252 -57.728 -18.470
65 HN2 A2G 10 HN2 A2G 10 4.002 -57.135 -20.301
66 H3 A2G 10 H3 A2G 10 3.308 -57.403 -17.844
67 HO3 A2G 10 HO3 A2G 10 5.083 -59.527 -18.100
68 H4 A2G 10 H4 A2G 10 3.924 -57.750 -15.521
69 HO4 A2G 10 HO4 A2G 10 6.171 -57.839 -15.003
70 H5 A2G 10 H5 A2G 10 3.975 -55.426 -16.312
71 H6 A2G 10 H6 A2G 10 6.487 -55.571 -14.709
72 H8 A2G 10 H8 A2G 10 4.399 -59.173 -22.323
73 H8A A2G 10 H8A A2G 10 5.901 -58.486 -22.941
74 H8B A2G 10 H8B A2G 10 4.550 -57.429 -22.533
75 H14 A2G 10 H14 A2G 10 5.045 -54.590 -14.448
76 H15 A2G 10 H15 A2G 10 4.554 -56.047 -13.034
77 H1 A2G 11 H1 A2G 11 10.306 -52.247 -21.572
78 H2 A2G 11 H2 A2G 11 11.132 -50.359 -20.234
79 HN2 A2G 11 HN2 A2G 11 9.140 -51.958 -18.737
80 H3 A2G 11 H3 A2G 11 8.206 -49.776 -19.706
81 HO3 A2G 11 HO3 A2G 11 9.107 -48.864 -18.054
82 H4 A2G 11 H4 A2G 11 8.530 -47.771 -21.039
83 HO4 A2G 11 HO4 A2G 11 10.861 -48.296 -22.192
84 H5 A2G 11 H5 A2G 11 7.864 -49.787 -22.271
85 H6 A2G 11 H6 A2G 11 8.419 -49.026 -24.437
86 H8 A2G 11 H8 A2G 11 10.080 -53.552 -17.335
87 H8A A2G 11 H8A A2G 11 10.540 -52.260 -16.227
88 H8B A2G 11 H8B A2G 11 11.766 -53.363 -16.853
89 H14 A2G 11 H14 A2G 11 8.582 -47.577 -23.445
90 H15 A2G 11 H15 A2G 11 10.792 -49.260 -23.756
Start of MODEL 18
1 H1 ACE 1 H1 ACE 1 -2.161 -52.203 -20.737
2 H2 ACE 1 H2 ACE 1 -2.467 -52.741 -19.085
3 H3 ACE 1 H3 ACE 1 -3.082 -53.678 -20.446
4 HA PRO 2 HA PRO 2 0.777 -55.788 -20.889
5 HB2 PRO 2 HB2 PRO 2 1.717 -54.803 -23.429
6 HB3 PRO 2 HB3 PRO 2 0.842 -56.303 -23.093
7 HG2 PRO 2 HG2 PRO 2 -0.154 -54.142 -24.496
8 HG3 PRO 2 HG3 PRO 2 -1.121 -55.430 -23.762
9 HD2 PRO 2 HD2 PRO 2 -0.644 -52.650 -22.794
10 HD3 PRO 2 HD3 PRO 2 -2.058 -53.703 -22.561
11 H THR 3 H THR 3 2.691 -55.539 -19.891
12 HA THR 3 HA THR 3 3.965 -52.895 -19.902
13 HB THR 3 HB THR 3 5.217 -53.700 -17.970
14 HG21 THR 3 HG21 THR 3 2.502 -54.776 -17.383
15 HG22 THR 3 HG22 THR 3 2.594 -53.113 -17.963
16 HG23 THR 3 HG23 THR 3 3.454 -53.585 -16.498
17 H THR 4 H THR 4 6.343 -52.798 -20.033
18 HA THR 4 HA THR 4 7.324 -54.658 -22.098
19 HB THR 4 HB THR 4 9.023 -52.886 -22.542
20 HG21 THR 4 HG21 THR 4 7.575 -51.623 -23.840
21 HG22 THR 4 HG22 THR 4 6.368 -51.505 -22.561
22 HG23 THR 4 HG23 THR 4 6.538 -53.003 -23.475
23 H THR 5 H THR 5 9.616 -55.272 -21.997
24 HA THR 5 HA THR 5 10.310 -56.143 -19.321
25 HB THR 5 HB THR 5 11.029 -57.859 -20.587
26 HG1 THR 5 HG1 THR 5 13.084 -57.524 -20.433
27 HG21 THR 5 HG21 THR 5 11.384 -57.627 -23.055
28 HG22 THR 5 HG22 THR 5 11.067 -55.899 -22.896
29 HG23 THR 5 HG23 THR 5 9.799 -57.067 -22.523
30 HA PRO 6 HA PRO 6 13.243 -53.222 -17.946
31 HB2 PRO 6 HB2 PRO 6 15.550 -54.947 -17.999
32 HB3 PRO 6 HB3 PRO 6 14.577 -54.462 -16.602
33 HG2 PRO 6 HG2 PRO 6 14.526 -56.948 -18.134
34 HG3 PRO 6 HG3 PRO 6 13.907 -56.606 -16.511
35 HD2 PRO 6 HD2 PRO 6 12.281 -57.037 -18.674
36 HD3 PRO 6 HD3 PRO 6 11.810 -56.023 -17.290
37 H LEU 7 H LEU 7 14.121 -51.625 -19.123
38 HA LEU 7 HA LEU 7 15.009 -52.047 -21.819
39 HB2 LEU 7 HB2 LEU 7 14.238 -49.830 -20.192
40 HB3 LEU 7 HB3 LEU 7 15.830 -49.491 -20.874
41 HG LEU 7 HG LEU 7 14.960 -50.107 -23.127
42 HD11 LEU 7 HD11 LEU 7 12.800 -51.115 -21.550
43 HD12 LEU 7 HD12 LEU 7 13.014 -51.222 -23.298
44 HD13 LEU 7 HD13 LEU 7 12.162 -49.846 -22.595
45 HD21 LEU 7 HD21 LEU 7 14.561 -47.898 -23.319
46 HD22 LEU 7 HD22 LEU 7 14.369 -47.786 -21.570
47 HD23 LEU 7 HD23 LEU 7 12.970 -48.117 -22.589
48 H LYS 8 H LYS 8 17.064 -52.014 -22.646
49 HA LYS 8 HA LYS 8 19.351 -51.449 -20.952
50 HB2 LYS 8 HB2 LYS 8 20.341 -53.752 -21.511
51 HB3 LYS 8 HB3 LYS 8 19.112 -53.693 -20.247
52 HG2 LYS 8 HG2 LYS 8 17.446 -54.583 -21.652
53 HG3 LYS 8 HG3 LYS 8 18.342 -54.184 -23.118
54 HD2 LYS 8 HD2 LYS 8 19.725 -56.005 -21.234
55 HD3 LYS 8 HD3 LYS 8 18.299 -56.672 -22.030
56 HE2 LYS 8 HE2 LYS 8 19.211 -56.091 -24.223
57 HE3 LYS 8 HE3 LYS 8 20.610 -55.332 -23.464
58 HZ1 LYS 8 HZ1 LYS 8 20.303 -57.999 -24.160
59 HZ2 LYS 8 HZ2 LYS 8 20.285 -57.946 -22.461
60 HZ3 LYS 8 HZ3 LYS 8 21.596 -57.291 -23.321
61 HN1 NH2 9 HN1 NH2 9 18.443 -50.256 -23.510
62 HN2 NH2 9 HN2 NH2 9 19.119 -51.081 -24.831
63 H1 A2G 10 H1 A2G 10 6.613 -55.479 -18.605
64 H2 A2G 10 H2 A2G 10 7.192 -57.672 -17.657
65 HN2 A2G 10 HN2 A2G 10 4.898 -57.926 -19.513
66 H3 A2G 10 H3 A2G 10 4.229 -57.921 -17.069
67 HO3 A2G 10 HO3 A2G 10 5.384 -59.743 -15.818
68 H4 A2G 10 H4 A2G 10 4.846 -57.780 -14.723
69 HO4 A2G 10 HO4 A2G 10 7.246 -58.342 -15.690
70 H5 A2G 10 H5 A2G 10 4.401 -55.644 -15.850
71 H6 A2G 10 H6 A2G 10 6.833 -54.959 -14.275
72 H8 A2G 10 H8 A2G 10 5.859 -60.000 -21.259
73 H8A A2G 10 H8A A2G 10 7.130 -59.036 -22.011
74 H8B A2G 10 H8B A2G 10 5.542 -58.327 -21.718
75 H14 A2G 10 H14 A2G 10 5.187 -54.344 -14.123
76 H15 A2G 10 H15 A2G 10 5.409 -55.621 -12.394
77 H1 A2G 11 H1 A2G 11 10.311 -52.011 -20.985
78 H2 A2G 11 H2 A2G 11 10.812 -49.925 -19.785
79 HN2 A2G 11 HN2 A2G 11 8.614 -51.402 -18.458
80 H3 A2G 11 H3 A2G 11 7.821 -49.445 -19.881
81 HO3 A2G 11 HO3 A2G 11 8.885 -48.648 -18.038
82 H4 A2G 11 H4 A2G 11 8.325 -47.609 -21.392
83 HO4 A2G 11 HO4 A2G 11 10.433 -47.220 -20.501
84 H5 A2G 11 H5 A2G 11 7.967 -49.800 -22.440
85 H6 A2G 11 H6 A2G 11 8.932 -49.311 -24.554
86 H8 A2G 11 H8 A2G 11 9.413 -52.914 -16.832
87 H8A A2G 11 H8A A2G 11 9.543 -51.508 -15.775
88 H8B A2G 11 H8B A2G 11 10.948 -52.538 -16.050
89 H14 A2G 11 H14 A2G 11 8.786 -47.738 -23.770
90 H15 A2G 11 H15 A2G 11 11.034 -48.355 -22.970
Start of MODEL 19
1 H1 ACE 1 H1 ACE 1 -2.074 -52.756 -18.417
2 H2 ACE 1 H2 ACE 1 -1.945 -54.103 -17.285
3 H3 ACE 1 H3 ACE 1 -2.853 -54.294 -18.785
4 HA PRO 2 HA PRO 2 0.832 -55.248 -21.034
5 HB2 PRO 2 HB2 PRO 2 1.088 -52.965 -22.775
6 HB3 PRO 2 HB3 PRO 2 0.363 -54.540 -23.132
7 HG2 PRO 2 HG2 PRO 2 -1.006 -52.149 -22.932
8 HG3 PRO 2 HG3 PRO 2 -1.726 -53.763 -22.830
9 HD2 PRO 2 HD2 PRO 2 -1.099 -51.840 -20.639
10 HD3 PRO 2 HD3 PRO 2 -2.383 -53.067 -20.736
11 H THR 3 H THR 3 3.030 -55.169 -20.824
12 HA THR 3 HA THR 3 4.318 -52.626 -20.128
13 HB THR 3 HB THR 3 5.478 -53.637 -18.216
14 HG21 THR 3 HG21 THR 3 3.067 -52.596 -18.112
15 HG22 THR 3 HG22 THR 3 3.708 -53.443 -16.703
16 HG23 THR 3 HG23 THR 3 2.570 -54.256 -17.779
17 H THR 4 H THR 4 6.712 -52.811 -20.184
18 HA THR 4 HA THR 4 7.513 -54.673 -22.325
19 HB THR 4 HB THR 4 9.586 -52.963 -22.178
20 HG21 THR 4 HG21 THR 4 8.202 -53.423 -24.170
21 HG22 THR 4 HG22 THR 4 8.482 -51.692 -23.982
22 HG23 THR 4 HG23 THR 4 6.928 -52.389 -23.523
23 H THR 5 H THR 5 9.731 -55.540 -22.216
24 HA THR 5 HA THR 5 10.241 -56.645 -19.584
25 HB THR 5 HB THR 5 10.821 -58.354 -20.927
26 HG1 THR 5 HG1 THR 5 12.951 -58.134 -21.864
27 HG21 THR 5 HG21 THR 5 9.707 -57.318 -22.826
28 HG22 THR 5 HG22 THR 5 11.223 -58.034 -23.372
29 HG23 THR 5 HG23 THR 5 11.109 -56.291 -23.129
30 HA PRO 6 HA PRO 6 13.445 -54.169 -17.959
31 HB2 PRO 6 HB2 PRO 6 15.551 -56.127 -18.094
32 HB3 PRO 6 HB3 PRO 6 14.604 -55.634 -16.682
33 HG2 PRO 6 HG2 PRO 6 14.321 -57.991 -18.382
34 HG3 PRO 6 HG3 PRO 6 13.704 -57.693 -16.752
35 HD2 PRO 6 HD2 PRO 6 12.093 -57.798 -18.965
36 HD3 PRO 6 HD3 PRO 6 11.702 -56.833 -17.522
37 H LEU 7 H LEU 7 13.865 -52.640 -19.527
38 HA LEU 7 HA LEU 7 15.286 -53.234 -21.948
39 HB2 LEU 7 HB2 LEU 7 13.807 -51.043 -20.881
40 HB3 LEU 7 HB3 LEU 7 15.403 -50.449 -21.343
41 HG LEU 7 HG LEU 7 13.602 -52.114 -23.128
42 HD11 LEU 7 HD11 LEU 7 13.711 -49.248 -22.555
43 HD12 LEU 7 HD12 LEU 7 12.501 -50.165 -23.452
44 HD13 LEU 7 HD13 LEU 7 13.961 -49.600 -24.264
45 HD21 LEU 7 HD21 LEU 7 15.441 -52.356 -24.406
46 HD22 LEU 7 HD22 LEU 7 16.393 -51.489 -23.202
47 HD23 LEU 7 HD23 LEU 7 15.603 -50.602 -24.505
48 H LYS 8 H LYS 8 17.416 -53.014 -22.412
49 HA LYS 8 HA LYS 8 19.250 -52.758 -20.177
50 HB2 LYS 8 HB2 LYS 8 19.404 -54.389 -22.207
51 HB3 LYS 8 HB3 LYS 8 20.099 -53.001 -23.046
52 HG2 LYS 8 HG2 LYS 8 21.694 -52.773 -21.063
53 HG3 LYS 8 HG3 LYS 8 21.131 -54.366 -20.554
54 HD2 LYS 8 HD2 LYS 8 21.815 -55.309 -22.729
55 HD3 LYS 8 HD3 LYS 8 22.379 -53.717 -23.242
56 HE2 LYS 8 HE2 LYS 8 24.298 -54.956 -22.448
57 HE3 LYS 8 HE3 LYS 8 23.930 -53.712 -21.255
58 HZ1 LYS 8 HZ1 LYS 8 24.236 -55.656 -20.028
59 HZ2 LYS 8 HZ2 LYS 8 23.355 -56.609 -21.124
60 HZ3 LYS 8 HZ3 LYS 8 22.551 -55.494 -20.126
61 HN1 NH2 9 HN1 NH2 9 18.641 -50.804 -23.208
62 HN2 NH2 9 HN2 NH2 9 20.049 -49.888 -22.964
63 H1 A2G 10 H1 A2G 10 6.614 -55.544 -18.840
64 H2 A2G 10 H2 A2G 10 6.879 -57.854 -18.052
65 HN2 A2G 10 HN2 A2G 10 4.622 -57.650 -19.958
66 H3 A2G 10 H3 A2G 10 3.895 -57.776 -17.529
67 HO3 A2G 10 HO3 A2G 10 4.376 -59.819 -17.911
68 H4 A2G 10 H4 A2G 10 4.451 -57.852 -15.169
69 HO4 A2G 10 HO4 A2G 10 7.094 -57.984 -16.160
70 H5 A2G 10 H5 A2G 10 4.334 -55.602 -16.138
71 H6 A2G 10 H6 A2G 10 6.777 -55.249 -14.522
72 H8 A2G 10 H8 A2G 10 5.377 -59.792 -21.823
73 H8A A2G 10 H8A A2G 10 6.718 -58.864 -22.494
74 H8B A2G 10 H8B A2G 10 5.185 -58.068 -22.136
75 H14 A2G 10 H14 A2G 10 5.153 -54.615 -14.255
76 H15 A2G 10 H15 A2G 10 6.055 -57.252 -13.736
77 H1 A2G 11 H1 A2G 11 10.209 -51.156 -21.336
78 H2 A2G 11 H2 A2G 11 9.831 -48.977 -20.265
79 HN2 A2G 11 HN2 A2G 11 8.525 -51.214 -18.830
80 H3 A2G 11 H3 A2G 11 6.904 -49.762 -20.268
81 HO3 A2G 11 HO3 A2G 11 7.607 -47.181 -19.784
82 H4 A2G 11 H4 A2G 11 6.592 -47.978 -21.889
83 HO4 A2G 11 HO4 A2G 11 9.022 -47.281 -21.013
84 H5 A2G 11 H5 A2G 11 7.144 -50.186 -22.811
85 H6 A2G 11 H6 A2G 11 7.868 -49.481 -24.984
86 H8 A2G 11 H8 A2G 11 9.786 -51.981 -17.039
87 H8A A2G 11 H8A A2G 11 9.217 -50.609 -16.089
88 H8B A2G 11 H8B A2G 11 10.947 -50.883 -16.291
89 H14 A2G 11 H14 A2G 11 6.992 -48.111 -24.300
90 H15 A2G 11 H15 A2G 11 8.798 -47.153 -24.883
Start of MODEL 20
1 H1 ACE 1 H1 ACE 1 -2.104 -53.413 -18.509
2 H2 ACE 1 H2 ACE 1 -1.342 -53.870 -16.985
3 H3 ACE 1 H3 ACE 1 -2.239 -55.069 -17.917
4 HA PRO 2 HA PRO 2 1.164 -56.558 -20.228
5 HB2 PRO 2 HB2 PRO 2 0.472 -55.472 -22.804
6 HB3 PRO 2 HB3 PRO 2 0.257 -57.129 -22.222
7 HG2 PRO 2 HG2 PRO 2 -1.690 -54.964 -22.435
8 HG3 PRO 2 HG3 PRO 2 -1.950 -56.707 -22.284
9 HD2 PRO 2 HD2 PRO 2 -2.491 -54.932 -20.268
10 HD3 PRO 2 HD3 PRO 2 -2.039 -56.628 -19.976
