Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
639261 | 6dul RC | 30482 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ILE 1 HT1 ILE 1 1.840 -0.042 -1.965
2 H2 ILE 1 HT2 ILE 1 1.286 -1.640 -2.003
3 H3 ILE 1 HT3 ILE 1 2.821 -1.288 -1.365
4 HA ILE 1 HA ILE 1 0.168 -0.694 -0.216
5 HB ILE 1 HB ILE 1 1.298 -1.763 1.799
6 HG12 ILE 1 HG12 ILE 1 3.633 -1.365 0.554
7 HG13 ILE 1 HG11 ILE 1 3.402 -2.732 1.640
8 HG21 ILE 1 HG21 ILE 1 0.981 -3.365 -0.756
9 HG22 ILE 1 HG22 ILE 1 -0.266 -3.027 0.443
10 HG23 ILE 1 HG23 ILE 1 1.092 -4.076 0.855
11 HD11 ILE 1 HD11 ILE 1 2.611 -3.195 -1.185
12 HD12 ILE 1 HD12 ILE 1 3.450 -4.262 -0.059
13 HD13 ILE 1 HD13 ILE 1 4.338 -2.986 -0.894
14 H ASN 2 HN ASN 2 2.648 -0.477 1.992
15 HA ASN 2 HA ASN 2 2.565 2.465 1.878
16 HB2 ASN 2 HB2 ASN 2 3.655 1.851 4.314
17 HB3 ASN 2 HB1 ASN 2 1.946 2.161 4.023
18 HD21 ASN 2 HD21 ASN 2 0.511 0.281 3.833
19 HD22 ASN 2 HD22 ASN 2 0.987 -1.232 4.441
20 H LEU 3 HN LEU 3 4.634 3.254 3.268
21 HA LEU 3 HA LEU 3 6.840 3.028 1.516
22 HB2 LEU 3 HB2 LEU 3 6.724 4.067 4.301
23 HB3 LEU 3 HB1 LEU 3 8.030 4.356 3.170
24 HG LEU 3 HG LEU 3 6.012 5.194 1.639
25 HD11 LEU 3 HD11 LEU 3 4.105 4.951 2.920
26 HD12 LEU 3 HD12 LEU 3 4.588 6.566 3.435
27 HD13 LEU 3 HD13 LEU 3 4.975 5.170 4.440
28 HD21 LEU 3 HD21 LEU 3 6.369 7.491 2.904
29 HD22 LEU 3 HD22 LEU 3 7.690 6.743 2.007
30 HD23 LEU 3 HD23 LEU 3 7.611 6.577 3.761
31 H LYS 4 HN LYS 4 5.830 1.292 4.310
32 HA LYS 4 HA LYS 4 8.162 0.278 5.330
33 HB2 LYS 4 HB2 LYS 4 5.555 -1.170 4.868
34 HB3 LYS 4 HB1 LYS 4 6.786 -1.607 6.054
35 HG2 LYS 4 HG2 LYS 4 5.937 1.204 6.240
36 HG3 LYS 4 HG1 LYS 4 4.630 0.056 6.542
37 HD2 LYS 4 HD2 LYS 4 5.844 -1.006 8.310
38 HD3 LYS 4 HD1 LYS 4 7.335 -0.164 7.881
39 HE2 LYS 4 HE2 LYS 4 4.813 1.230 8.815
40 HE3 LYS 4 HE1 LYS 4 6.163 0.828 9.870
41 HZ1 LYS 4 HZ1 LYS 4 6.617 2.981 9.236
42 HZ2 LYS 4 HZ2 LYS 4 6.068 2.759 7.643
43 HZ3 LYS 4 HZ3 LYS 4 7.548 2.088 8.139
44 H ALA 5 HN ALA 5 6.226 -0.966 2.620
45 HA ALA 5 HA ALA 5 7.959 -3.145 2.024
46 HB1 ALA 5 HB1 ALA 5 5.645 -3.089 1.219
47 HB2 ALA 5 HB2 ALA 5 6.762 -3.225 -0.139
48 HB3 ALA 5 HB3 ALA 5 6.008 -1.674 0.233
49 H LEU 6 HN LEU 6 7.651 0.143 0.712