11 H THR 3 H THR 3 3.029 -55.540 -19.686
12 HA THR 3 HA THR 3 3.495 -52.788 -20.595
13 HB THR 3 HB THR 3 5.542 -52.995 -19.109
14 HG21 THR 3 HG21 THR 3 3.012 -53.636 -17.600
15 HG22 THR 3 HG22 THR 3 3.193 -52.106 -18.458
16 HG23 THR 3 HG23 THR 3 4.306 -52.523 -17.156
17 H THR 4 H THR 4 6.276 -52.824 -20.683
18 HA THR 4 HA THR 4 6.704 -54.271 -23.209
19 HB THR 4 HB THR 4 8.852 -52.659 -23.036
20 HG21 THR 4 HG21 THR 4 7.189 -52.695 -24.860
21 HG22 THR 4 HG22 THR 4 7.572 -51.039 -24.387
22 HG23 THR 4 HG23 THR 4 6.065 -51.785 -23.852
23 H THR 5 H THR 5 9.448 -54.333 -23.287
24 HA THR 5 HA THR 5 10.000 -56.566 -21.521
25 HB THR 5 HB THR 5 11.529 -57.162 -23.072
26 HG1 THR 5 HG1 THR 5 12.301 -54.469 -22.849
27 HG21 THR 5 HG21 THR 5 11.074 -56.355 -25.275
28 HG22 THR 5 HG22 THR 5 10.527 -54.794 -24.662
29 HG23 THR 5 HG23 THR 5 9.552 -56.239 -24.390
30 HA PRO 6 HA PRO 6 12.530 -54.479 -18.595
31 HB2 PRO 6 HB2 PRO 6 14.764 -56.296 -18.695
32 HB3 PRO 6 HB3 PRO 6 13.432 -56.261 -17.530
33 HG2 PRO 6 HG2 PRO 6 13.870 -58.236 -19.410
34 HG3 PRO 6 HG3 PRO 6 12.345 -57.935 -18.567
35 HD2 PRO 6 HD2 PRO 6 13.127 -57.222 -21.355
36 HD3 PRO 6 HD3 PRO 6 11.521 -57.604 -20.692
37 H LEU 7 H LEU 7 14.768 -53.566 -18.126
38 HA LEU 7 HA LEU 7 15.674 -52.095 -20.418
39 HB2 LEU 7 HB2 LEU 7 16.404 -52.196 -17.515
40 HB3 LEU 7 HB3 LEU 7 17.490 -51.397 -18.651
41 HG LEU 7 HG LEU 7 15.652 -49.963 -19.428
42 HD11 LEU 7 HD11 LEU 7 13.501 -50.035 -18.080
43 HD12 LEU 7 HD12 LEU 7 14.056 -51.573 -17.420
44 HD13 LEU 7 HD13 LEU 7 13.755 -51.413 -19.150
45 HD21 LEU 7 HD21 LEU 7 16.215 -50.101 -16.466
46 HD22 LEU 7 HD22 LEU 7 15.173 -48.845 -17.132
47 HD23 LEU 7 HD23 LEU 7 16.854 -48.966 -17.655
48 H LYS 8 H LYS 8 18.064 -51.931 -20.898
49 HA LYS 8 HA LYS 8 19.061 -54.595 -21.474
50 HB2 LYS 8 HB2 LYS 8 19.161 -52.283 -22.871
51 HB3 LYS 8 HB3 LYS 8 20.738 -52.230 -22.080
52 HG2 LYS 8 HG2 LYS 8 19.659 -54.537 -23.729
53 HG3 LYS 8 HG3 LYS 8 20.904 -53.396 -24.240
54 HD2 LYS 8 HD2 LYS 8 22.092 -54.158 -22.010
55 HD3 LYS 8 HD3 LYS 8 21.064 -55.580 -22.189
56 HE2 LYS 8 HE2 LYS 8 23.079 -56.121 -23.338
57 HE3 LYS 8 HE3 LYS 8 21.920 -55.707 -24.602
58 HZ1 LYS 8 HZ1 LYS 8 23.318 -54.151 -25.279
59 HZ2 LYS 8 HZ2 LYS 8 24.379 -54.473 -23.990
60 HZ3 LYS 8 HZ3 LYS 8 23.126 -53.341 -23.800
61 HN1 NH2 9 HN1 NH2 9 20.574 -55.622 -19.703
62 HN2 NH2 9 HN2 NH2 9 22.033 -54.804 -19.992
63 H1 A2G 10 H1 A2G 10 6.966 -54.559 -18.892
64 H2 A2G 10 H2 A2G 10 7.711 -56.552 -17.661
65 HN2 A2G 10 HN2 A2G 10 5.531 -57.256 -19.536
66 H3 A2G 10 H3 A2G 10 4.764 -57.022 -17.133
67 HO3 A2G 10 HO3 A2G 10 5.496 -58.797 -16.055
68 H4 A2G 10 H4 A2G 10 5.268 -56.536 -14.805
69 HO4 A2G 10 HO4 A2G 10 7.262 -56.281 -14.109
70 H5 A2G 10 H5 A2G 10 4.668 -54.608 -16.203
71 H6 A2G 10 H6 A2G 10 6.951 -53.481 -14.666
72 H8 A2G 10 H8 A2G 10 6.757 -59.407 -21.001
73 H8A A2G 10 H8A A2G 10 7.964 -58.413 -21.818
74 H8B A2G 10 H8B A2G 10 6.305 -57.834 -21.659
75 H14 A2G 10 H14 A2G 10 5.241 -53.049 -14.618
76 H15 A2G 10 H15 A2G 10 6.646 -54.867 -13.124
77 H1 A2G 11 H1 A2G 11 9.666 -51.065 -21.958
78 H2 A2G 11 H2 A2G 11 9.536 -49.130 -20.450
79 HN2 A2G 11 HN2 A2G 11 8.317 -51.562 -19.278
80 H3 A2G 11 H3 A2G 11 6.602 -49.845 -20.189
81 HO3 A2G 11 HO3 A2G 11 7.891 -47.519 -19.280
82 H4 A2G 11 H4 A2G 11 6.157 -47.774 -21.379
83 HO4 A2G 11 HO4 A2G 11 7.866 -46.539 -22.159
84 H5 A2G 11 H5 A2G 11 6.478 -49.769 -22.773
85 H6 A2G 11 H6 A2G 11 6.857 -48.666 -24.839
86 H8 A2G 11 H8 A2G 11 9.636 -52.669 -17.787
87 H8A A2G 11 H8A A2G 11 9.492 -51.399 -16.571
88 H8B A2G 11 H8B A2G 11 11.084 -51.881 -17.158
89 H14 A2G 11 H14 A2G 11 6.266 -47.392 -23.772
90 H15 A2G 11 H15 A2G 11 8.340 -46.681 -23.477
Start of MODEL 21
1 H1 ACE 1 H1 ACE 1 -1.664 -50.823 -19.863
2 H2 ACE 1 H2 ACE 1 -1.783 -51.493 -18.235
3 H3 ACE 1 H3 ACE 1 -2.650 -52.255 -19.567
4 HA PRO 2 HA PRO 2 0.501 -55.085 -20.668
5 HB2 PRO 2 HB2 PRO 2 1.332 -53.897 -23.158
6 HB3 PRO 2 HB3 PRO 2 0.281 -55.300 -22.911
7 HG2 PRO 2 HG2 PRO 2 -0.420 -52.534 -23.533
8 HG3 PRO 2 HG3 PRO 2 -1.378 -54.012 -23.712
9 HD2 PRO 2 HD2 PRO 2 -1.908 -52.105 -21.818
10 HD3 PRO 2 HD3 PRO 2 -2.303 -53.825 -21.603
11 H THR 3 H THR 3 2.450 -55.151 -19.717
12 HA THR 3 HA THR 3 4.123 -52.739 -19.690
13 HB THR 3 HB THR 3 5.325 -53.814 -17.868
14 HG21 THR 3 HG21 THR 3 2.565 -53.163 -17.835
15 HG22 THR 3 HG22 THR 3 3.685 -53.161 -16.473
16 HG23 THR 3 HG23 THR 3 2.755 -54.612 -16.847
17 H THR 4 H THR 4 6.431 -52.931 -20.065
18 HA THR 4 HA THR 4 7.014 -54.898 -22.182
19 HB THR 4 HB THR 4 8.891 -53.325 -22.749
20 HG21 THR 4 HG21 THR 4 7.508 -51.949 -24.014
21 HG22 THR 4 HG22 THR 4 6.354 -51.730 -22.699
22 HG23 THR 4 HG23 THR 4 6.388 -53.246 -23.599
23 H THR 5 H THR 5 9.349 -55.596 -22.285
24 HA THR 5 HA THR 5 10.091 -56.690 -19.707
25 HB THR 5 HB THR 5 12.070 -57.524 -21.313
26 HG1 THR 5 HG1 THR 5 11.620 -56.622 -23.186
27 HG21 THR 5 HG21 THR 5 10.321 -59.346 -22.041
28 HG22 THR 5 HG22 THR 5 9.243 -58.467 -20.957
29 HG23 THR 5 HG23 THR 5 10.737 -59.168 -20.337
30 HA PRO 6 HA PRO 6 13.136 -53.934 -18.233
31 HB2 PRO 6 HB2 PRO 6 15.330 -55.799 -18.292
32 HB3 PRO 6 HB3 PRO 6 14.370 -55.283 -16.898
33 HG2 PRO 6 HG2 PRO 6 14.185 -57.728 -18.483
34 HG3 PRO 6 HG3 PRO 6 13.565 -57.383 -16.862
35 HD2 PRO 6 HD2 PRO 6 11.946 -57.665 -19.053
36 HD3 PRO 6 HD3 PRO 6 11.520 -56.653 -17.655
37 H LEU 7 H LEU 7 14.687 -52.533 -19.029
38 HA LEU 7 HA LEU 7 15.207 -52.618 -21.849
39 HB2 LEU 7 HB2 LEU 7 16.773 -50.757 -20.165
40 HB3 LEU 7 HB3 LEU 7 15.817 -50.439 -21.614
41 HG LEU 7 HG LEU 7 13.786 -51.016 -20.029
42 HD11 LEU 7 HD11 LEU 7 14.140 -50.919 -17.771
43 HD12 LEU 7 HD12 LEU 7 15.428 -49.724 -17.922
44 HD13 LEU 7 HD13 LEU 7 15.767 -51.429 -18.223
45 HD21 LEU 7 HD21 LEU 7 13.677 -48.597 -19.404
46 HD22 LEU 7 HD22 LEU 7 14.113 -48.842 -21.096
47 HD23 LEU 7 HD23 LEU 7 15.356 -48.421 -19.917
48 H LYS 8 H LYS 8 17.597 -51.999 -22.501
49 HA LYS 8 HA LYS 8 19.216 -54.288 -21.746
50 HB2 LYS 8 HB2 LYS 8 20.818 -53.055 -23.442
51 HB3 LYS 8 HB3 LYS 8 19.396 -53.924 -24.025
52 HG2 LYS 8 HG2 LYS 8 19.593 -51.647 -25.022
53 HG3 LYS 8 HG3 LYS 8 18.109 -51.848 -24.088
54 HD2 LYS 8 HD2 LYS 8 18.954 -50.595 -22.262
55 HD3 LYS 8 HD3 LYS 8 20.615 -50.711 -22.846
56 HE2 LYS 8 HE2 LYS 8 18.401 -49.256 -24.318
57 HE3 LYS 8 HE3 LYS 8 19.565 -48.465 -23.255
58 HZ1 LYS 8 HZ1 LYS 8 19.880 -49.197 -25.941
59 HZ2 LYS 8 HZ2 LYS 8 20.978 -50.105 -25.016
60 HZ3 LYS 8 HZ3 LYS 8 20.989 -48.408 -24.928
61 HN1 NH2 9 HN1 NH2 9 21.793 -53.706 -20.950
62 HN2 NH2 9 HN2 NH2 9 22.118 -52.075 -21.289
63 H1 A2G 10 H1 A2G 10 6.424 -55.649 -18.663
64 H2 A2G 10 H2 A2G 10 6.765 -58.016 -18.098
65 HN2 A2G 10 HN2 A2G 10 4.429 -57.569 -19.861
66 H3 A2G 10 H3 A2G 10 3.824 -58.017 -17.368
67 HO3 A2G 10 HO3 A2G 10 5.755 -59.918 -17.827
68 H4 A2G 10 H4 A2G 10 4.547 -58.301 -15.069
69 HO4 A2G 10 HO4 A2G 10 6.753 -58.274 -14.576
70 H5 A2G 10 H5 A2G 10 4.347 -55.974 -15.818
71 H6 A2G 10 H6 A2G 10 6.933 -56.052 -14.281
72 H8 A2G 10 H8 A2G 10 4.713 -59.584 -21.805
73 H8A A2G 10 H8A A2G 10 6.260 -59.088 -22.494
74 H8B A2G 10 H8B A2G 10 5.022 -57.881 -22.146
75 H14 A2G 10 H14 A2G 10 5.543 -54.991 -14.058
76 H15 A2G 10 H15 A2G 10 5.968 -56.949 -12.593
77 H1 A2G 11 H1 A2G 11 10.323 -52.503 -21.315
78 H2 A2G 11 H2 A2G 11 11.052 -50.448 -20.180
79 HN2 A2G 11 HN2 A2G 11 8.859 -51.839 -18.758
80 H3 A2G 11 H3 A2G 11 8.106 -49.739 -20.110
81 HO3 A2G 11 HO3 A2G 11 8.869 -47.873 -19.149
82 H4 A2G 11 H4 A2G 11 8.660 -47.966 -21.676
83 HO4 A2G 11 HO4 A2G 11 10.724 -47.465 -21.204
84 H5 A2G 11 H5 A2G 11 8.073 -50.133 -22.667
85 H6 A2G 11 H6 A2G 11 9.107 -49.829 -24.846
86 H8 A2G 11 H8 A2G 11 9.816 -53.308 -17.054
87 H8A A2G 11 H8A A2G 11 9.624 -51.817 -16.131
88 H8B A2G 11 H8B A2G 11 11.189 -52.630 -16.179
89 H14 A2G 11 H14 A2G 11 8.821 -48.236 -24.143
90 H15 A2G 11 H15 A2G 11 10.886 -48.162 -24.804
Start of MODEL 22
1 H1 ACE 1 H1 ACE 1 -2.009 -54.031 -17.678
2 H2 ACE 1 H2 ACE 1 -1.578 -55.695 -17.283
3 H3 ACE 1 H3 ACE 1 -2.714 -55.364 -18.592
4 HA PRO 2 HA PRO 2 0.592 -54.722 -21.456
5 HB2 PRO 2 HB2 PRO 2 0.354 -51.907 -22.033
6 HB3 PRO 2 HB3 PRO 2 -0.290 -53.274 -22.956
7 HG2 PRO 2 HG2 PRO 2 -1.796 -51.424 -21.561
8 HG3 PRO 2 HG3 PRO 2 -2.352 -53.017 -22.095
9 HD2 PRO 2 HD2 PRO 2 -1.515 -52.129 -19.373
10 HD3 PRO 2 HD3 PRO 2 -2.691 -53.377 -19.845
11 H THR 3 H THR 3 2.693 -54.822 -20.922
12 HA THR 3 HA THR 3 4.016 -52.425 -19.863
13 HB THR 3 HB THR 3 5.185 -53.753 -18.142
14 HG21 THR 3 HG21 THR 3 3.455 -53.663 -16.584
15 HG22 THR 3 HG22 THR 3 2.265 -54.298 -17.720
16 HG23 THR 3 HG23 THR 3 2.816 -52.629 -17.862
17 H THR 4 H THR 4 6.515 -53.184 -19.564
18 HA THR 4 HA THR 4 7.289 -54.746 -21.938
19 HB THR 4 HB THR 4 8.926 -53.052 -22.582
20 HG21 THR 4 HG21 THR 4 7.424 -51.661 -23.649
21 HG22 THR 4 HG22 THR 4 6.458 -51.417 -22.194
22 HG23 THR 4 HG23 THR 4 6.310 -52.917 -23.110
23 H THR 5 H THR 5 9.439 -55.594 -21.850
24 HA THR 5 HA THR 5 10.258 -56.257 -19.150
25 HB THR 5 HB THR 5 10.451 -57.486 -21.687
26 HG1 THR 5 HG1 THR 5 11.262 -59.176 -20.381
27 HG21 THR 5 HG21 THR 5 12.829 -58.009 -21.844
28 HG22 THR 5 HG22 THR 5 13.168 -57.008 -20.433
29 HG23 THR 5 HG23 THR 5 12.607 -56.262 -21.930
30 HA PRO 6 HA PRO 6 13.437 -53.393 -18.300
31 HB2 PRO 6 HB2 PRO 6 15.562 -55.325 -18.076
32 HB3 PRO 6 HB3 PRO 6 14.671 -54.522 -16.774
33 HG2 PRO 6 HG2 PRO 6 14.343 -57.208 -17.873
34 HG3 PRO 6 HG3 PRO 6 13.795 -56.544 -16.327
35 HD2 PRO 6 HD2 PRO 6 12.089 -57.158 -18.381
36 HD3 PRO 6 HD3 PRO 6 11.750 -55.889 -17.182
37 H LEU 7 H LEU 7 13.773 -52.264 -20.193
38 HA LEU 7 HA LEU 7 15.090 -53.397 -22.476
39 HB2 LEU 7 HB2 LEU 7 13.423 -51.523 -22.578
40 HB3 LEU 7 HB3 LEU 7 14.636 -50.474 -21.846
41 HG LEU 7 HG LEU 7 16.190 -51.043 -23.724
42 HD11 LEU 7 HD11 LEU 7 13.873 -52.770 -24.413
43 HD12 LEU 7 HD12 LEU 7 15.591 -53.009 -24.736
44 HD13 LEU 7 HD13 LEU 7 14.642 -51.933 -25.762
45 HD21 LEU 7 HD21 LEU 7 14.312 -49.993 -25.474
46 HD22 LEU 7 HD22 LEU 7 15.321 -49.052 -24.376
47 HD23 LEU 7 HD23 LEU 7 13.690 -49.516 -23.894
48 H LYS 8 H LYS 8 17.186 -53.173 -23.147