50 HA LEU 6 HA LEU 6 9.655 -0.052 -1.244
51 HB2 LEU 6 HB2 LEU 6 8.917 2.415 0.326
52 HB3 LEU 6 HB1 LEU 6 9.536 2.333 -1.322
53 HG LEU 6 HG LEU 6 6.822 1.397 -0.338
54 HD11 LEU 6 HD11 LEU 6 7.339 3.882 -0.871
55 HD12 LEU 6 HD12 LEU 6 5.930 3.152 -1.640
56 HD13 LEU 6 HD13 LEU 6 7.424 3.358 -2.554
57 HD21 LEU 6 HD21 LEU 6 6.552 1.000 -2.912
58 HD22 LEU 6 HD22 LEU 6 7.364 -0.236 -1.950
59 HD23 LEU 6 HD23 LEU 6 8.311 0.901 -2.913
60 H ALA 7 HN ALA 7 9.696 0.961 2.129
61 HA ALA 7 HA ALA 7 12.419 1.710 2.228
62 HB1 ALA 7 HB1 ALA 7 11.091 2.481 4.020
63 HB2 ALA 7 HB2 ALA 7 12.106 1.235 4.747
64 HB3 ALA 7 HB3 ALA 7 10.430 0.877 4.331
65 H ALA 8 HN ALA 8 10.776 -1.359 2.584
66 HA ALA 8 HA ALA 8 12.863 -2.847 3.732
67 HB1 ALA 8 HB1 ALA 8 10.854 -3.853 1.706
68 HB2 ALA 8 HB2 ALA 8 10.509 -3.651 3.423
69 HB3 ALA 8 HB3 ALA 8 11.726 -4.813 2.899
70 H LEU 9 HN LEU 9 12.033 -2.416 0.299
71 HA LEU 9 HA LEU 9 14.377 -3.803 -0.595
72 HB2 LEU 9 HB2 LEU 9 13.788 -2.492 -2.807
73 HB3 LEU 9 HB1 LEU 9 12.801 -3.848 -2.273
74 HG LEU 9 HG LEU 9 11.882 -1.411 -1.024
75 HD11 LEU 9 HD11 LEU 9 12.641 -0.119 -2.827
76 HD12 LEU 9 HD12 LEU 9 10.980 -0.501 -3.275
77 HD13 LEU 9 HD13 LEU 9 12.318 -1.393 -4.002
78 HD21 LEU 9 HD21 LEU 9 9.778 -2.118 -2.233
79 HD22 LEU 9 HD22 LEU 9 10.498 -3.377 -1.229
80 HD23 LEU 9 HD23 LEU 9 10.720 -3.409 -2.976
81 H ALA 10 HN ALA 10 13.456 -0.410 -0.287
82 HA ALA 10 HA ALA 10 15.761 0.791 -1.311
83 HB1 ALA 10 HB1 ALA 10 15.078 2.767 -0.214
84 HB2 ALA 10 HB2 ALA 10 14.289 1.877 1.087
85 HB3 ALA 10 HB3 ALA 10 13.572 1.904 -0.525
86 H LYS 11 HN LYS 11 15.127 -0.607 1.871
87 HA LYS 11 HA LYS 11 17.262 0.356 3.331
88 HB2 LYS 11 HB2 LYS 11 15.428 -1.817 3.547
89 HB3 LYS 11 HB1 LYS 11 17.040 -2.414 3.936
90 HG2 LYS 11 HG2 LYS 11 17.338 -0.731 5.633
91 HG3 LYS 11 HG1 LYS 11 15.882 0.123 5.122
92 HD2 LYS 11 HD2 LYS 11 14.543 -1.215 6.356
93 HD3 LYS 11 HD1 LYS 11 15.332 -2.675 5.758
94 HE2 LYS 11 HE2 LYS 11 17.290 -1.939 7.353
95 HE3 LYS 11 HE1 LYS 11 16.032 -0.990 8.148
96 HZ1 LYS 11 HZ1 LYS 11 14.703 -3.109 8.182
97 HZ2 LYS 11 HZ2 LYS 11 16.048 -3.065 9.213
98 HZ3 LYS 11 HZ3 LYS 11 16.127 -3.921 7.748
99 H LYS 12 HN LYS 12 17.222 -2.207 0.927