49 HA LYS 8 HA LYS 8 19.046 -51.472 -21.711
50 HB2 LYS 8 HB2 LYS 8 18.756 -54.279 -21.042
51 HB3 LYS 8 HB3 LYS 8 20.378 -53.931 -21.642
52 HG2 LYS 8 HG2 LYS 8 19.004 -52.266 -19.517
53 HG3 LYS 8 HG3 LYS 8 20.083 -53.612 -19.145
54 HD2 LYS 8 HD2 LYS 8 21.909 -52.354 -19.546
55 HD3 LYS 8 HD3 LYS 8 21.277 -51.836 -21.108
56 HE2 LYS 8 HE2 LYS 8 19.952 -50.090 -20.045
57 HE3 LYS 8 HE3 LYS 8 20.438 -50.653 -18.446
58 HZ1 LYS 8 HZ1 LYS 8 22.310 -49.663 -20.527
59 HZ2 LYS 8 HZ2 LYS 8 22.704 -50.096 -18.933
60 HZ3 LYS 8 HZ3 LYS 8 21.735 -48.734 -19.230
61 HN1 NH2 9 HN1 NH2 9 20.848 -51.028 -24.079
62 HN2 NH2 9 HN2 NH2 9 19.232 -50.899 -24.582
63 H1 A2G 10 H1 A2G 10 6.217 -55.609 -19.040
64 H2 A2G 10 H2 A2G 10 6.366 -58.016 -18.565
65 HN2 A2G 10 HN2 A2G 10 4.106 -57.464 -20.396
66 H3 A2G 10 H3 A2G 10 3.396 -57.833 -17.991
67 HO3 A2G 10 HO3 A2G 10 4.423 -59.789 -18.934
68 H4 A2G 10 H4 A2G 10 3.978 -58.284 -15.676
69 HO4 A2G 10 HO4 A2G 10 5.783 -59.375 -15.561
70 H5 A2G 10 H5 A2G 10 3.954 -55.921 -16.340
71 H6 A2G 10 H6 A2G 10 6.439 -56.110 -14.680
72 H8 A2G 10 H8 A2G 10 4.677 -59.247 -22.546
73 H8A A2G 10 H8A A2G 10 6.158 -58.463 -23.100
74 H8B A2G 10 H8B A2G 10 4.756 -57.488 -22.657
75 H14 A2G 10 H14 A2G 10 4.998 -55.123 -14.429
76 H15 A2G 10 H15 A2G 10 4.473 -56.627 -13.075
77 H1 A2G 11 H1 A2G 11 10.493 -52.393 -21.144
78 H2 A2G 11 H2 A2G 11 11.357 -50.389 -20.016
79 HN2 A2G 11 HN2 A2G 11 9.193 -51.698 -18.477
80 H3 A2G 11 H3 A2G 11 8.448 -49.580 -19.762
81 HO3 A2G 11 HO3 A2G 11 9.274 -47.831 -18.731
82 H4 A2G 11 H4 A2G 11 8.973 -47.795 -21.325
83 HO4 A2G 11 HO4 A2G 11 10.958 -47.311 -21.792
84 H5 A2G 11 H5 A2G 11 8.254 -49.922 -22.320
85 H6 A2G 11 H6 A2G 11 8.826 -49.358 -24.486
86 H8 A2G 11 H8 A2G 11 9.825 -52.901 -16.705
87 H8A A2G 11 H8A A2G 11 10.552 -51.595 -15.770
88 H8B A2G 11 H8B A2G 11 11.531 -52.976 -16.262
89 H14 A2G 11 H14 A2G 11 9.369 -47.891 -23.672
90 H15 A2G 11 H15 A2G 11 10.895 -50.118 -24.501
Start of MODEL 23
1 H1 ACE 1 H1 ACE 1 -1.247 -49.823 -19.229
2 H2 ACE 1 H2 ACE 1 -2.112 -50.807 -20.410
3 H3 ACE 1 H3 ACE 1 -0.853 -49.694 -20.943
4 HA PRO 2 HA PRO 2 0.546 -54.278 -20.219
5 HB2 PRO 2 HB2 PRO 2 1.817 -54.024 -22.792
6 HB3 PRO 2 HB3 PRO 2 0.503 -55.114 -22.322
7 HG2 PRO 2 HG2 PRO 2 0.393 -52.585 -23.779
8 HG3 PRO 2 HG3 PRO 2 -0.803 -53.885 -23.680
9 HD2 PRO 2 HD2 PRO 2 -1.145 -51.445 -22.483
10 HD3 PRO 2 HD3 PRO 2 -1.873 -52.944 -21.861
11 H THR 3 H THR 3 2.629 -54.787 -19.575
12 HA THR 3 HA THR 3 4.502 -52.530 -19.428
13 HB THR 3 HB THR 3 5.625 -53.817 -17.691
14 HG21 THR 3 HG21 THR 3 2.966 -52.887 -17.567
15 HG22 THR 3 HG22 THR 3 4.065 -53.146 -16.211
16 HG23 THR 3 HG23 THR 3 2.972 -54.434 -16.719
17 H THR 4 H THR 4 6.807 -52.946 -19.783
18 HA THR 4 HA THR 4 7.194 -54.769 -22.068
19 HB THR 4 HB THR 4 9.234 -53.373 -22.495
20 HG21 THR 4 HG21 THR 4 8.023 -51.762 -23.634
21 HG22 THR 4 HG22 THR 4 6.936 -51.472 -22.275
22 HG23 THR 4 HG23 THR 4 6.732 -52.910 -23.277
23 H THR 5 H THR 5 9.335 -55.826 -22.227
24 HA THR 5 HA THR 5 9.976 -57.123 -19.715
25 HB THR 5 HB THR 5 10.271 -58.790 -21.196
26 HG1 THR 5 HG1 THR 5 12.344 -58.932 -21.307
27 HG21 THR 5 HG21 THR 5 10.562 -56.628 -23.299
28 HG22 THR 5 HG22 THR 5 9.104 -57.551 -22.931
29 HG23 THR 5 HG23 THR 5 10.500 -58.356 -23.648
30 HA PRO 6 HA PRO 6 13.518 -55.029 -18.269
31 HB2 PRO 6 HB2 PRO 6 15.418 -57.152 -18.686
32 HB3 PRO 6 HB3 PRO 6 14.642 -56.660 -17.174
33 HG2 PRO 6 HG2 PRO 6 14.002 -58.882 -18.956
34 HG3 PRO 6 HG3 PRO 6 13.555 -58.626 -17.263
35 HD2 PRO 6 HD2 PRO 6 11.759 -58.463 -19.326
36 HD3 PRO 6 HD3 PRO 6 11.582 -57.553 -17.809
37 H LEU 7 H LEU 7 13.886 -53.468 -19.835
38 HA LEU 7 HA LEU 7 16.214 -53.797 -21.477
39 HB2 LEU 7 HB2 LEU 7 14.432 -54.917 -22.857
40 HB3 LEU 7 HB3 LEU 7 13.600 -53.364 -22.936
41 HG LEU 7 HG LEU 7 16.269 -52.797 -23.600
42 HD11 LEU 7 HD11 LEU 7 16.546 -55.269 -23.919
43 HD12 LEU 7 HD12 LEU 7 16.783 -54.347 -25.403
44 HD13 LEU 7 HD13 LEU 7 15.271 -55.215 -25.136
45 HD21 LEU 7 HD21 LEU 7 15.293 -52.322 -25.825
46 HD22 LEU 7 HD22 LEU 7 14.245 -51.737 -24.532
47 HD23 LEU 7 HD23 LEU 7 13.849 -53.231 -25.380
48 H LYS 8 H LYS 8 17.080 -51.948 -20.684
49 HA LYS 8 HA LYS 8 15.500 -49.526 -20.444
50 HB2 LYS 8 HB2 LYS 8 17.606 -48.534 -19.612
51 HB3 LYS 8 HB3 LYS 8 17.202 -50.022 -18.757
52 HG2 LYS 8 HG2 LYS 8 19.254 -50.780 -19.297
53 HG3 LYS 8 HG3 LYS 8 18.700 -50.863 -20.969
54 HD2 LYS 8 HD2 LYS 8 19.387 -48.498 -21.293
55 HD3 LYS 8 HD3 LYS 8 20.002 -48.469 -19.641
56 HE2 LYS 8 HE2 LYS 8 21.836 -48.912 -21.210
57 HE3 LYS 8 HE3 LYS 8 21.548 -50.327 -20.198
58 HZ1 LYS 8 HZ1 LYS 8 20.415 -51.407 -21.930
59 HZ2 LYS 8 HZ2 LYS 8 21.803 -50.744 -22.652
60 HZ3 LYS 8 HZ3 LYS 8 20.293 -49.994 -22.858
61 HN1 NH2 9 HN1 NH2 9 16.059 -47.621 -22.861
62 HN2 NH2 9 HN2 NH2 9 17.284 -47.377 -21.711
63 H1 A2G 10 H1 A2G 10 6.539 -55.718 -18.624
64 H2 A2G 10 H2 A2G 10 6.665 -58.121 -18.119
65 HN2 A2G 10 HN2 A2G 10 4.300 -57.492 -19.786
66 H3 A2G 10 H3 A2G 10 3.758 -57.850 -17.310
67 HO3 A2G 10 HO3 A2G 10 5.186 -60.075 -16.631
68 H4 A2G 10 H4 A2G 10 4.515 -58.279 -15.041
69 HO4 A2G 10 HO4 A2G 10 6.310 -59.353 -14.957
70 H5 A2G 10 H5 A2G 10 4.495 -55.926 -15.745
71 H6 A2G 10 H6 A2G 10 7.101 -56.099 -14.300
72 H8 A2G 10 H8 A2G 10 4.569 -59.567 -21.780
73 H8A A2G 10 H8A A2G 10 5.970 -58.851 -22.578
74 H8B A2G 10 H8B A2G 10 4.630 -57.827 -22.061
75 H14 A2G 10 H14 A2G 10 5.665 -55.149 -13.915
76 H15 A2G 10 H15 A2G 10 4.797 -56.814 -12.906
77 H1 A2G 11 H1 A2G 11 10.733 -52.922 -20.930
78 H2 A2G 11 H2 A2G 11 11.713 -51.074 -19.642
79 HN2 A2G 11 HN2 A2G 11 9.303 -52.224 -18.363
80 H3 A2G 11 H3 A2G 11 8.897 -49.953 -19.580
81 HO3 A2G 11 HO3 A2G 11 11.372 -49.253 -18.439
82 H4 A2G 11 H4 A2G 11 9.744 -48.178 -21.008
83 HO4 A2G 11 HO4 A2G 11 12.151 -49.559 -21.366
84 H5 A2G 11 H5 A2G 11 8.884 -50.168 -22.159
85 H6 A2G 11 H6 A2G 11 10.231 -49.976 -24.276
86 H8 A2G 11 H8 A2G 11 10.138 -54.039 -16.791
87 H8A A2G 11 H8A A2G 11 9.871 -52.591 -15.821
88 H8B A2G 11 H8B A2G 11 11.420 -53.430 -15.745
89 H14 A2G 11 H14 A2G 11 9.760 -48.417 -23.602
90 H15 A2G 11 H15 A2G 11 11.811 -48.230 -22.702
Start of MODEL 24
1 H1 ACE 1 H1 ACE 1 -2.717 -55.656 -19.520
2 H2 ACE 1 H2 ACE 1 -2.459 -53.913 -19.583
3 H3 ACE 1 H3 ACE 1 -2.191 -54.790 -18.077
4 HA PRO 2 HA PRO 2 1.283 -56.660 -20.987
5 HB2 PRO 2 HB2 PRO 2 1.383 -54.904 -23.268
6 HB3 PRO 2 HB3 PRO 2 1.054 -56.642 -23.239
7 HG2 PRO 2 HG2 PRO 2 -0.803 -54.401 -23.457
8 HG3 PRO 2 HG3 PRO 2 -1.040 -56.107 -23.859
9 HD2 PRO 2 HD2 PRO 2 -2.235 -54.896 -21.712
10 HD3 PRO 2 HD3 PRO 2 -1.839 -56.630 -21.755
11 H THR 3 H THR 3 3.069 -55.992 -19.955
12 HA THR 3 HA THR 3 3.565 -53.118 -19.625
13 HB THR 3 HB THR 3 5.206 -53.810 -17.934
14 HG21 THR 3 HG21 THR 3 3.000 -55.604 -17.179
15 HG22 THR 3 HG22 THR 3 2.466 -54.020 -17.746
16 HG23 THR 3 HG23 THR 3 3.580 -54.140 -16.384
17 H THR 4 H THR 4 6.112 -52.717 -19.503
18 HA THR 4 HA THR 4 7.399 -53.974 -21.837
19 HB THR 4 HB THR 4 8.119 -51.797 -22.675
20 HG21 THR 4 HG21 THR 4 5.253 -51.204 -22.284
21 HG22 THR 4 HG22 THR 4 5.592 -52.827 -22.886
22 HG23 THR 4 HG23 THR 4 6.164 -51.418 -23.779
23 H THR 5 H THR 5 9.575 -54.268 -21.642
24 HA THR 5 HA THR 5 11.109 -52.893 -19.604
25 HB THR 5 HB THR 5 10.622 -55.874 -19.396
26 HG1 THR 5 HG1 THR 5 9.746 -55.259 -17.385
27 HG21 THR 5 HG21 THR 5 12.708 -55.873 -18.522
28 HG22 THR 5 HG22 THR 5 11.992 -55.026 -17.151
29 HG23 THR 5 HG23 THR 5 12.762 -54.111 -18.446
30 HA PRO 6 HA PRO 6 13.466 -54.356 -23.313
31 HB2 PRO 6 HB2 PRO 6 14.300 -51.632 -23.751
32 HB3 PRO 6 HB3 PRO 6 13.259 -52.637 -24.771
33 HG2 PRO 6 HG2 PRO 6 12.449 -50.413 -23.347
34 HG3 PRO 6 HG3 PRO 6 11.385 -51.674 -23.986
35 HD2 PRO 6 HD2 PRO 6 12.324 -51.245 -21.189
36 HD3 PRO 6 HD3 PRO 6 10.805 -51.961 -21.776
37 H LEU 7 H LEU 7 14.074 -53.480 -20.298
38 HA LEU 7 HA LEU 7 16.800 -52.589 -20.403
39 HB2 LEU 7 HB2 LEU 7 14.808 -52.892 -18.418
40 HB3 LEU 7 HB3 LEU 7 16.171 -53.897 -17.925
41 HG LEU 7 HG LEU 7 17.688 -51.942 -18.334
42 HD11 LEU 7 HD11 LEU 7 15.342 -50.913 -19.565
43 HD12 LEU 7 HD12 LEU 7 16.911 -50.124 -19.408
44 HD13 LEU 7 HD13 LEU 7 15.679 -49.893 -18.167
45 HD21 LEU 7 HD21 LEU 7 17.214 -52.149 -16.068
46 HD22 LEU 7 HD22 LEU 7 15.479 -51.937 -16.307
47 HD23 LEU 7 HD23 LEU 7 16.558 -50.542 -16.381
48 H LYS 8 H LYS 8 18.677 -53.763 -20.037
49 HA LYS 8 HA LYS 8 18.569 -56.634 -19.639
50 HB2 LYS 8 HB2 LYS 8 19.989 -56.990 -21.746
51 HB3 LYS 8 HB3 LYS 8 18.260 -56.729 -21.981
52 HG2 LYS 8 HG2 LYS 8 18.554 -54.598 -22.836
53 HG3 LYS 8 HG3 LYS 8 20.060 -54.338 -21.954
54 HD2 LYS 8 HD2 LYS 8 20.479 -54.622 -24.375
55 HD3 LYS 8 HD3 LYS 8 21.218 -55.923 -23.441
56 HE2 LYS 8 HE2 LYS 8 19.425 -57.437 -23.991
57 HE3 LYS 8 HE3 LYS 8 18.482 -56.138 -24.722
58 HZ1 LYS 8 HZ1 LYS 8 21.172 -56.876 -25.708
59 HZ2 LYS 8 HZ2 LYS 8 19.976 -55.960 -26.495
60 HZ3 LYS 8 HZ3 LYS 8 19.767 -57.633 -26.282
61 HN1 NH2 9 HN1 NH2 9 21.472 -54.273 -18.551
62 HN2 NH2 9 HN2 NH2 9 19.834 -54.419 -18.127
63 H1 A2G 10 H1 A2G 10 6.890 -55.099 -18.944
64 H2 A2G 10 H2 A2G 10 8.065 -57.188 -18.395
65 HN2 A2G 10 HN2 A2G 10 5.694 -57.612 -20.116
66 H3 A2G 10 H3 A2G 10 5.332 -58.238 -17.616
67 HO3 A2G 10 HO3 A2G 10 6.685 -59.811 -18.441
68 H4 A2G 10 H4 A2G 10 6.147 -58.243 -15.331
69 HO4 A2G 10 HO4 A2G 10 8.255 -58.527 -15.366
70 H5 A2G 10 H5 A2G 10 5.119 -56.141 -16.064
71 H6 A2G 10 H6 A2G 10 7.543 -55.172 -14.607
72 H8 A2G 10 H8 A2G 10 6.768 -59.511 -22.018
73 H8A A2G 10 H8A A2G 10 7.854 -58.361 -22.798
74 H8B A2G 10 H8B A2G 10 6.217 -57.872 -22.362
75 H14 A2G 10 H14 A2G 10 5.838 -54.880 -14.263
76 H15 A2G 10 H15 A2G 10 7.413 -56.646 -13.140
77 H1 A2G 11 H1 A2G 11 9.213 -50.364 -21.729
78 H2 A2G 11 H2 A2G 11 9.441 -48.328 -20.371
79 HN2 A2G 11 HN2 A2G 11 8.453 -50.642 -18.810
80 H3 A2G 11 H3 A2G 11 6.613 -48.920 -19.456
81 HO3 A2G 11 HO3 A2G 11 7.949 -46.523 -19.008
82 H4 A2G 11 H4 A2G 11 5.970 -46.919 -20.677
83 HO4 A2G 11 HO4 A2G 11 8.246 -46.081 -20.387
84 H5 A2G 11 H5 A2G 11 5.952 -49.014 -21.956
85 H6 A2G 11 H6 A2G 11 6.129 -48.071 -24.207
86 H8 A2G 11 H8 A2G 11 10.304 -51.769 -17.746
87 H8A A2G 11 H8A A2G 11 9.977 -50.568 -16.496
88 H8B A2G 11 H8B A2G 11 11.603 -50.731 -17.159
89 H14 A2G 11 H14 A2G 11 5.436 -46.864 -23.125
90 H15 A2G 11 H15 A2G 11 8.200 -47.041 -23.699
Start of MODEL 25
1 H1 ACE 1 H1 ACE 1 -1.616 -51.344 -16.892
2 H2 ACE 1 H2 ACE 1 -0.483 -50.021 -17.169
3 H3 ACE 1 H3 ACE 1 -0.363 -50.991 -15.702
4 HA PRO 2 HA PRO 2 0.688 -54.273 -19.187
5 HB2 PRO 2 HB2 PRO 2 1.141 -52.723 -21.572
6 HB3 PRO 2 HB3 PRO 2 -0.054 -54.003 -21.308
7 HG2 PRO 2 HG2 PRO 2 -0.392 -51.102 -21.270
8 HG3 PRO 2 HG3 PRO 2 -1.604 -52.380 -21.448
9 HD2 PRO 2 HD2 PRO 2 -1.371 -50.843 -19.193
10 HD3 PRO 2 HD3 PRO 2 -1.998 -52.508 -19.175
11 H THR 3 H THR 3 2.777 -54.822 -18.950
12 HA THR 3 HA THR 3 4.792 -52.694 -18.785
13 HB THR 3 HB THR 3 6.197 -54.358 -17.702
14 HG21 THR 3 HG21 THR 3 5.080 -54.080 -15.762
15 HG22 THR 3 HG22 THR 3 3.775 -55.138 -16.298
16 HG23 THR 3 HG23 THR 3 3.747 -53.424 -16.712
17 H THR 4 H THR 4 7.062 -53.549 -19.560
18 HA THR 4 HA THR 4 6.792 -54.911 -22.158
19 HB THR 4 HB THR 4 8.658 -53.071 -22.795
20 HG21 THR 4 HG21 THR 4 6.845 -51.841 -23.932
21 HG22 THR 4 HG22 THR 4 5.655 -52.649 -22.912
22 HG23 THR 4 HG23 THR 4 6.604 -53.583 -24.068
23 H THR 5 H THR 5 9.016 -55.433 -23.067
24 HA THR 5 HA THR 5 10.547 -56.737 -20.979
25 HB THR 5 HB THR 5 11.594 -57.938 -22.703
26 HG1 THR 5 HG1 THR 5 12.365 -56.370 -24.003
27 HG21 THR 5 HG21 THR 5 9.106 -58.287 -22.560
28 HG22 THR 5 HG22 THR 5 9.795 -58.679 -24.135
29 HG23 THR 5 HG23 THR 5 8.926 -57.162 -23.906
30 HA PRO 6 HA PRO 6 13.317 -53.223 -20.814
31 HB2 PRO 6 HB2 PRO 6 14.658 -54.517 -18.615
32 HB3 PRO 6 HB3 PRO 6 13.550 -53.138 -18.564
33 HG2 PRO 6 HG2 PRO 6 13.025 -55.657 -17.561
34 HG3 PRO 6 HG3 PRO 6 11.814 -54.421 -17.934
35 HD2 PRO 6 HD2 PRO 6 12.563 -56.854 -19.490
36 HD3 PRO 6 HD3 PRO 6 10.999 -56.011 -19.387
37 H LEU 7 H LEU 7 15.855 -53.160 -20.378
38 HA LEU 7 HA LEU 7 17.365 -55.430 -21.265
39 HB2 LEU 7 HB2 LEU 7 16.275 -54.559 -23.396
40 HB3 LEU 7 HB3 LEU 7 17.264 -53.111 -23.194
41 HG LEU 7 HG LEU 7 19.106 -55.130 -22.836
42 HD11 LEU 7 HD11 LEU 7 17.219 -55.939 -25.071
43 HD12 LEU 7 HD12 LEU 7 17.411 -56.802 -23.545
44 HD13 LEU 7 HD13 LEU 7 18.756 -56.711 -24.682
45 HD21 LEU 7 HD21 LEU 7 18.311 -53.725 -25.407
46 HD22 LEU 7 HD22 LEU 7 19.864 -54.507 -25.117
47 HD23 LEU 7 HD23 LEU 7 19.402 -53.088 -24.177
48 H LYS 8 H LYS 8 17.639 -53.959 -19.004
49 HA LYS 8 HA LYS 8 20.313 -52.878 -19.326
50 HB2 LYS 8 HB2 LYS 8 18.004 -51.157 -18.404
51 HB3 LYS 8 HB3 LYS 8 19.697 -50.755 -18.108
52 HG2 LYS 8 HG2 LYS 8 20.033 -51.036 -20.640
53 HG3 LYS 8 HG3 LYS 8 18.274 -50.996 -20.761
54 HD2 LYS 8 HD2 LYS 8 18.737 -48.843 -19.141
55 HD3 LYS 8 HD3 LYS 8 20.168 -48.809 -20.171
56 HE2 LYS 8 HE2 LYS 8 18.664 -48.968 -22.171
57 HE3 LYS 8 HE3 LYS 8 17.279 -48.827 -21.088
58 HZ1 LYS 8 HZ1 LYS 8 17.690 -46.658 -20.691
59 HZ2 LYS 8 HZ2 LYS 8 18.431 -46.739 -22.218
60 HZ3 LYS 8 HZ3 LYS 8 19.374 -46.825 -20.806
61 HN1 NH2 9 HN1 NH2 9 20.959 -54.617 -17.734
62 HN2 NH2 9 HN2 NH2 9 20.953 -53.958 -16.171
63 H1 A2G 10 H1 A2G 10 6.769 -56.012 -19.171
64 H2 A2G 10 H2 A2G 10 6.834 -58.467 -19.267
65 HN2 A2G 10 HN2 A2G 10 4.206 -57.468 -20.194
66 H3 A2G 10 H3 A2G 10 4.176 -58.346 -17.815
67 HO3 A2G 10 HO3 A2G 10 4.217 -60.120 -19.073
68 H4 A2G 10 H4 A2G 10 5.349 -59.313 -15.920
69 HO4 A2G 10 HO4 A2G 10 7.796 -58.942 -17.244
70 H5 A2G 10 H5 A2G 10 5.346 -56.861 -16.047
71 H6 A2G 10 H6 A2G 10 8.165 -57.282 -15.263
72 H8 A2G 10 H8 A2G 10 4.059 -58.884 -22.755
73 H8A A2G 10 H8A A2G 10 5.272 -57.853 -23.516
74 H8B A2G 10 H8B A2G 10 4.049 -57.145 -22.459
75 H14 A2G 10 H14 A2G 10 6.820 -56.641 -14.319
76 H15 A2G 10 H15 A2G 10 7.840 -59.123 -14.354
77 H1 A2G 11 H1 A2G 11 9.381 -51.167 -22.327
78 H2 A2G 11 H2 A2G 11 9.389 -49.065 -21.054
79 HN2 A2G 11 HN2 A2G 11 9.088 -51.397 -19.253
80 H3 A2G 11 H3 A2G 11 6.903 -50.160 -19.709
81 HO3 A2G 11 HO3 A2G 11 8.552 -47.911 -19.378
82 H4 A2G 11 H4 A2G 11 5.699 -48.384 -20.849
83 HO4 A2G 11 HO4 A2G 11 6.788 -46.751 -21.536
84 H5 A2G 11 H5 A2G 11 5.917 -50.498 -22.078
85 H6 A2G 11 H6 A2G 11 5.309 -49.678 -24.198
86 H8 A2G 11 H8 A2G 11 11.087 -52.153 -18.343
87 H8A A2G 11 H8A A2G 11 11.101 -50.739 -17.288
88 H8B A2G 11 H8B A2G 11 12.477 -51.068 -18.342
89 H14 A2G 11 H14 A2G 11 4.979 -48.302 -23.145
90 H15 A2G 11 H15 A2G 11 6.343 -47.252 -24.315
Start of MODEL 26
1 H1 ACE 1 H1 ACE 1 -2.038 -51.709 -17.850
2 H2 ACE 1 H2 ACE 1 -2.722 -52.190 -19.403
3 H3 ACE 1 H3 ACE 1 -1.732 -50.736 -19.288
4 HA PRO 2 HA PRO 2 0.590 -54.778 -20.625
5 HB2 PRO 2 HB2 PRO 2 1.693 -53.142 -22.723
6 HB3 PRO 2 HB3 PRO 2 0.645 -54.560 -22.877
7 HG2 PRO 2 HG2 PRO 2 -0.026 -51.723 -23.043
8 HG3 PRO 2 HG3 PRO 2 -0.928 -53.133 -23.615
9 HD2 PRO 2 HD2 PRO 2 -1.717 -51.621 -21.472
10 HD3 PRO 2 HD3 PRO 2 -2.104 -53.348 -21.638
11 H THR 3 H THR 3 2.985 -54.922 -20.791
12 HA THR 3 HA THR 3 4.442 -52.599 -19.741
13 HB THR 3 HB THR 3 5.489 -53.946 -17.976
14 HG21 THR 3 HG21 THR 3 2.539 -54.403 -17.648
15 HG22 THR 3 HG22 THR 3 3.155 -52.754 -17.755
16 HG23 THR 3 HG23 THR 3 3.712 -53.822 -16.466
17 H THR 4 H THR 4 6.885 -53.475 -19.422
18 HA THR 4 HA THR 4 7.593 -55.131 -21.753
19 HB THR 4 HB THR 4 9.567 -53.359 -21.944
20 HG21 THR 4 HG21 THR 4 6.766 -52.885 -23.008
21 HG22 THR 4 HG22 THR 4 7.971 -53.948 -23.735
22 HG23 THR 4 HG23 THR 4 8.249 -52.208 -23.681
23 H THR 5 H THR 5 9.744 -56.028 -21.648
24 HA THR 5 HA THR 5 10.489 -56.718 -18.932
25 HB THR 5 HB THR 5 10.943 -58.622 -20.040
26 HG1 THR 5 HG1 THR 5 13.003 -57.601 -21.543
27 HG21 THR 5 HG21 THR 5 11.130 -58.689 -22.532
28 HG22 THR 5 HG22 THR 5 11.036 -56.927 -22.550
29 HG23 THR 5 HG23 THR 5 9.668 -57.878 -21.973
30 HA PRO 6 HA PRO 6 13.829 -54.067 -18.006
31 HB2 PRO 6 HB2 PRO 6 15.913 -56.055 -18.017
32 HB3 PRO 6 HB3 PRO 6 15.096 -55.333 -16.622
33 HG2 PRO 6 HG2 PRO 6 14.659 -57.922 -17.900
34 HG3 PRO 6 HG3 PRO 6 14.189 -57.363 -16.289
35 HD2 PRO 6 HD2 PRO 6 12.389 -57.787 -18.309
36 HD3 PRO 6 HD3 PRO 6 12.128 -56.606 -17.006
37 H LEU 7 H LEU 7 14.147 -52.794 -19.801
38 HA LEU 7 HA LEU 7 15.313 -53.776 -22.232
39 HB2 LEU 7 HB2 LEU 7 13.734 -51.713 -21.805
40 HB3 LEU 7 HB3 LEU 7 15.258 -50.866 -21.535
41 HG LEU 7 HG LEU 7 15.934 -52.129 -23.786
42 HD11 LEU 7 HD11 LEU 7 14.099 -52.423 -25.295
43 HD12 LEU 7 HD12 LEU 7 12.968 -51.664 -24.174
44 HD13 LEU 7 HD13 LEU 7 13.643 -53.252 -23.806
45 HD21 LEU 7 HD21 LEU 7 15.225 -50.088 -25.012
46 HD22 LEU 7 HD22 LEU 7 15.946 -49.691 -23.452
47 HD23 LEU 7 HD23 LEU 7 14.195 -49.644 -23.652
48 H LYS 8 H LYS 8 16.957 -51.292 -22.544
49 HA LYS 8 HA LYS 8 19.156 -51.623 -20.683
50 HB2 LYS 8 HB2 LYS 8 19.308 -53.449 -22.535
51 HB3 LYS 8 HB3 LYS 8 19.801 -52.112 -23.576
52 HG2 LYS 8 HG2 LYS 8 21.874 -52.703 -22.771
53 HG3 LYS 8 HG3 LYS 8 21.397 -51.593 -21.485
54 HD2 LYS 8 HD2 LYS 8 20.383 -53.634 -20.309
55 HD3 LYS 8 HD3 LYS 8 21.274 -54.613 -21.476
56 HE2 LYS 8 HE2 LYS 8 22.527 -52.539 -19.653
57 HE3 LYS 8 HE3 LYS 8 22.543 -54.278 -19.357
58 HZ1 LYS 8 HZ1 LYS 8 23.752 -54.617 -21.383
59 HZ2 LYS 8 HZ2 LYS 8 24.575 -53.462 -20.447
60 HZ3 LYS 8 HZ3 LYS 8 23.648 -52.973 -21.784
61 HN1 NH2 9 HN1 NH2 9 20.356 -48.720 -21.261
62 HN2 NH2 9 HN2 NH2 9 18.854 -48.980 -20.517
63 H1 A2G 10 H1 A2G 10 6.507 -55.827 -18.783
64 H2 A2G 10 H2 A2G 10 6.570 -58.239 -18.317
65 HN2 A2G 10 HN2 A2G 10 4.464 -57.552 -20.283
66 H3 A2G 10 H3 A2G 10 3.578 -57.987 -17.907
67 HO3 A2G 10 HO3 A2G 10 5.382 -60.153 -17.597
68 H4 A2G 10 H4 A2G 10 4.021 -58.463 -15.565
69 HO4 A2G 10 HO4 A2G 10 6.771 -58.337 -16.221
70 H5 A2G 10 H5 A2G 10 4.092 -56.097 -16.214
71 H6 A2G 10 H6 A2G 10 6.473 -56.376 -14.417
72 H8 A2G 10 H8 A2G 10 4.821 -59.480 -22.223
73 H8A A2G 10 H8A A2G 10 6.443 -59.104 -22.803
74 H8B A2G 10 H8B A2G 10 5.273 -57.809 -22.556
75 H14 A2G 10 H14 A2G 10 5.065 -55.328 -14.250
76 H15 A2G 10 H15 A2G 10 3.851 -57.071 -13.620
77 H1 A2G 11 H1 A2G 11 10.256 -51.505 -21.276
78 H2 A2G 11 H2 A2G 11 9.968 -49.269 -20.297
79 HN2 A2G 11 HN2 A2G 11 8.824 -51.391 -18.576
80 H3 A2G 11 H3 A2G 11 7.069 -50.074 -19.930
81 HO3 A2G 11 HO3 A2G 11 6.972 -48.366 -18.722
82 H4 A2G 11 H4 A2G 11 6.557 -48.390 -21.607
83 HO4 A2G 11 HO4 A2G 11 9.334 -48.090 -22.013
84 H5 A2G 11 H5 A2G 11 7.034 -50.643 -22.455
85 H6 A2G 11 H6 A2G 11 7.421 -50.060 -24.721
86 H8 A2G 11 H8 A2G 11 10.257 -52.083 -16.886
87 H8A A2G 11 H8A A2G 11 9.894 -50.597 -16.010
88 H8B A2G 11 H8B A2G 11 11.565 -51.008 -16.394
89 H14 A2G 11 H14 A2G 11 6.735 -48.598 -24.014
90 H15 A2G 11 H15 A2G 11 9.303 -49.116 -24.907
Start of MODEL 27
1 H1 ACE 1 H1 ACE 1 -2.418 -53.426 -17.387
2 H2 ACE 1 H2 ACE 1 -2.019 -51.949 -18.262
3 H3 ACE 1 H3 ACE 1 -1.534 -52.133 -16.577
4 HA PRO 2 HA PRO 2 1.093 -55.632 -18.784
5 HB2 PRO 2 HB2 PRO 2 0.888 -55.070 -21.601
6 HB3 PRO 2 HB3 PRO 2 0.415 -56.544 -20.742
7 HG2 PRO 2 HG2 PRO 2 -1.238 -54.329 -21.687
8 HG3 PRO 2 HG3 PRO 2 -1.704 -55.975 -21.236
9 HD2 PRO 2 HD2 PRO 2 -2.324 -53.776 -19.724
10 HD3 PRO 2 HD3 PRO 2 -2.103 -55.400 -19.033
11 H THR 3 H THR 3 3.162 -55.399 -20.153
12 HA THR 3 HA THR 3 3.950 -52.605 -20.580
13 HB THR 3 HB THR 3 6.073 -53.034 -19.286
14 HG21 THR 3 HG21 THR 3 3.661 -53.347 -17.506
15 HG22 THR 3 HG22 THR 3 3.927 -51.863 -18.421
16 HG23 THR 3 HG23 THR 3 5.115 -52.388 -17.229
17 H THR 4 H THR 4 6.657 -53.033 -20.964
18 HA THR 4 HA THR 4 6.608 -54.660 -23.420
19 HB THR 4 HB THR 4 8.974 -53.293 -23.497
20 HG21 THR 4 HG21 THR 4 6.245 -52.284 -24.358
21 HG22 THR 4 HG22 THR 4 7.260 -53.400 -25.272
22 HG23 THR 4 HG23 THR 4 7.792 -51.740 -25.006
23 H THR 5 H THR 5 9.309 -55.055 -23.780
24 HA THR 5 HA THR 5 9.789 -57.243 -21.937
25 HB THR 5 HB THR 5 10.612 -58.051 -23.870
26 HG1 THR 5 HG1 THR 5 12.671 -56.136 -23.699
27 HG21 THR 5 HG21 THR 5 11.170 -56.554 -25.802
28 HG22 THR 5 HG22 THR 5 10.826 -55.166 -24.769
29 HG23 THR 5 HG23 THR 5 9.542 -56.307 -25.171
30 HA PRO 6 HA PRO 6 12.608 -55.614 -19.029
31 HB2 PRO 6 HB2 PRO 6 14.914 -57.133 -19.846
32 HB3 PRO 6 HB3 PRO 6 13.841 -57.428 -18.470