100 HA LYS 12 HA LYS 12 19.939 -2.987 1.363
101 HB2 LYS 12 HB2 LYS 12 17.913 -3.549 -0.797
102 HB3 LYS 12 HB1 LYS 12 19.578 -4.122 -0.916
103 HG2 LYS 12 HG2 LYS 12 18.498 -5.919 0.134
104 HG3 LYS 12 HG1 LYS 12 19.181 -5.039 1.501
105 HD2 LYS 12 HD2 LYS 12 16.995 -5.275 2.246
106 HD3 LYS 12 HD1 LYS 12 16.847 -3.749 1.382
107 HE2 LYS 12 HE2 LYS 12 15.036 -5.137 0.652
108 HE3 LYS 12 HE1 LYS 12 16.197 -5.072 -0.669
109 HZ1 LYS 12 HZ1 LYS 12 17.028 -7.180 0.843
110 HZ2 LYS 12 HZ2 LYS 12 16.128 -7.279 -0.600
111 HZ3 LYS 12 HZ3 LYS 12 15.339 -7.313 0.895
112 H ILE 13 HN ILE 13 18.283 -0.711 -0.718
113 HA ILE 13 HA ILE 13 20.584 -0.132 -2.336
114 HB ILE 13 HB ILE 13 18.173 1.620 -2.043
115 HG12 ILE 13 HG12 ILE 13 17.485 -0.775 -2.407
116 HG13 ILE 13 HG11 ILE 13 17.046 0.295 -3.735
117 HG21 ILE 13 HG21 ILE 13 20.128 1.037 -4.283
118 HG22 ILE 13 HG22 ILE 13 19.989 2.538 -3.368
119 HG23 ILE 13 HG23 ILE 13 18.694 2.048 -4.459
120 HD11 ILE 13 HD11 ILE 13 18.477 -2.081 -3.967
121 HD12 ILE 13 HD12 ILE 13 19.723 -0.840 -4.072
122 HD13 ILE 13 HD13 ILE 13 18.365 -0.820 -5.195
123 H LEU 14 HN LEU 14 18.907 1.334 0.398
124 HA LEU 14 HA LEU 14 20.559 3.651 0.553
125 HB2 LEU 14 HB2 LEU 14 18.482 2.349 2.218
126 HB3 LEU 14 HB1 LEU 14 19.647 3.335 3.097
127 HG LEU 14 HG LEU 14 17.711 4.683 2.409
128 HD11 LEU 14 HD12 LEU 14 18.971 6.502 1.855
129 HD12 LEU 14 HD13 LEU 14 19.792 5.673 0.534
130 HD13 LEU 14 HD11 LEU 14 20.306 5.405 2.200
131 HD21 LEU 14 HD22 LEU 14 18.549 4.172 -0.449
132 HD22 LEU 14 HD23 LEU 14 17.092 4.982 0.125
133 HD23 LEU 14 HD21 LEU 14 17.277 3.242 0.341
134 HN1 NH2 15 H1 LEU 14 20.636 0.550 2.381
Start of MODEL 2
1 H1 ILE 1 HT1 ILE 1 2.664 -1.390 -4.339
2 H2 ILE 1 HT2 ILE 1 3.380 0.127 -4.094
3 H3 ILE 1 HT3 ILE 1 1.738 -0.100 -3.755
4 HA ILE 1 HA ILE 1 2.253 -1.566 -1.932
5 HB ILE 1 HB ILE 1 4.408 -2.316 -1.443
6 HG12 ILE 1 HG12 ILE 1 5.432 -0.053 -1.377
7 HG13 ILE 1 HG11 ILE 1 6.477 -1.223 -2.179
8 HG21 ILE 1 HG21 ILE 1 3.567 -2.999 -3.815
9 HG22 ILE 1 HG22 ILE 1 5.246 -3.331 -3.392
10 HG23 ILE 1 HG23 ILE 1 4.852 -1.943 -4.403
11 HD11 ILE 1 HD11 ILE 1 5.166 -0.360 -4.341
12 HD12 ILE 1 HD12 ILE 1 6.587 0.485 -3.725
13 HD13 ILE 1 HD13 ILE 1 4.972 1.079 -3.338