33 HG2 PRO 6 HG2 PRO 6 13.905 -58.716 -21.090
34 HG3 PRO 6 HG3 PRO 6 13.167 -59.265 -19.578
35 HD2 PRO 6 HD2 PRO 6 11.707 -58.418 -21.735
36 HD3 PRO 6 HD3 PRO 6 11.134 -58.278 -20.057
37 H LEU 7 H LEU 7 15.055 -54.799 -18.930
38 HA LEU 7 HA LEU 7 16.152 -53.768 -21.372
39 HB2 LEU 7 HB2 LEU 7 15.684 -51.462 -21.125
40 HB3 LEU 7 HB3 LEU 7 14.134 -52.266 -20.877
41 HG LEU 7 HG LEU 7 16.012 -51.257 -18.723
42 HD11 LEU 7 HD11 LEU 7 14.794 -49.372 -18.916
43 HD12 LEU 7 HD12 LEU 7 13.368 -50.294 -18.438
44 HD13 LEU 7 HD13 LEU 7 13.773 -50.117 -20.146
45 HD21 LEU 7 HD21 LEU 7 15.088 -53.237 -17.821
46 HD22 LEU 7 HD22 LEU 7 13.541 -52.988 -18.630
47 HD23 LEU 7 HD23 LEU 7 13.992 -51.975 -17.258
48 H LYS 8 H LYS 8 17.799 -51.883 -20.667
49 HA LYS 8 HA LYS 8 19.531 -53.147 -18.711
50 HB2 LYS 8 HB2 LYS 8 20.046 -50.555 -20.168
51 HB3 LYS 8 HB3 LYS 8 21.226 -51.686 -19.502
52 HG2 LYS 8 HG2 LYS 8 19.361 -52.218 -21.834
53 HG3 LYS 8 HG3 LYS 8 21.103 -51.961 -21.932
54 HD2 LYS 8 HD2 LYS 8 21.204 -53.954 -20.217
55 HD3 LYS 8 HD3 LYS 8 19.598 -54.321 -20.848
56 HE2 LYS 8 HE2 LYS 8 21.118 -55.554 -22.214
57 HE3 LYS 8 HE3 LYS 8 20.634 -54.161 -23.181
58 HZ1 LYS 8 HZ1 LYS 8 22.974 -53.871 -21.456
59 HZ2 LYS 8 HZ2 LYS 8 22.658 -53.194 -22.982
60 HZ3 LYS 8 HZ3 LYS 8 23.149 -54.815 -22.853
61 HN1 NH2 9 HN1 NH2 9 17.585 -49.793 -17.778
62 HN2 NH2 9 HN2 NH2 9 18.977 -49.429 -18.677
63 H1 A2G 10 H1 A2G 10 7.336 -54.736 -19.123
64 H2 A2G 10 H2 A2G 10 7.958 -56.778 -17.905
65 HN2 A2G 10 HN2 A2G 10 5.584 -57.230 -19.617
66 H3 A2G 10 H3 A2G 10 5.029 -56.928 -17.145
67 HO3 A2G 10 HO3 A2G 10 7.295 -58.485 -16.452
68 H4 A2G 10 H4 A2G 10 5.744 -56.442 -14.878
69 HO4 A2G 10 HO4 A2G 10 7.761 -57.343 -14.857
70 H5 A2G 10 H5 A2G 10 5.272 -54.475 -16.263
71 H6 A2G 10 H6 A2G 10 7.775 -53.569 -14.959
72 H8 A2G 10 H8 A2G 10 6.408 -59.620 -21.031
73 H8A A2G 10 H8A A2G 10 7.670 -58.821 -21.967
74 H8B A2G 10 H8B A2G 10 6.114 -58.027 -21.729
75 H14 A2G 10 H14 A2G 10 6.121 -52.994 -14.742
76 H15 A2G 10 H15 A2G 10 7.157 -55.440 -13.749
77 H1 A2G 11 H1 A2G 11 9.916 -51.587 -22.755
78 H2 A2G 11 H2 A2G 11 10.005 -49.517 -21.433
79 HN2 A2G 11 HN2 A2G 11 8.803 -51.774 -19.941
80 H3 A2G 11 H3 A2G 11 7.080 -50.055 -20.854
81 HO3 A2G 11 HO3 A2G 11 8.558 -47.731 -20.283
82 H4 A2G 11 H4 A2G 11 6.617 -48.081 -22.194
83 HO4 A2G 11 HO4 A2G 11 8.163 -46.719 -22.470
84 H5 A2G 11 H5 A2G 11 6.724 -50.210 -23.411
85 H6 A2G 11 H6 A2G 11 7.495 -49.277 -25.670
86 H8 A2G 11 H8 A2G 11 10.792 -52.885 -18.652
87 H8A A2G 11 H8A A2G 11 9.838 -51.831 -17.609
88 H8B A2G 11 H8B A2G 11 11.587 -51.629 -17.701
89 H14 A2G 11 H14 A2G 11 6.258 -48.340 -24.831
90 H15 A2G 11 H15 A2G 11 8.331 -47.304 -25.710
Start of MODEL 28
1 H1 ACE 1 H1 ACE 1 -2.999 -52.782 -20.999
2 H2 ACE 1 H2 ACE 1 -1.999 -51.460 -21.599
3 H3 ACE 1 H3 ACE 1 -2.453 -51.519 -19.896
4 HA PRO 2 HA PRO 2 0.361 -55.507 -20.343
5 HB2 PRO 2 HB2 PRO 2 1.678 -55.222 -22.889
6 HB3 PRO 2 HB3 PRO 2 0.623 -56.533 -22.342
7 HG2 PRO 2 HG2 PRO 2 0.020 -54.257 -24.068
8 HG3 PRO 2 HG3 PRO 2 -0.852 -55.783 -23.864
9 HD2 PRO 2 HD2 PRO 2 -1.803 -53.382 -22.951
10 HD3 PRO 2 HD3 PRO 2 -2.206 -54.939 -22.192
11 H THR 3 H THR 3 2.525 -55.498 -19.684
12 HA THR 3 HA THR 3 3.789 -52.849 -19.641
13 HB THR 3 HB THR 3 5.205 -53.809 -17.854
14 HG21 THR 3 HG21 THR 3 2.499 -53.179 -17.725
15 HG22 THR 3 HG22 THR 3 3.584 -53.354 -16.345
16 HG23 THR 3 HG23 THR 3 2.605 -54.722 -16.877
17 H THR 4 H THR 4 6.398 -53.374 -19.334
18 HA THR 4 HA THR 4 7.218 -55.030 -21.629
19 HB THR 4 HB THR 4 8.769 -53.225 -22.347
20 HG21 THR 4 HG21 THR 4 5.993 -52.066 -22.228
21 HG22 THR 4 HG22 THR 4 6.312 -53.528 -23.162
22 HG23 THR 4 HG23 THR 4 7.150 -52.028 -23.559
23 H THR 5 H THR 5 9.563 -55.476 -21.630
24 HA THR 5 HA THR 5 10.454 -56.104 -18.946
25 HB THR 5 HB THR 5 11.704 -57.699 -19.946
26 HG1 THR 5 HG1 THR 5 13.368 -56.949 -20.944
27 HG21 THR 5 HG21 THR 5 9.508 -57.639 -21.242
28 HG22 THR 5 HG22 THR 5 10.854 -58.446 -22.048
29 HG23 THR 5 HG23 THR 5 10.395 -56.811 -22.521
30 HA PRO 6 HA PRO 6 13.414 -52.896 -18.452
31 HB2 PRO 6 HB2 PRO 6 15.626 -54.570 -17.668
32 HB3 PRO 6 HB3 PRO 6 14.511 -53.669 -16.628
33 HG2 PRO 6 HG2 PRO 6 14.653 -56.420 -16.829
34 HG3 PRO 6 HG3 PRO 6 13.288 -55.502 -16.177
35 HD2 PRO 6 HD2 PRO 6 13.573 -56.811 -18.840
36 HD3 PRO 6 HD3 PRO 6 12.110 -56.522 -17.871
37 H LEU 7 H LEU 7 14.281 -51.805 -20.118
38 HA LEU 7 HA LEU 7 15.665 -53.099 -22.274
39 HB2 LEU 7 HB2 LEU 7 16.021 -50.775 -23.092
40 HB3 LEU 7 HB3 LEU 7 14.332 -51.109 -22.705
41 HG LEU 7 HG LEU 7 14.896 -50.161 -20.360
42 HD11 LEU 7 HD11 LEU 7 17.381 -49.682 -21.880
43 HD12 LEU 7 HD12 LEU 7 17.124 -49.755 -20.137
44 HD13 LEU 7 HD13 LEU 7 16.769 -48.269 -21.018
45 HD21 LEU 7 HD21 LEU 7 14.579 -48.652 -22.934
46 HD22 LEU 7 HD22 LEU 7 14.832 -47.743 -21.444
47 HD23 LEU 7 HD23 LEU 7 13.446 -48.823 -21.594
48 H LYS 8 H LYS 8 17.815 -51.946 -23.005
49 HA LYS 8 HA LYS 8 19.616 -51.295 -20.826
50 HB2 LYS 8 HB2 LYS 8 21.212 -53.163 -21.592
51 HB3 LYS 8 HB3 LYS 8 19.842 -53.631 -20.583
52 HG2 LYS 8 HG2 LYS 8 18.572 -54.308 -22.560
53 HG3 LYS 8 HG3 LYS 8 19.877 -53.762 -23.612
54 HD2 LYS 8 HD2 LYS 8 21.393 -55.393 -22.367
55 HD3 LYS 8 HD3 LYS 8 19.927 -56.060 -21.647
56 HE2 LYS 8 HE2 LYS 8 20.627 -55.938 -24.591
57 HE3 LYS 8 HE3 LYS 8 20.430 -57.383 -23.599
58 HZ1 LYS 8 HZ1 LYS 8 18.460 -55.882 -24.967
59 HZ2 LYS 8 HZ2 LYS 8 18.107 -55.921 -23.305
60 HZ3 LYS 8 HZ3 LYS 8 18.304 -57.371 -24.168
61 HN1 NH2 9 HN1 NH2 9 18.619 -50.487 -23.785
62 HN2 NH2 9 HN2 NH2 9 20.049 -49.666 -24.192
63 H1 A2G 10 H1 A2G 10 6.426 -55.580 -18.465
64 H2 A2G 10 H2 A2G 10 6.871 -57.917 -17.850
65 HN2 A2G 10 HN2 A2G 10 4.609 -57.666 -19.744
66 H3 A2G 10 H3 A2G 10 3.897 -58.077 -17.292
67 HO3 A2G 10 HO3 A2G 10 4.513 -60.161 -16.567
68 H4 A2G 10 H4 A2G 10 4.511 -58.315 -14.952
69 HO4 A2G 10 HO4 A2G 10 6.754 -59.093 -15.836
70 H5 A2G 10 H5 A2G 10 4.196 -56.016 -15.755
71 H6 A2G 10 H6 A2G 10 6.573 -56.319 -13.890
72 H8 A2G 10 H8 A2G 10 4.918 -59.407 -21.563
73 H8A A2G 10 H8A A2G 10 6.580 -59.429 -22.151
74 H8B A2G 10 H8B A2G 10 5.667 -57.920 -22.145
75 H14 A2G 10 H14 A2G 10 5.630 -54.842 -14.086
76 H15 A2G 10 H15 A2G 10 3.772 -56.243 -13.545
77 H1 A2G 11 H1 A2G 11 10.121 -52.025 -21.212
78 H2 A2G 11 H2 A2G 11 10.582 -49.867 -20.130
79 HN2 A2G 11 HN2 A2G 11 8.888 -51.631 -18.461
80 H3 A2G 11 H3 A2G 11 7.590 -49.741 -19.669
81 HO3 A2G 11 HO3 A2G 11 8.125 -48.275 -18.292
82 H4 A2G 11 H4 A2G 11 7.586 -47.894 -21.249
83 HO4 A2G 11 HO4 A2G 11 10.282 -48.448 -21.839
84 H5 A2G 11 H5 A2G 11 7.303 -50.136 -22.211
85 H6 A2G 11 H6 A2G 11 7.608 -49.490 -24.416
86 H8 A2G 11 H8 A2G 11 10.088 -52.849 -16.929
87 H8A A2G 11 H8A A2G 11 10.277 -51.438 -15.889
88 H8B A2G 11 H8B A2G 11 11.701 -52.302 -16.470
89 H14 A2G 11 H14 A2G 11 7.803 -47.926 -23.624
90 H15 A2G 11 H15 A2G 11 9.649 -47.962 -24.631
Start of MODEL 29
1 H1 ACE 1 H1 ACE 1 -1.672 -56.448 -18.770
2 H2 ACE 1 H2 ACE 1 -1.027 -55.278 -17.620
3 H3 ACE 1 H3 ACE 1 -0.327 -56.893 -17.721
4 HA PRO 2 HA PRO 2 1.073 -54.595 -21.700
5 HB2 PRO 2 HB2 PRO 2 0.383 -51.804 -21.493
6 HB3 PRO 2 HB3 PRO 2 -0.201 -52.993 -22.668
7 HG2 PRO 2 HG2 PRO 2 -1.721 -51.810 -20.687
8 HG3 PRO 2 HG3 PRO 2 -2.133 -53.294 -21.556
9 HD2 PRO 2 HD2 PRO 2 -1.038 -52.967 -18.802
10 HD3 PRO 2 HD3 PRO 2 -2.094 -54.240 -19.457
11 H THR 3 H THR 3 3.151 -54.829 -20.914
12 HA THR 3 HA THR 3 4.410 -52.389 -19.878
13 HB THR 3 HB THR 3 5.613 -53.661 -18.143
14 HG21 THR 3 HG21 THR 3 3.206 -52.625 -17.872
15 HG22 THR 3 HG22 THR 3 3.874 -53.635 -16.590
16 HG23 THR 3 HG23 THR 3 2.711 -54.312 -17.731
17 H THR 4 H THR 4 6.930 -53.089 -19.572
18 HA THR 4 HA THR 4 7.740 -54.640 -21.943
19 HB THR 4 HB THR 4 9.576 -52.725 -22.110
20 HG21 THR 4 HG21 THR 4 8.160 -51.633 -23.809
21 HG22 THR 4 HG22 THR 4 6.736 -52.430 -23.137
22 HG23 THR 4 HG23 THR 4 8.007 -53.388 -23.900
23 H THR 5 H THR 5 9.945 -55.387 -21.867
24 HA THR 5 HA THR 5 10.764 -56.068 -19.170
25 HB THR 5 HB THR 5 12.702 -57.138 -20.682
26 HG1 THR 5 HG1 THR 5 10.548 -57.301 -22.448
27 HG21 THR 5 HG21 THR 5 9.893 -58.020 -20.100
28 HG22 THR 5 HG22 THR 5 11.410 -58.615 -19.426
29 HG23 THR 5 HG23 THR 5 10.941 -59.055 -21.068
30 HA PRO 6 HA PRO 6 13.841 -53.117 -18.236
31 HB2 PRO 6 HB2 PRO 6 16.043 -54.968 -18.086
32 HB3 PRO 6 HB3 PRO 6 15.128 -54.245 -16.754
33 HG2 PRO 6 HG2 PRO 6 14.903 -56.904 -17.940
34 HG3 PRO 6 HG3 PRO 6 14.338 -56.315 -16.371
35 HD2 PRO 6 HD2 PRO 6 12.647 -56.930 -18.437
36 HD3 PRO 6 HD3 PRO 6 12.263 -55.716 -17.195
37 H LEU 7 H LEU 7 14.175 -51.885 -20.050
38 HA LEU 7 HA LEU 7 15.474 -52.883 -22.405
39 HB2 LEU 7 HB2 LEU 7 14.066 -50.503 -21.612
40 HB3 LEU 7 HB3 LEU 7 15.584 -50.061 -22.393
41 HG LEU 7 HG LEU 7 13.602 -52.045 -23.541
42 HD11 LEU 7 HD11 LEU 7 13.887 -49.078 -23.803
43 HD12 LEU 7 HD12 LEU 7 12.427 -50.066 -23.800
44 HD13 LEU 7 HD13 LEU 7 13.445 -50.003 -25.238
45 HD21 LEU 7 HD21 LEU 7 15.215 -52.483 -25.053
46 HD22 LEU 7 HD22 LEU 7 16.324 -51.496 -24.102
47 HD23 LEU 7 HD23 LEU 7 15.391 -50.764 -25.408
48 H LYS 8 H LYS 8 17.581 -53.276 -22.544
49 HA LYS 8 HA LYS 8 19.505 -51.301 -21.641
50 HB2 LYS 8 HB2 LYS 8 20.764 -52.824 -20.214
51 HB3 LYS 8 HB3 LYS 8 19.117 -52.667 -19.603
52 HG2 LYS 8 HG2 LYS 8 18.560 -54.755 -20.971
53 HG3 LYS 8 HG3 LYS 8 20.300 -54.961 -21.176
54 HD2 LYS 8 HD2 LYS 8 20.520 -54.862 -18.661
55 HD3 LYS 8 HD3 LYS 8 18.759 -54.909 -18.569
56 HE2 LYS 8 HE2 LYS 8 18.968 -57.161 -18.591
57 HE3 LYS 8 HE3 LYS 8 19.354 -56.990 -20.303
58 HZ1 LYS 8 HZ1 LYS 8 21.585 -56.468 -18.573
59 HZ2 LYS 8 HZ2 LYS 8 21.482 -57.471 -19.940
60 HZ3 LYS 8 HZ3 LYS 8 20.988 -58.048 -18.420
61 HN1 NH2 9 HN1 NH2 9 21.461 -52.297 -24.193
62 HN2 NH2 9 HN2 NH2 9 21.810 -51.939 -22.571
63 H1 A2G 10 H1 A2G 10 6.726 -55.478 -18.985
64 H2 A2G 10 H2 A2G 10 6.954 -57.879 -18.510
65 HN2 A2G 10 HN2 A2G 10 4.765 -57.311 -20.420
66 H3 A2G 10 H3 A2G 10 3.967 -57.811 -18.008
67 HO3 A2G 10 HO3 A2G 10 4.573 -59.767 -18.804
68 H4 A2G 10 H4 A2G 10 4.510 -58.244 -15.679
69 HO4 A2G 10 HO4 A2G 10 6.938 -57.893 -15.289
70 H5 A2G 10 H5 A2G 10 4.412 -55.883 -16.341
71 H6 A2G 10 H6 A2G 10 6.860 -56.013 -14.615
72 H8 A2G 10 H8 A2G 10 5.238 -59.183 -22.481
73 H8A A2G 10 H8A A2G 10 6.824 -58.609 -22.997
74 H8B A2G 10 H8B A2G 10 5.534 -57.455 -22.659
75 H14 A2G 10 H14 A2G 10 5.407 -55.034 -14.417
76 H15 A2G 10 H15 A2G 10 5.469 -57.854 -14.162
77 H1 A2G 11 H1 A2G 11 10.137 -50.840 -21.409
78 H2 A2G 11 H2 A2G 11 9.700 -48.654 -20.375
79 HN2 A2G 11 HN2 A2G 11 8.746 -50.903 -18.702
80 H3 A2G 11 H3 A2G 11 6.871 -49.674 -19.999
81 HO3 A2G 11 HO3 A2G 11 8.276 -47.900 -18.704
82 H4 A2G 11 H4 A2G 11 6.218 -47.995 -21.630
83 HO4 A2G 11 HO4 A2G 11 8.404 -46.853 -20.986
84 H5 A2G 11 H5 A2G 11 6.848 -50.189 -22.535
85 H6 A2G 11 H6 A2G 11 7.194 -49.528 -24.795
86 H8 A2G 11 H8 A2G 11 10.268 -51.538 -17.087
87 H8A A2G 11 H8A A2G 11 9.822 -50.141 -16.107
88 H8B A2G 11 H8B A2G 11 11.503 -50.386 -16.581
89 H14 A2G 11 H14 A2G 11 6.369 -48.158 -24.052
90 H15 A2G 11 H15 A2G 11 8.818 -47.651 -23.584
Start of MODEL 30
1 H1 ACE 1 H1 ACE 1 -0.072 -55.007 -16.645
2 H2 ACE 1 H2 ACE 1 1.356 -55.748 -15.923
3 H3 ACE 1 H3 ACE 1 0.167 -56.751 -16.755
4 HA PRO 2 HA PRO 2 2.057 -56.600 -20.700
5 HB2 PRO 2 HB2 PRO 2 0.151 -54.918 -22.054
6 HB3 PRO 2 HB3 PRO 2 0.312 -56.678 -22.141
7 HG2 PRO 2 HG2 PRO 2 -1.571 -55.056 -20.610
8 HG3 PRO 2 HG3 PRO 2 -1.657 -56.765 -21.060
9 HD2 PRO 2 HD2 PRO 2 -1.210 -55.914 -18.495
10 HD3 PRO 2 HD3 PRO 2 -0.608 -57.464 -19.124
11 H THR 3 H THR 3 3.861 -55.441 -21.026
12 HA THR 3 HA THR 3 3.652 -52.540 -21.409
13 HB THR 3 HB THR 3 5.899 -52.500 -19.994
14 HG21 THR 3 HG21 THR 3 3.677 -51.315 -19.575
15 HG22 THR 3 HG22 THR 3 4.626 -51.694 -18.138
16 HG23 THR 3 HG23 THR 3 3.239 -52.695 -18.568
17 H THR 4 H THR 4 6.776 -53.714 -20.813
18 HA THR 4 HA THR 4 7.262 -54.336 -23.648
19 HB THR 4 HB THR 4 9.488 -52.852 -22.945
20 HG21 THR 4 HG21 THR 4 6.971 -51.929 -24.364
21 HG22 THR 4 HG22 THR 4 8.296 -52.824 -25.108
22 HG23 THR 4 HG23 THR 4 8.565 -51.187 -24.511
23 H THR 5 H THR 5 9.951 -54.625 -23.628
24 HA THR 5 HA THR 5 10.281 -57.029 -22.041
25 HB THR 5 HB THR 5 11.419 -57.546 -23.910
26 HG1 THR 5 HG1 THR 5 13.204 -55.609 -22.861
27 HG21 THR 5 HG21 THR 5 10.406 -55.687 -25.112
28 HG22 THR 5 HG22 THR 5 12.108 -55.802 -25.562
29 HG23 THR 5 HG23 THR 5 11.580 -54.564 -24.424
30 HA PRO 6 HA PRO 6 12.582 -55.738 -18.566
31 HB2 PRO 6 HB2 PRO 6 15.059 -57.044 -19.238
32 HB3 PRO 6 HB3 PRO 6 13.822 -57.570 -18.087
33 HG2 PRO 6 HG2 PRO 6 14.321 -58.467 -20.820
34 HG3 PRO 6 HG3 PRO 6 13.411 -59.252 -19.521
35 HD2 PRO 6 HD2 PRO 6 12.221 -58.157 -21.732
36 HD3 PRO 6 HD3 PRO 6 11.413 -58.278 -20.151
37 H LEU 7 H LEU 7 14.286 -54.312 -17.889
38 HA LEU 7 HA LEU 7 15.012 -52.371 -19.873
39 HB2 LEU 7 HB2 LEU 7 15.928 -52.621 -16.998
40 HB3 LEU 7 HB3 LEU 7 16.082 -51.192 -18.021
41 HG LEU 7 HG LEU 7 13.377 -51.906 -18.197
42 HD11 LEU 7 HD11 LEU 7 13.824 -53.379 -16.200
43 HD12 LEU 7 HD12 LEU 7 12.626 -52.119 -15.907
44 HD13 LEU 7 HD13 LEU 7 14.271 -51.930 -15.301
45 HD21 LEU 7 HD21 LEU 7 14.278 -49.624 -18.159
46 HD22 LEU 7 HD22 LEU 7 14.773 -49.829 -16.478
47 HD23 LEU 7 HD23 LEU 7 13.059 -49.807 -16.896
48 H LYS 8 H LYS 8 17.083 -51.818 -20.595
49 HA LYS 8 HA LYS 8 18.917 -54.059 -20.796
50 HB2 LYS 8 HB2 LYS 8 18.702 -51.352 -22.067
51 HB3 LYS 8 HB3 LYS 8 20.227 -52.234 -22.148
52 HG2 LYS 8 HG2 LYS 8 17.728 -53.729 -22.810
53 HG3 LYS 8 HG3 LYS 8 18.326 -52.568 -23.995
54 HD2 LYS 8 HD2 LYS 8 20.328 -53.726 -24.321
55 HD3 LYS 8 HD3 LYS 8 20.232 -54.530 -22.754
56 HE2 LYS 8 HE2 LYS 8 19.738 -56.029 -24.730
57 HE3 LYS 8 HE3 LYS 8 18.458 -55.971 -23.518
58 HZ1 LYS 8 HZ1 LYS 8 18.435 -55.080 -26.249
59 HZ2 LYS 8 HZ2 LYS 8 17.841 -53.916 -25.165
60 HZ3 LYS 8 HZ3 LYS 8 17.139 -55.462 -25.223
61 HN1 NH2 9 HN1 NH2 9 19.886 -52.210 -17.688
62 HN2 NH2 9 HN2 NH2 9 18.715 -51.341 -18.556
63 H1 A2G 10 H1 A2G 10 7.238 -53.949 -19.236
64 H2 A2G 10 H2 A2G 10 7.771 -55.708 -17.605
65 HN2 A2G 10 HN2 A2G 10 5.895 -56.611 -19.709
66 H3 A2G 10 H3 A2G 10 4.772 -56.092 -17.411
67 HO3 A2G 10 HO3 A2G 10 7.015 -57.492 -16.614
68 H4 A2G 10 H4 A2G 10 4.968 -55.227 -15.149
69 HO4 A2G 10 HO4 A2G 10 7.243 -55.989 -15.038
70 H5 A2G 10 H5 A2G 10 4.599 -53.559 -16.913
71 H6 A2G 10 H6 A2G 10 6.702 -52.437 -15.051
72 H8 A2G 10 H8 A2G 10 6.866 -59.069 -20.481
73 H8A A2G 10 H8A A2G 10 8.507 -58.666 -20.990
74 H8B A2G 10 H8B A2G 10 7.153 -57.662 -21.505
75 H14 A2G 10 H14 A2G 10 5.272 -51.628 -15.691
76 H15 A2G 10 H15 A2G 10 4.142 -53.461 -14.523
77 H1 A2G 11 H1 A2G 11 10.032 -51.294 -21.664
78 H2 A2G 11 H2 A2G 11 9.556 -49.401 -20.172
79 HN2 A2G 11 HN2 A2G 11 8.021 -51.789 -19.329
80 H3 A2G 11 H3 A2G 11 6.641 -50.100 -20.622
81 HO3 A2G 11 HO3 A2G 11 7.992 -48.726 -18.744
82 H4 A2G 11 H4 A2G 11 6.488 -47.992 -21.823
83 HO4 A2G 11 HO4 A2G 11 7.983 -46.717 -20.914
84 H5 A2G 11 H5 A2G 11 7.122 -49.951 -23.160
85 H6 A2G 11 H6 A2G 11 7.971 -48.793 -25.048
86 H8 A2G 11 H8 A2G 11 9.208 -53.133 -17.792
87 H8A A2G 11 H8A A2G 11 8.720 -51.945 -16.583
88 H8B A2G 11 H8B A2G 11 10.425 -52.345 -16.788
89 H14 A2G 11 H14 A2G 11 7.152 -47.544 -24.111
90 H15 A2G 11 H15 A2G 11 9.183 -46.807 -24.678
Start of MODEL 31
1 H1 ACE 1 H1 ACE 1 -2.575 -53.362 -18.614
2 H2 ACE 1 H2 ACE 1 -1.809 -51.774 -18.624
3 H3 ACE 1 H3 ACE 1 -1.603 -52.844 -17.236
4 HA PRO 2 HA PRO 2 0.666 -55.330 -20.800
5 HB2 PRO 2 HB2 PRO 2 0.967 -53.449 -22.959
6 HB3 PRO 2 HB3 PRO 2 0.129 -55.007 -22.974
7 HG2 PRO 2 HG2 PRO 2 -0.963 -52.309 -22.742
8 HG3 PRO 2 HG3 PRO 2 -1.767 -53.818 -23.197
9 HD2 PRO 2 HD2 PRO 2 -2.207 -52.547 -20.810
10 HD3 PRO 2 HD3 PRO 2 -2.372 -54.305 -21.020
11 H THR 3 H THR 3 2.560 -55.222 -19.699
12 HA THR 3 HA THR 3 4.043 -52.688 -19.614
13 HB THR 3 HB THR 3 5.428 -53.801 -17.916
14 HG21 THR 3 HG21 THR 3 2.761 -53.058 -17.663
15 HG22 THR 3 HG22 THR 3 3.879 -53.353 -16.332
16 HG23 THR 3 HG23 THR 3 2.822 -54.645 -16.897
17 H THR 4 H THR 4 6.601 -53.366 -19.487
18 HA THR 4 HA THR 4 7.198 -55.040 -21.838
19 HB THR 4 HB THR 4 8.857 -53.290 -22.563
20 HG21 THR 4 HG21 THR 4 6.421 -53.577 -23.418
21 HG22 THR 4 HG22 THR 4 7.260 -52.072 -23.796
22 HG23 THR 4 HG23 THR 4 6.081 -52.120 -22.485
23 H THR 5 H THR 5 9.623 -55.408 -22.012
24 HA THR 5 HA THR 5 10.574 -56.296 -19.421
25 HB THR 5 HB THR 5 11.817 -57.766 -20.603
26 HG1 THR 5 HG1 THR 5 12.478 -55.516 -22.175
27 HG21 THR 5 HG21 THR 5 10.936 -58.302 -22.757
28 HG22 THR 5 HG22 THR 5 10.454 -56.631 -23.049
29 HG23 THR 5 HG23 THR 5 9.599 -57.598 -21.849
30 HA PRO 6 HA PRO 6 13.514 -53.123 -18.657
31 HB2 PRO 6 HB2 PRO 6 15.760 -54.841 -18.101
32 HB3 PRO 6 HB3 PRO 6 14.660 -54.069 -16.950
33 HG2 PRO 6 HG2 PRO 6 14.824 -56.782 -17.440
34 HG3 PRO 6 HG3 PRO 6 13.466 -55.953 -16.666
35 HD2 PRO 6 HD2 PRO 6 13.703 -56.973 -19.458
36 HD3 PRO 6 HD3 PRO 6 12.260 -56.805 -18.432
37 H LEU 7 H LEU 7 14.197 -51.905 -20.339
38 HA LEU 7 HA LEU 7 15.659 -52.978 -22.562
39 HB2 LEU 7 HB2 LEU 7 14.660 -50.293 -21.734
40 HB3 LEU 7 HB3 LEU 7 15.960 -50.357 -22.925
41 HG LEU 7 HG LEU 7 13.577 -52.148 -23.268
42 HD11 LEU 7 HD11 LEU 7 12.451 -50.359 -24.551
43 HD12 LEU 7 HD12 LEU 7 13.712 -49.225 -24.070
44 HD13 LEU 7 HD13 LEU 7 12.631 -49.909 -22.856
45 HD21 LEU 7 HD21 LEU 7 14.318 -52.282 -25.454
46 HD22 LEU 7 HD22 LEU 7 15.854 -51.939 -24.660
47 HD23 LEU 7 HD23 LEU 7 14.960 -50.640 -25.448
48 H LYS 8 H LYS 8 17.787 -52.237 -23.236
49 HA LYS 8 HA LYS 8 19.542 -51.084 -21.234
50 HB2 LYS 8 HB2 LYS 8 19.820 -53.960 -22.122
51 HB3 LYS 8 HB3 LYS 8 21.124 -53.046 -21.363
52 HG2 LYS 8 HG2 LYS 8 19.449 -52.538 -19.480
53 HG3 LYS 8 HG3 LYS 8 18.453 -53.815 -20.181
54 HD2 LYS 8 HD2 LYS 8 20.915 -55.023 -20.092
55 HD3 LYS 8 HD3 LYS 8 20.958 -54.021 -18.641
56 HE2 LYS 8 HE2 LYS 8 18.807 -56.031 -19.372
57 HE3 LYS 8 HE3 LYS 8 20.003 -56.199 -18.087
58 HZ1 LYS 8 HZ1 LYS 8 19.071 -54.277 -16.989
59 HZ2 LYS 8 HZ2 LYS 8 17.858 -55.437 -17.248
60 HZ3 LYS 8 HZ3 LYS 8 17.947 -54.061 -18.242
61 HN1 NH2 9 HN1 NH2 9 19.594 -52.845 -24.442
62 HN2 NH2 9 HN2 NH2 9 21.108 -52.185 -24.833
63 H1 A2G 10 H1 A2G 10 6.549 -55.583 -18.643
64 H2 A2G 10 H2 A2G 10 6.908 -57.971 -18.185
65 HN2 A2G 10 HN2 A2G 10 4.631 -57.469 -20.009
66 H3 A2G 10 H3 A2G 10 3.943 -58.051 -17.565
67 HO3 A2G 10 HO3 A2G 10 6.031 -59.956 -17.590
68 H4 A2G 10 H4 A2G 10 4.586 -58.439 -15.258
69 HO4 A2G 10 HO4 A2G 10 6.988 -58.032 -14.912
70 H5 A2G 10 H5 A2G 10 4.378 -56.081 -15.896
71 H6 A2G 10 H6 A2G 10 6.909 -56.141 -14.286
72 H8 A2G 10 H8 A2G 10 5.043 -59.454 -22.009
73 H8A A2G 10 H8A A2G 10 6.560 -58.821 -22.648
74 H8B A2G 10 H8B A2G 10 5.235 -57.721 -22.269
75 H14 A2G 10 H14 A2G 10 5.442 -55.198 -14.022
76 H15 A2G 10 H15 A2G 10 4.473 -56.900 -13.131
77 H1 A2G 11 H1 A2G 11 10.206 -52.071 -21.461
78 H2 A2G 11 H2 A2G 11 10.677 -49.908 -20.391
79 HN2 A2G 11 HN2 A2G 11 8.975 -51.639 -18.694
80 H3 A2G 11 H3 A2G 11 7.687 -49.772 -19.919
81 HO3 A2G 11 HO3 A2G 11 9.482 -47.662 -19.581
82 H4 A2G 11 H4 A2G 11 7.681 -47.934 -21.510
83 HO4 A2G 11 HO4 A2G 11 10.280 -48.424 -22.331
84 H5 A2G 11 H5 A2G 11 7.388 -50.180 -22.457
85 H6 A2G 11 H6 A2G 11 8.482 -49.705 -24.759
86 H8 A2G 11 H8 A2G 11 10.830 -52.994 -17.150
87 H8A A2G 11 H8A A2G 11 9.830 -51.730 -16.434
88 H8B A2G 11 H8B A2G 11 11.585 -51.663 -16.275
89 H14 A2G 11 H14 A2G 11 7.332 -48.517 -24.146
90 H15 A2G 11 H15 A2G 11 9.140 -47.353 -23.317
Start of MODEL 32
1 H1 ACE 1 H1 ACE 1 -2.015 -50.423 -18.753
2 H2 ACE 1 H2 ACE 1 -0.648 -49.416 -19.230
3 H3 ACE 1 H3 ACE 1 -0.929 -49.774 -17.526
4 HA PRO 2 HA PRO 2 0.676 -53.852 -19.492
5 HB2 PRO 2 HB2 PRO 2 1.607 -53.327 -22.169
6 HB3 PRO 2 HB3 PRO 2 0.276 -54.375 -21.658
7 HG2 PRO 2 HG2 PRO 2 0.012 -52.013 -23.065
8 HG3 PRO 2 HG3 PRO 2 -1.274 -52.825 -22.161
9 HD2 PRO 2 HD2 PRO 2 0.331 -50.428 -21.406
10 HD3 PRO 2 HD3 PRO 2 -1.338 -50.859 -20.965
11 H THR 3 H THR 3 2.763 -54.598 -19.209
12 HA THR 3 HA THR 3 4.852 -52.540 -19.069
13 HB THR 3 HB THR 3 6.068 -54.147 -17.684
14 HG21 THR 3 HG21 THR 3 3.471 -54.566 -16.431
15 HG22 THR 3 HG22 THR 3 3.646 -52.916 -17.029
16 HG23 THR 3 HG23 THR 3 4.823 -53.571 -15.890