14 H ASN 2 HN ASN 2 3.384 -0.758 0.160
15 HA ASN 2 HA ASN 2 2.989 2.160 0.277
16 HB2 ASN 2 HB2 ASN 2 2.475 1.868 2.579
17 HB3 ASN 2 HB1 ASN 2 1.625 0.596 1.705
18 HD21 ASN 2 HD21 ASN 2 2.845 -1.562 1.567
19 HD22 ASN 2 HD22 ASN 2 3.779 -2.018 2.910
20 H LEU 3 HN LEU 3 4.255 2.829 2.513
21 HA LEU 3 HA LEU 3 6.902 3.208 1.694
22 HB2 LEU 3 HB2 LEU 3 5.691 3.525 4.392
23 HB3 LEU 3 HB1 LEU 3 7.216 4.226 3.881
24 HG LEU 3 HG LEU 3 5.489 5.053 1.892
25 HD11 LEU 3 HD11 LEU 3 3.366 4.940 2.623
26 HD12 LEU 3 HD12 LEU 3 3.787 6.089 3.890
27 HD13 LEU 3 HD13 LEU 3 3.883 4.357 4.204
28 HD21 LEU 3 HD21 LEU 3 5.502 7.257 3.247
29 HD22 LEU 3 HD22 LEU 3 7.062 6.564 2.808
30 HD23 LEU 3 HD23 LEU 3 6.440 6.364 4.446
31 H LYS 4 HN LYS 4 5.413 0.922 3.915
32 HA LYS 4 HA LYS 4 7.657 -0.017 5.206
33 HB2 LYS 4 HB2 LYS 4 5.153 -1.436 4.328
34 HB3 LYS 4 HB1 LYS 4 6.365 -2.178 5.365
35 HG2 LYS 4 HG2 LYS 4 6.077 -0.354 7.011
36 HG3 LYS 4 HG1 LYS 4 4.844 0.378 5.978
37 HD2 LYS 4 HD2 LYS 4 3.695 -1.954 6.103
38 HD3 LYS 4 HD1 LYS 4 4.735 -2.219 7.507
39 HE2 LYS 4 HE2 LYS 4 3.855 -0.106 8.498
40 HE3 LYS 4 HE1 LYS 4 2.765 0.056 7.121
41 HZ1 LYS 4 HZ1 LYS 4 2.585 -2.546 8.229
42 HZ2 LYS 4 HZ2 LYS 4 1.368 -1.374 8.044
43 HZ3 LYS 4 HZ3 LYS 4 2.331 -1.380 9.439
44 H ALA 5 HN ALA 5 6.239 -1.126 2.147
45 HA ALA 5 HA ALA 5 8.200 -3.119 1.645
46 HB1 ALA 5 HB1 ALA 5 7.336 -2.719 -0.804
47 HB2 ALA 5 HB2 ALA 5 6.117 -1.731 0.000
48 HB3 ALA 5 HB3 ALA 5 6.269 -3.442 0.400
49 H LEU 6 HN LEU 6 7.816 0.231 0.569
50 HA LEU 6 HA LEU 6 10.037 0.394 -1.139
51 HB2 LEU 6 HB2 LEU 6 8.419 2.348 0.428
52 HB3 LEU 6 HB1 LEU 6 9.962 2.889 -0.237
53 HG LEU 6 HG LEU 6 8.675 1.378 -2.263
54 HD11 LEU 6 HD11 LEU 6 6.681 3.107 -2.427
55 HD12 LEU 6 HD12 LEU 6 6.857 3.148 -0.673
56 HD13 LEU 6 HD13 LEU 6 6.511 1.626 -1.491
57 HD21 LEU 6 HD21 LEU 6 8.914 4.384 -2.000
58 HD22 LEU 6 HD22 LEU 6 8.882 3.439 -3.490
59 HD23 LEU 6 HD23 LEU 6 10.270 3.333 -2.408
60 H ALA 7 HN ALA 7 9.672 1.009 2.300
61 HA ALA 7 HA ALA 7 12.353 1.794 2.790
62 HB1 ALA 7 HB1 ALA 7 11.832 1.669 5.085
63 HB2 ALA 7 HB2 ALA 7 10.579 0.453 4.822
64 HB3 ALA 7 HB3 ALA 7 10.316 2.121 4.308
65 H ALA 8 HN ALA 8 10.748 -1.303 2.689