17 H THR 4 H THR 4 7.149 -53.690 -19.432
18 HA THR 4 HA THR 4 7.053 -55.231 -21.941
19 HB THR 4 HB THR 4 9.129 -53.684 -22.537
20 HG21 THR 4 HG21 THR 4 7.587 -52.254 -23.825
21 HG22 THR 4 HG22 THR 4 6.241 -52.809 -22.830
22 HG23 THR 4 HG23 THR 4 7.080 -53.941 -23.890
23 H THR 5 H THR 5 9.249 -56.115 -22.501
24 HA THR 5 HA THR 5 10.394 -57.329 -20.130
25 HB THR 5 HB THR 5 10.122 -58.050 -22.849
26 HG1 THR 5 HG1 THR 5 11.190 -59.974 -21.963
27 HG21 THR 5 HG21 THR 5 12.309 -56.909 -23.197
28 HG22 THR 5 HG22 THR 5 12.403 -58.649 -23.472
29 HG23 THR 5 HG23 THR 5 13.020 -57.958 -21.971
30 HA PRO 6 HA PRO 6 13.877 -54.845 -19.277
31 HB2 PRO 6 HB2 PRO 6 15.854 -56.887 -19.751
32 HB3 PRO 6 HB3 PRO 6 15.227 -56.310 -18.200
33 HG2 PRO 6 HG2 PRO 6 14.534 -58.710 -19.710
34 HG3 PRO 6 HG3 PRO 6 14.269 -58.334 -18.002
35 HD2 PRO 6 HD2 PRO 6 12.241 -58.453 -19.840
36 HD3 PRO 6 HD3 PRO 6 12.180 -57.425 -18.388
37 H LEU 7 H LEU 7 15.713 -53.810 -20.271
38 HA LEU 7 HA LEU 7 16.613 -54.544 -22.893
39 HB2 LEU 7 HB2 LEU 7 15.738 -52.554 -24.069
40 HB3 LEU 7 HB3 LEU 7 14.438 -53.613 -23.522
41 HG LEU 7 HG LEU 7 15.010 -51.815 -21.392
42 HD11 LEU 7 HD11 LEU 7 16.060 -50.329 -23.025
43 HD12 LEU 7 HD12 LEU 7 14.506 -49.655 -22.532
44 HD13 LEU 7 HD13 LEU 7 14.659 -50.469 -24.088
45 HD21 LEU 7 HD21 LEU 7 12.835 -52.831 -21.812
46 HD22 LEU 7 HD22 LEU 7 12.721 -52.020 -23.374
47 HD23 LEU 7 HD23 LEU 7 12.664 -51.077 -21.885
48 H LYS 8 H LYS 8 17.537 -53.707 -20.159
49 HA LYS 8 HA LYS 8 19.659 -51.951 -21.067
50 HB2 LYS 8 HB2 LYS 8 17.383 -50.874 -19.697
51 HB3 LYS 8 HB3 LYS 8 18.795 -50.755 -18.646
52 HG2 LYS 8 HG2 LYS 8 20.066 -49.689 -20.479
53 HG3 LYS 8 HG3 LYS 8 18.644 -49.790 -21.518
54 HD2 LYS 8 HD2 LYS 8 17.382 -48.399 -19.894
55 HD3 LYS 8 HD3 LYS 8 18.839 -48.253 -18.912
56 HE2 LYS 8 HE2 LYS 8 18.815 -47.463 -21.825
57 HE3 LYS 8 HE3 LYS 8 18.343 -46.332 -20.557
58 HZ1 LYS 8 HZ1 LYS 8 20.952 -47.270 -21.289
59 HZ2 LYS 8 HZ2 LYS 8 20.650 -47.413 -19.622
60 HZ3 LYS 8 HZ3 LYS 8 20.507 -45.903 -20.389
61 HN1 NH2 9 HN1 NH2 9 20.535 -51.486 -18.018
62 HN2 NH2 9 HN2 NH2 9 21.652 -52.651 -18.546
63 H1 A2G 10 H1 A2G 10 6.649 -56.008 -18.824
64 H2 A2G 10 H2 A2G 10 6.514 -58.456 -18.647
65 HN2 A2G 10 HN2 A2G 10 4.130 -57.334 -19.999
66 H3 A2G 10 H3 A2G 10 3.731 -57.975 -17.549
67 HO3 A2G 10 HO3 A2G 10 4.958 -60.058 -18.698
68 H4 A2G 10 H4 A2G 10 4.597 -58.797 -15.433
69 HO4 A2G 10 HO4 A2G 10 6.526 -59.664 -15.267
70 H5 A2G 10 H5 A2G 10 4.818 -56.384 -15.822
71 H6 A2G 10 H6 A2G 10 7.482 -57.049 -14.655
72 H8 A2G 10 H8 A2G 10 3.971 -59.097 -22.265
73 H8A A2G 10 H8A A2G 10 5.410 -58.485 -23.080
74 H8B A2G 10 H8B A2G 10 4.278 -57.362 -22.327
75 H14 A2G 10 H14 A2G 10 6.209 -56.005 -14.022
76 H15 A2G 10 H15 A2G 10 6.532 -58.063 -12.912
77 H1 A2G 11 H1 A2G 11 10.200 -51.988 -21.971
78 H2 A2G 11 H2 A2G 11 10.468 -49.827 -20.831
79 HN2 A2G 11 HN2 A2G 11 9.524 -51.972 -19.022
80 H3 A2G 11 H3 A2G 11 7.671 -50.313 -19.771
81 HO3 A2G 11 HO3 A2G 11 8.097 -48.043 -19.141
82 H4 A2G 11 H4 A2G 11 6.976 -48.461 -21.174
83 HO4 A2G 11 HO4 A2G 11 9.132 -47.471 -21.042
84 H5 A2G 11 H5 A2G 11 6.935 -50.659 -22.259
85 H6 A2G 11 H6 A2G 11 6.898 -49.926 -24.530
86 H8 A2G 11 H8 A2G 11 11.216 -52.915 -17.748
87 H8A A2G 11 H8A A2G 11 11.205 -51.485 -16.715
88 H8B A2G 11 H8B A2G 11 12.701 -51.996 -17.500
89 H14 A2G 11 H14 A2G 11 6.512 -48.494 -23.576
90 H15 A2G 11 H15 A2G 11 8.203 -47.606 -24.398
Start of MODEL 33
1 H1 ACE 1 H1 ACE 1 -1.922 -52.610 -18.382
2 H2 ACE 1 H2 ACE 1 -2.623 -53.272 -19.859
3 H3 ACE 1 H3 ACE 1 -1.812 -51.705 -19.893
4 HA PRO 2 HA PRO 2 0.908 -55.528 -21.121
5 HB2 PRO 2 HB2 PRO 2 1.694 -53.917 -23.376
6 HB3 PRO 2 HB3 PRO 2 0.819 -55.455 -23.382
7 HG2 PRO 2 HG2 PRO 2 -0.198 -52.734 -23.677
8 HG3 PRO 2 HG3 PRO 2 -0.952 -54.275 -24.108
9 HD2 PRO 2 HD2 PRO 2 -1.805 -52.727 -22.015
10 HD3 PRO 2 HD3 PRO 2 -1.989 -54.495 -22.054
11 H THR 3 H THR 3 2.738 -55.454 -19.957
12 HA THR 3 HA THR 3 4.134 -52.895 -19.607
13 HB THR 3 HB THR 3 5.315 -54.010 -17.785
14 HG21 THR 3 HG21 THR 3 3.539 -53.652 -16.447
15 HG22 THR 3 HG22 THR 3 2.724 -55.086 -17.073
16 HG23 THR 3 HG23 THR 3 2.542 -53.537 -17.897
17 H THR 4 H THR 4 6.643 -53.284 -19.358
18 HA THR 4 HA THR 4 7.608 -55.020 -21.535
19 HB THR 4 HB THR 4 9.026 -53.210 -22.391
20 HG21 THR 4 HG21 THR 4 6.451 -53.540 -22.969
21 HG22 THR 4 HG22 THR 4 7.361 -52.181 -23.628
22 HG23 THR 4 HG23 THR 4 6.320 -51.946 -22.225
23 H THR 5 H THR 5 9.885 -55.503 -21.409
24 HA THR 5 HA THR 5 10.777 -55.772 -18.664
25 HB THR 5 HB THR 5 12.823 -56.785 -20.070
26 HG1 THR 5 HG1 THR 5 11.501 -57.816 -21.899
27 HG21 THR 5 HG21 THR 5 11.293 -58.918 -20.213
28 HG22 THR 5 HG22 THR 5 10.130 -57.904 -19.358
29 HG23 THR 5 HG23 THR 5 11.704 -58.242 -18.636
30 HA PRO 6 HA PRO 6 13.492 -52.404 -18.108
31 HB2 PRO 6 HB2 PRO 6 15.890 -53.962 -17.763
32 HB3 PRO 6 HB3 PRO 6 14.892 -53.198 -16.516
33 HG2 PRO 6 HG2 PRO 6 14.976 -55.985 -17.382
34 HG3 PRO 6 HG3 PRO 6 14.339 -55.285 -15.888
35 HD2 PRO 6 HD2 PRO 6 12.740 -56.325 -17.854
36 HD3 PRO 6 HD3 PRO 6 12.214 -55.025 -16.759
37 H LEU 7 H LEU 7 14.525 -51.078 -19.506
38 HA LEU 7 HA LEU 7 15.252 -52.025 -22.117
39 HB2 LEU 7 HB2 LEU 7 15.644 -49.320 -20.809
40 HB3 LEU 7 HB3 LEU 7 15.892 -49.667 -22.521
41 HG LEU 7 HG LEU 7 13.277 -50.462 -21.323
42 HD11 LEU 7 HD11 LEU 7 14.249 -47.646 -21.677
43 HD12 LEU 7 HD12 LEU 7 13.204 -48.316 -20.425
44 HD13 LEU 7 HD13 LEU 7 12.564 -48.022 -22.041
45 HD21 LEU 7 HD21 LEU 7 12.490 -50.056 -23.535
46 HD22 LEU 7 HD22 LEU 7 14.069 -50.815 -23.743
47 HD23 LEU 7 HD23 LEU 7 13.896 -49.071 -23.936
48 H LYS 8 H LYS 8 17.086 -53.076 -22.508
49 HA LYS 8 HA LYS 8 19.398 -52.768 -20.781
50 HB2 LYS 8 HB2 LYS 8 20.344 -54.386 -22.645
51 HB3 LYS 8 HB3 LYS 8 19.209 -54.980 -21.431
52 HG2 LYS 8 HG2 LYS 8 18.068 -53.788 -23.920
53 HG3 LYS 8 HG3 LYS 8 18.798 -55.390 -24.040
54 HD2 LYS 8 HD2 LYS 8 16.919 -54.858 -21.772
55 HD3 LYS 8 HD3 LYS 8 16.240 -55.108 -23.381
56 HE2 LYS 8 HE2 LYS 8 17.381 -57.255 -23.574
57 HE3 LYS 8 HE3 LYS 8 18.186 -56.998 -22.026
58 HZ1 LYS 8 HZ1 LYS 8 16.423 -57.793 -20.980
59 HZ2 LYS 8 HZ2 LYS 8 15.698 -58.146 -22.476
60 HZ3 LYS 8 HZ3 LYS 8 15.407 -56.653 -21.717
61 HN1 NH2 9 HN1 NH2 9 19.773 -50.172 -23.642
62 HN2 NH2 9 HN2 NH2 9 18.284 -50.941 -23.374
63 H1 A2G 10 H1 A2G 10 6.625 -55.695 -18.604
64 H2 A2G 10 H2 A2G 10 7.113 -58.060 -18.148
65 HN2 A2G 10 HN2 A2G 10 4.899 -57.688 -20.079
66 H3 A2G 10 H3 A2G 10 4.131 -58.335 -17.680
67 HO3 A2G 10 HO3 A2G 10 5.459 -60.378 -16.792
68 H4 A2G 10 H4 A2G 10 4.682 -58.709 -15.346
69 HO4 A2G 10 HO4 A2G 10 6.614 -59.553 -15.181
70 H5 A2G 10 H5 A2G 10 4.356 -56.362 -15.974
71 H6 A2G 10 H6 A2G 10 6.785 -56.154 -14.264
72 H8 A2G 10 H8 A2G 10 5.568 -59.677 -22.042
73 H8A A2G 10 H8A A2G 10 7.024 -58.877 -22.636
74 H8B A2G 10 H8B A2G 10 5.573 -57.932 -22.301
75 H14 A2G 10 H14 A2G 10 5.167 -55.504 -13.999
76 H15 A2G 10 H15 A2G 10 4.574 -57.824 -13.746
77 H1 A2G 11 H1 A2G 11 10.445 -52.113 -21.112
78 H2 A2G 11 H2 A2G 11 10.975 -49.883 -20.221
79 HN2 A2G 11 HN2 A2G 11 9.078 -51.392 -18.521
80 H3 A2G 11 H3 A2G 11 7.974 -49.535 -19.975
81 HO3 A2G 11 HO3 A2G 11 9.175 -47.283 -19.727
82 H4 A2G 11 H4 A2G 11 8.170 -47.881 -21.740
83 HO4 A2G 11 HO4 A2G 11 10.614 -47.745 -21.008
84 H5 A2G 11 H5 A2G 11 7.829 -50.185 -22.508
85 H6 A2G 11 H6 A2G 11 8.616 -49.933 -24.764
86 H8 A2G 11 H8 A2G 11 10.019 -52.348 -16.670
87 H8A A2G 11 H8A A2G 11 10.222 -50.786 -15.877
88 H8B A2G 11 H8B A2G 11 11.620 -51.826 -16.148
89 H14 A2G 11 H14 A2G 11 8.297 -48.305 -24.164
90 H15 A2G 11 H15 A2G 11 10.675 -48.564 -23.473
Start of MODEL 34
1 H1 ACE 1 H1 ACE 1 -1.699 -51.001 -19.596
2 H2 ACE 1 H2 ACE 1 -1.947 -51.414 -17.899
3 H3 ACE 1 H3 ACE 1 -2.790 -52.315 -19.159
4 HA PRO 2 HA PRO 2 0.691 -54.973 -19.753
5 HB2 PRO 2 HB2 PRO 2 1.556 -54.251 -22.407
6 HB3 PRO 2 HB3 PRO 2 0.509 -55.594 -21.923
7 HG2 PRO 2 HG2 PRO 2 -0.283 -53.380 -23.373
8 HG3 PRO 2 HG3 PRO 2 -1.358 -54.481 -22.499
9 HD2 PRO 2 HD2 PRO 2 -0.426 -51.756 -21.728
10 HD3 PRO 2 HD3 PRO 2 -1.950 -52.585 -21.335
11 H THR 3 H THR 3 2.885 -55.174 -19.384
12 HA THR 3 HA THR 3 4.392 -52.660 -19.214
13 HB THR 3 HB THR 3 5.938 -53.939 -17.784
14 HG21 THR 3 HG21 THR 3 3.419 -54.833 -16.587
15 HG22 THR 3 HG22 THR 3 3.344 -53.172 -17.175
16 HG23 THR 3 HG23 THR 3 4.576 -53.636 -16.002
17 H THR 4 H THR 4 6.951 -53.388 -19.392
18 HA THR 4 HA THR 4 7.279 -54.799 -21.958
19 HB THR 4 HB THR 4 9.084 -52.897 -22.360
20 HG21 THR 4 HG21 THR 4 7.180 -53.418 -23.844
21 HG22 THR 4 HG22 THR 4 7.393 -51.675 -23.675
22 HG23 THR 4 HG23 THR 4 6.108 -52.497 -22.788
23 H THR 5 H THR 5 9.648 -55.222 -22.400
24 HA THR 5 HA THR 5 10.824 -56.374 -20.014
25 HB THR 5 HB THR 5 11.882 -57.764 -21.446
26 HG1 THR 5 HG1 THR 5 13.187 -57.020 -23.035
27 HG21 THR 5 HG21 THR 5 9.559 -57.419 -22.435
28 HG22 THR 5 HG22 THR 5 10.770 -58.069 -23.538
29 HG23 THR 5 HG23 THR 5 10.323 -56.365 -23.625
30 HA PRO 6 HA PRO 6 13.945 -53.367 -19.290
31 HB2 PRO 6 HB2 PRO 6 16.172 -55.190 -19.137
32 HB3 PRO 6 HB3 PRO 6 15.229 -54.498 -17.808
33 HG2 PRO 6 HG2 PRO 6 15.242 -57.157 -18.556
34 HG3 PRO 6 HG3 PRO 6 14.004 -56.369 -17.567
35 HD2 PRO 6 HD2 PRO 6 13.909 -57.130 -20.449
36 HD3 PRO 6 HD3 PRO 6 12.588 -57.020 -19.262
37 H LEU 7 H LEU 7 14.560 -51.997 -20.869
38 HA LEU 7 HA LEU 7 15.682 -52.879 -23.357
39 HB2 LEU 7 HB2 LEU 7 15.178 -50.185 -22.112
40 HB3 LEU 7 HB3 LEU 7 16.055 -50.341 -23.634
41 HG LEU 7 HG LEU 7 14.156 -51.584 -24.605
42 HD11 LEU 7 HD11 LEU 7 11.978 -51.402 -23.180
43 HD12 LEU 7 HD12 LEU 7 13.081 -51.227 -21.814
44 HD13 LEU 7 HD13 LEU 7 13.128 -52.687 -22.804
45 HD21 LEU 7 HD21 LEU 7 13.728 -48.859 -23.401
46 HD22 LEU 7 HD22 LEU 7 12.430 -49.626 -24.318
47 HD23 LEU 7 HD23 LEU 7 13.981 -49.299 -25.091
48 H LYS 8 H LYS 8 17.405 -54.075 -21.925
49 HA LYS 8 HA LYS 8 19.872 -52.587 -22.256
50 HB2 LYS 8 HB2 LYS 8 20.591 -52.556 -20.037
51 HB3 LYS 8 HB3 LYS 8 18.885 -52.135 -19.881
52 HG2 LYS 8 HG2 LYS 8 18.527 -54.715 -19.662
53 HG3 LYS 8 HG3 LYS 8 20.247 -54.746 -19.269