66 HA ALA 8 HA ALA 8 12.792 -2.832 3.908
67 HB1 ALA 8 HB1 ALA 8 11.112 -4.325 3.773
68 HB2 ALA 8 HB2 ALA 8 11.496 -4.504 2.062
69 HB3 ALA 8 HB3 ALA 8 10.271 -3.343 2.573
70 H LEU 9 HN LEU 9 12.028 -2.258 0.489
71 HA LEU 9 HA LEU 9 14.348 -3.673 -0.430
72 HB2 LEU 9 HB2 LEU 9 13.828 -2.537 -2.632
73 HB3 LEU 9 HB1 LEU 9 12.521 -3.511 -1.956
74 HG LEU 9 HG LEU 9 11.941 -1.123 -0.810
75 HD11 LEU 9 HD11 LEU 9 12.715 0.693 -1.944
76 HD12 LEU 9 HD12 LEU 9 12.511 -0.087 -3.512
77 HD13 LEU 9 HD13 LEU 9 13.957 -0.399 -2.553
78 HD21 LEU 9 HD21 LEU 9 11.164 -2.127 -3.567
79 HD22 LEU 9 HD22 LEU 9 10.310 -0.839 -2.720
80 HD23 LEU 9 HD23 LEU 9 10.341 -2.470 -2.046
81 H ALA 10 HN ALA 10 13.540 -0.249 0.009
82 HA ALA 10 HA ALA 10 15.843 0.918 -1.020
83 HB1 ALA 10 HB1 ALA 10 15.368 2.786 0.581
84 HB2 ALA 10 HB2 ALA 10 14.140 1.772 1.335
85 HB3 ALA 10 HB3 ALA 10 13.963 2.273 -0.345
86 H LYS 11 HN LYS 11 15.312 -0.534 2.164
87 HA LYS 11 HA LYS 11 17.577 0.333 3.497
88 HB2 LYS 11 HB2 LYS 11 15.613 -1.638 3.901
89 HB3 LYS 11 HB1 LYS 11 17.159 -2.481 4.005
90 HG2 LYS 11 HG2 LYS 11 16.700 0.139 5.450
91 HG3 LYS 11 HG1 LYS 11 16.242 -1.401 6.178
92 HD2 LYS 11 HD2 LYS 11 18.472 -2.155 6.273
93 HD3 LYS 11 HD1 LYS 11 19.008 -1.009 5.047
94 HE2 LYS 11 HE2 LYS 11 19.783 -0.230 7.207
95 HE3 LYS 11 HE1 LYS 11 18.512 0.855 6.639
96 HZ1 LYS 11 HZ1 LYS 11 18.113 0.330 8.910
97 HZ2 LYS 11 HZ2 LYS 11 18.241 -1.335 8.626
98 HZ3 LYS 11 HZ3 LYS 11 16.929 -0.456 7.989
99 H LYS 12 HN LYS 12 17.243 -2.150 1.040
100 HA LYS 12 HA LYS 12 19.959 -3.047 1.291
101 HB2 LYS 12 HB2 LYS 12 17.722 -3.645 -0.636
102 HB3 LYS 12 HB1 LYS 12 19.363 -4.229 -0.921
103 HG2 LYS 12 HG2 LYS 12 18.421 -5.993 0.289
104 HG3 LYS 12 HG1 LYS 12 19.237 -5.067 1.549
105 HD2 LYS 12 HD2 LYS 12 17.213 -5.119 2.591
106 HD3 LYS 12 HD1 LYS 12 16.796 -3.823 1.478
107 HE2 LYS 12 HE2 LYS 12 15.818 -5.379 -0.086
108 HE3 LYS 12 HE1 LYS 12 16.396 -6.755 0.842
109 HZ1 LYS 12 HZ1 LYS 12 14.905 -6.334 2.551
110 HZ2 LYS 12 HZ2 LYS 12 13.997 -6.064 1.135
111 HZ3 LYS 12 HZ3 LYS 12 14.596 -4.746 2.032
112 H ILE 13 HN ILE 13 18.166 -0.843 -0.791
113 HA ILE 13 HA ILE 13 20.367 -0.418 -2.588
114 HB ILE 13 HB ILE 13 18.010 1.389 -2.279