54 HD2 LYS 8 HD2 LYS 8 18.119 -53.119 -17.845
55 HD3 LYS 8 HD3 LYS 8 18.934 -54.549 -17.211
56 HE2 LYS 8 HE2 LYS 8 21.106 -53.106 -17.795
57 HE3 LYS 8 HE3 LYS 8 19.974 -51.773 -17.564
58 HZ1 LYS 8 HZ1 LYS 8 19.908 -52.124 -15.379
59 HZ2 LYS 8 HZ2 LYS 8 21.296 -53.080 -15.591
60 HZ3 LYS 8 HZ3 LYS 8 19.760 -53.805 -15.549
61 HN1 NH2 9 HN1 NH2 9 18.235 -55.719 -21.602
62 HN2 NH2 9 HN2 NH2 9 19.329 -56.400 -22.708
63 H1 A2G 10 H1 A2G 10 6.938 -55.670 -18.777
64 H2 A2G 10 H2 A2G 10 7.287 -58.092 -18.537
65 HN2 A2G 10 HN2 A2G 10 4.830 -57.450 -20.059
66 H3 A2G 10 H3 A2G 10 4.404 -58.165 -17.606
67 HO3 A2G 10 HO3 A2G 10 5.898 -60.341 -17.137
68 H4 A2G 10 H4 A2G 10 5.294 -58.759 -15.423
69 HO4 A2G 10 HO4 A2G 10 7.887 -58.233 -16.378
70 H5 A2G 10 H5 A2G 10 5.046 -56.357 -15.868
71 H6 A2G 10 H6 A2G 10 7.724 -56.611 -14.518
72 H8 A2G 10 H8 A2G 10 4.957 -59.139 -22.235
73 H8A A2G 10 H8A A2G 10 6.468 -58.632 -22.992
74 H8B A2G 10 H8B A2G 10 5.309 -57.423 -22.438
75 H14 A2G 10 H14 A2G 10 6.352 -55.596 -14.076
76 H15 A2G 10 H15 A2G 10 5.242 -57.679 -13.697
77 H1 A2G 11 H1 A2G 11 9.823 -51.077 -21.664
78 H2 A2G 11 H2 A2G 11 9.667 -48.965 -20.417
79 HN2 A2G 11 HN2 A2G 11 9.014 -51.335 -18.767
80 H3 A2G 11 H3 A2G 11 6.941 -49.961 -19.542
81 HO3 A2G 11 HO3 A2G 11 7.940 -48.697 -18.005
82 H4 A2G 11 H4 A2G 11 6.015 -48.179 -20.903
83 HO4 A2G 11 HO4 A2G 11 8.737 -47.567 -21.268
84 H5 A2G 11 H5 A2G 11 6.399 -50.295 -22.081
85 H6 A2G 11 H6 A2G 11 6.295 -49.463 -24.297
86 H8 A2G 11 H8 A2G 11 10.738 -52.063 -17.475
87 H8A A2G 11 H8A A2G 11 10.593 -50.720 -16.340
88 H8B A2G 11 H8B A2G 11 12.115 -50.999 -17.186
89 H14 A2G 11 H14 A2G 11 5.719 -48.118 -23.312
90 H15 A2G 11 H15 A2G 11 7.874 -48.257 -24.913
Start of MODEL 35
1 H1 ACE 1 H1 ACE 1 -1.970 -51.237 -19.784
2 H2 ACE 1 H2 ACE 1 -2.323 -52.017 -18.242
3 H3 ACE 1 H3 ACE 1 -2.890 -52.741 -19.746
4 HA PRO 2 HA PRO 2 0.603 -55.296 -20.399
5 HB2 PRO 2 HB2 PRO 2 1.756 -53.932 -22.657
6 HB3 PRO 2 HB3 PRO 2 0.777 -55.407 -22.653
7 HG2 PRO 2 HG2 PRO 2 0.005 -52.664 -23.280
8 HG3 PRO 2 HG3 PRO 2 -0.810 -54.185 -23.672
9 HD2 PRO 2 HD2 PRO 2 -1.765 -52.396 -21.823
10 HD3 PRO 2 HD3 PRO 2 -2.094 -54.142 -21.756
11 H THR 3 H THR 3 3.081 -55.210 -20.771
12 HA THR 3 HA THR 3 4.312 -52.754 -19.759
13 HB THR 3 HB THR 3 5.558 -53.961 -18.017
14 HG21 THR 3 HG21 THR 3 3.802 -53.977 -16.448
15 HG22 THR 3 HG22 THR 3 2.646 -54.620 -17.611
16 HG23 THR 3 HG23 THR 3 3.171 -52.942 -17.729
17 H THR 4 H THR 4 6.831 -53.357 -19.493
18 HA THR 4 HA THR 4 7.673 -54.946 -21.820
19 HB THR 4 HB THR 4 9.422 -52.993 -22.128
20 HG21 THR 4 HG21 THR 4 7.769 -53.765 -23.807
21 HG22 THR 4 HG22 THR 4 7.911 -52.008 -23.807
22 HG23 THR 4 HG23 THR 4 6.532 -52.781 -23.027
23 H THR 5 H THR 5 9.927 -55.553 -21.773
24 HA THR 5 HA THR 5 10.808 -56.161 -19.078
25 HB THR 5 HB THR 5 12.781 -57.144 -20.605
26 HG1 THR 5 HG1 THR 5 12.075 -56.377 -22.540
27 HG21 THR 5 HG21 THR 5 10.033 -58.167 -19.975
28 HG22 THR 5 HG22 THR 5 11.588 -58.675 -19.318
29 HG23 THR 5 HG23 THR 5 11.121 -59.154 -20.950
30 HA PRO 6 HA PRO 6 13.741 -53.044 -18.215
31 HB2 PRO 6 HB2 PRO 6 16.038 -54.775 -18.075
32 HB3 PRO 6 HB3 PRO 6 15.104 -54.086 -16.739
33 HG2 PRO 6 HG2 PRO 6 15.003 -56.766 -17.893
34 HG3 PRO 6 HG3 PRO 6 14.427 -56.189 -16.322
35 HD2 PRO 6 HD2 PRO 6 12.744 -56.915 -18.358
36 HD3 PRO 6 HD3 PRO 6 12.314 -55.710 -17.124
37 H LEU 7 H LEU 7 14.372 -51.670 -19.772
38 HA LEU 7 HA LEU 7 15.359 -52.557 -22.316
39 HB2 LEU 7 HB2 LEU 7 15.388 -49.755 -21.174
40 HB3 LEU 7 HB3 LEU 7 15.479 -50.211 -22.876
41 HG LEU 7 HG LEU 7 13.184 -51.502 -21.942
42 HD11 LEU 7 HD11 LEU 7 11.886 -49.744 -20.850
43 HD12 LEU 7 HD12 LEU 7 13.264 -48.646 -20.923
44 HD13 LEU 7 HD13 LEU 7 13.331 -50.080 -19.898
45 HD21 LEU 7 HD21 LEU 7 13.349 -50.518 -24.134
46 HD22 LEU 7 HD22 LEU 7 13.610 -48.912 -23.456
47 HD23 LEU 7 HD23 LEU 7 12.035 -49.690 -23.300
48 H LYS 8 H LYS 8 17.278 -53.675 -22.003
49 HA LYS 8 HA LYS 8 19.466 -52.465 -20.530
50 HB2 LYS 8 HB2 LYS 8 19.197 -54.880 -20.434
51 HB3 LYS 8 HB3 LYS 8 19.311 -54.990 -22.191
52 HG2 LYS 8 HG2 LYS 8 21.589 -54.491 -22.212
53 HG3 LYS 8 HG3 LYS 8 21.526 -53.670 -20.653
54 HD2 LYS 8 HD2 LYS 8 21.142 -55.831 -19.525
55 HD3 LYS 8 HD3 LYS 8 21.208 -56.655 -21.083
56 HE2 LYS 8 HE2 LYS 8 23.532 -55.468 -21.316
57 HE3 LYS 8 HE3 LYS 8 23.427 -55.313 -19.562
58 HZ1 LYS 8 HZ1 LYS 8 22.700 -57.926 -20.422
59 HZ2 LYS 8 HZ2 LYS 8 23.894 -57.452 -19.310
60 HZ3 LYS 8 HZ3 LYS 8 24.253 -57.521 -20.970
61 HN1 NH2 9 HN1 NH2 9 21.842 -52.098 -23.054
62 HN2 NH2 9 HN2 NH2 9 21.304 -51.241 -21.691
63 H1 A2G 10 H1 A2G 10 6.699 -55.794 -18.912
64 H2 A2G 10 H2 A2G 10 6.957 -58.199 -18.398
65 HN2 A2G 10 HN2 A2G 10 4.706 -57.662 -20.246
66 H3 A2G 10 H3 A2G 10 3.988 -58.051 -17.811
67 HO3 A2G 10 HO3 A2G 10 5.591 -60.242 -17.212
68 H4 A2G 10 H4 A2G 10 4.601 -58.518 -15.508
69 HO4 A2G 10 HO4 A2G 10 7.313 -58.198 -16.112
70 H5 A2G 10 H5 A2G 10 4.573 -56.146 -16.104
71 H6 A2G 10 H6 A2G 10 7.127 -56.271 -14.585
72 H8 A2G 10 H8 A2G 10 5.339 -59.469 -22.431
73 H8A A2G 10 H8A A2G 10 6.775 -58.577 -22.934
74 H8B A2G 10 H8B A2G 10 5.314 -57.706 -22.464
75 H14 A2G 10 H14 A2G 10 5.626 -55.430 -14.196
76 H15 A2G 10 H15 A2G 10 5.713 -57.099 -12.797
77 H1 A2G 11 H1 A2G 11 9.960 -51.019 -21.474
78 H2 A2G 11 H2 A2G 11 9.470 -48.818 -20.545
79 HN2 A2G 11 HN2 A2G 11 8.561 -50.996 -18.756
80 H3 A2G 11 H3 A2G 11 6.662 -49.873 -20.136
81 HO3 A2G 11 HO3 A2G 11 6.675 -47.350 -19.815
82 H4 A2G 11 H4 A2G 11 5.999 -48.247 -21.817
83 HO4 A2G 11 HO4 A2G 11 8.749 -47.637 -21.736
84 H5 A2G 11 H5 A2G 11 6.610 -50.482 -22.628
85 H6 A2G 11 H6 A2G 11 6.955 -49.916 -24.912
86 H8 A2G 11 H8 A2G 11 10.099 -51.532 -17.117
87 H8A A2G 11 H8A A2G 11 9.627 -50.089 -16.219
88 H8B A2G 11 H8B A2G 11 11.315 -50.337 -16.668
89 H14 A2G 11 H14 A2G 11 6.147 -48.509 -24.222
90 H15 A2G 11 H15 A2G 11 7.903 -47.787 -25.367
Start of MODEL 36
1 H1 ACE 1 H1 ACE 1 0.353 -56.238 -17.494
2 H2 ACE 1 H2 ACE 1 -1.079 -55.653 -18.343
3 H3 ACE 1 H3 ACE 1 -0.318 -54.655 -17.102
4 HA PRO 2 HA PRO 2 1.047 -53.764 -21.669
5 HB2 PRO 2 HB2 PRO 2 0.582 -51.002 -20.996
6 HB3 PRO 2 HB3 PRO 2 -0.253 -51.989 -22.205
7 HG2 PRO 2 HG2 PRO 2 -1.091 -51.251 -19.508
8 HG3 PRO 2 HG3 PRO 2 -2.054 -51.842 -20.868
9 HD2 PRO 2 HD2 PRO 2 -1.531 -53.346 -18.640
10 HD3 PRO 2 HD3 PRO 2 -1.819 -54.055 -20.245
11 H THR 3 H THR 3 3.128 -54.415 -20.824
12 HA THR 3 HA THR 3 4.785 -52.112 -20.075
13 HB THR 3 HB THR 3 5.924 -53.432 -18.315
14 HG21 THR 3 HG21 THR 3 4.344 -52.972 -16.660
15 HG22 THR 3 HG22 THR 3 2.996 -53.518 -17.656
16 HG23 THR 3 HG23 THR 3 3.762 -51.964 -17.985
17 H THR 4 H THR 4 7.159 -52.732 -20.174
18 HA THR 4 HA THR 4 7.565 -54.446 -22.536
19 HB THR 4 HB THR 4 9.916 -53.174 -22.298
20 HG21 THR 4 HG21 THR 4 8.415 -53.111 -24.256
21 HG22 THR 4 HG22 THR 4 9.021 -51.499 -23.876
22 HG23 THR 4 HG23 THR 4 7.378 -51.952 -23.423
23 H THR 5 H THR 5 9.521 -55.765 -22.609
24 HA THR 5 HA THR 5 9.900 -57.190 -20.112
25 HB THR 5 HB THR 5 10.054 -58.845 -21.627
26 HG1 THR 5 HG1 THR 5 12.136 -59.092 -21.406
27 HG21 THR 5 HG21 THR 5 10.681 -56.686 -23.657
28 HG22 THR 5 HG22 THR 5 9.112 -57.435 -23.368
29 HG23 THR 5 HG23 THR 5 10.428 -58.385 -24.056
30 HA PRO 6 HA PRO 6 13.612 -55.582 -18.480
31 HB2 PRO 6 HB2 PRO 6 15.260 -57.907 -18.905
32 HB3 PRO 6 HB3 PRO 6 14.493 -57.368 -17.402
33 HG2 PRO 6 HG2 PRO 6 13.657 -59.445 -19.277
34 HG3 PRO 6 HG3 PRO 6 13.183 -59.185 -17.592
35 HD2 PRO 6 HD2 PRO 6 11.496 -58.748 -19.705
36 HD3 PRO 6 HD3 PRO 6 11.375 -57.866 -18.166
37 H LEU 7 H LEU 7 14.231 -54.032 -19.973
38 HA LEU 7 HA LEU 7 16.556 -54.597 -21.554
39 HB2 LEU 7 HB2 LEU 7 14.370 -55.297 -22.904
40 HB3 LEU 7 HB3 LEU 7 14.323 -53.567 -23.238
41 HG LEU 7 HG LEU 7 16.671 -55.415 -23.754
42 HD11 LEU 7 HD11 LEU 7 14.765 -53.961 -25.613
43 HD12 LEU 7 HD12 LEU 7 14.859 -55.706 -25.374
44 HD13 LEU 7 HD13 LEU 7 16.200 -54.845 -26.132
45 HD21 LEU 7 HD21 LEU 7 16.290 -52.428 -23.980
46 HD22 LEU 7 HD22 LEU 7 17.479 -53.273 -24.972
47 HD23 LEU 7 HD23 LEU 7 17.612 -53.311 -23.215
48 H LYS 8 H LYS 8 17.736 -52.868 -21.058
49 HA LYS 8 HA LYS 8 16.491 -50.316 -20.455
50 HB2 LYS 8 HB2 LYS 8 18.501 -51.307 -19.233
51 HB3 LYS 8 HB3 LYS 8 19.449 -50.880 -20.658
52 HG2 LYS 8 HG2 LYS 8 18.492 -48.518 -20.403
53 HG3 LYS 8 HG3 LYS 8 17.938 -49.028 -18.808
54 HD2 LYS 8 HD2 LYS 8 20.806 -49.093 -19.791
55 HD3 LYS 8 HD3 LYS 8 20.135 -47.937 -18.641
56 HE2 LYS 8 HE2 LYS 8 21.031 -49.484 -17.170
57 HE3 LYS 8 HE3 LYS 8 19.410 -50.152 -17.363
58 HZ1 LYS 8 HZ1 LYS 8 21.866 -50.988 -18.806
59 HZ2 LYS 8 HZ2 LYS 8 20.305 -51.553 -19.170
60 HZ3 LYS 8 HZ3 LYS 8 21.004 -51.889 -17.658
61 HN1 NH2 9 HN1 NH2 9 16.136 -49.168 -23.316
62 HN2 NH2 9 HN2 NH2 9 16.970 -48.215 -22.187
63 H1 A2G 10 H1 A2G 10 6.662 -55.467 -18.955
64 H2 A2G 10 H2 A2G 10 6.496 -57.828 -18.296
65 HN2 A2G 10 HN2 A2G 10 4.356 -57.063 -20.194
66 H3 A2G 10 H3 A2G 10 3.581 -57.212 -17.745
67 HO3 A2G 10 HO3 A2G 10 3.755 -59.391 -16.883
68 H4 A2G 10 H4 A2G 10 4.116 -57.556 -15.400
69 HO4 A2G 10 HO4 A2G 10 6.833 -57.735 -16.148
70 H5 A2G 10 H5 A2G 10 4.399 -55.268 -16.244
71 H6 A2G 10 H6 A2G 10 6.855 -55.610 -14.583
72 H8 A2G 10 H8 A2G 10 4.534 -59.282 -22.058
73 H8A A2G 10 H8A A2G 10 6.080 -58.777 -22.739
74 H8B A2G 10 H8B A2G 10 4.833 -57.577 -22.397
75 H14 A2G 10 H14 A2G 10 5.513 -54.485 -14.380
76 H15 A2G 10 H15 A2G 10 4.270 -56.504 -13.907
77 H1 A2G 11 H1 A2G 11 10.899 -51.632 -21.294
78 H2 A2G 11 H2 A2G 11 10.982 -49.582 -19.942
79 HN2 A2G 11 HN2 A2G 11 9.334 -51.713 -18.715
80 H3 A2G 11 H3 A2G 11 7.962 -49.811 -19.847
81 HO3 A2G 11 HO3 A2G 11 9.897 -48.341 -18.533
82 H4 A2G 11 H4 A2G 11 7.914 -47.817 -21.228
83 HO4 A2G 11 HO4 A2G 11 10.588 -47.824 -20.585
84 H5 A2G 11 H5 A2G 11 8.026 -49.932 -22.462
85 H6 A2G 11 H6 A2G 11 8.558 -49.008 -24.526
86 H8 A2G 11 H8 A2G 11 10.304 -52.847 -17.055
87 H8A A2G 11 H8A A2G 11 10.412 -51.527 -15.888
88 H8B A2G 11 H8B A2G 11 11.878 -52.332 -16.448
89 H14 A2G 11 H14 A2G 11 8.409 -47.542 -23.556
90 H15 A2G 11 H15 A2G 11 10.392 -47.888 -24.902