115 HG12 ILE 13 HG12 ILE 13 17.204 -0.965 -2.357
116 HG13 ILE 13 HG11 ILE 13 16.770 -0.074 -3.815
117 HG21 ILE 13 HG21 ILE 13 19.947 0.668 -4.470
118 HG22 ILE 13 HG22 ILE 13 19.524 2.268 -3.861
119 HG23 ILE 13 HG23 ILE 13 18.377 1.372 -4.856
120 HD11 ILE 13 HD11 ILE 13 19.020 -2.076 -3.483
121 HD12 ILE 13 HD12 ILE 13 18.873 -1.018 -4.888
122 HD13 ILE 13 HD13 ILE 13 17.613 -2.202 -4.541
123 H LEU 14 HN LEU 14 18.952 1.302 0.153
124 HA LEU 14 HA LEU 14 20.622 3.601 -0.072
125 HB2 LEU 14 HB2 LEU 14 18.725 2.491 1.926
126 HB3 LEU 14 HB1 LEU 14 19.931 3.621 2.539
127 HG LEU 14 HG LEU 14 19.243 5.298 0.904
128 HD11 LEU 14 HD12 LEU 14 17.348 3.126 -0.048
129 HD12 LEU 14 HD13 LEU 14 18.626 3.906 -0.981
130 HD13 LEU 14 HD11 LEU 14 17.196 4.821 -0.506
131 HD21 LEU 14 HD22 LEU 14 16.746 4.136 2.158
132 HD22 LEU 14 HD23 LEU 14 17.093 5.829 1.813
133 HD23 LEU 14 HD21 LEU 14 17.973 4.993 3.091
134 HN1 NH2 15 H1 LEU 14 22.377 1.410 -0.341
Start of MODEL 3
1 H1 ILE 1 HT1 ILE 1 3.635 -1.880 -0.224
2 H2 ILE 1 HT2 ILE 1 3.250 -2.030 -1.865
3 H3 ILE 1 HT3 ILE 1 2.604 -3.121 -0.745
4 HA ILE 1 HA ILE 1 1.157 -1.184 -1.626
5 HB ILE 1 HB ILE 1 0.342 -0.953 0.932
6 HG12 ILE 1 HG12 ILE 1 2.644 -2.288 1.392
7 HG13 ILE 1 HG11 ILE 1 1.214 -2.492 2.393
8 HG21 ILE 1 HG21 ILE 1 0.135 -3.377 -0.880
9 HG22 ILE 1 HG22 ILE 1 -0.990 -2.024 -0.764
10 HG23 ILE 1 HG23 ILE 1 -0.845 -3.165 0.572
11 HD11 ILE 1 HD11 ILE 1 0.766 -4.593 1.563
12 HD12 ILE 1 HD12 ILE 1 2.510 -4.569 1.302
13 HD13 ILE 1 HD13 ILE 1 1.419 -4.217 -0.035
14 H ASN 2 HN ASN 2 2.643 -0.410 1.514
15 HA ASN 2 HA ASN 2 2.643 2.425 0.801
16 HB2 ASN 2 HB2 ASN 2 3.778 2.139 3.343
17 HB3 ASN 2 HB1 ASN 2 2.123 2.600 2.976
18 HD21 ASN 2 HD21 ASN 2 0.779 0.408 2.314
19 HD22 ASN 2 HD22 ASN 2 0.963 -0.852 3.430
20 H LEU 3 HN LEU 3 4.679 3.468 2.104
21 HA LEU 3 HA LEU 3 6.880 3.103 0.371
22 HB2 LEU 3 HB2 LEU 3 6.883 4.378 3.051
23 HB3 LEU 3 HB1 LEU 3 7.975 4.733 1.722
24 HG LEU 3 HG LEU 3 4.976 5.191 1.719
25 HD11 LEU 3 HD11 LEU 3 5.615 7.583 1.775
26 HD12 LEU 3 HD12 LEU 3 7.306 7.107 1.957
27 HD13 LEU 3 HD13 LEU 3 6.137 6.720 3.224
28 HD21 LEU 3 HD21 LEU 3 7.177 5.702 -0.287
29 HD22 LEU 3 HD22 LEU 3 5.617 6.522 -0.361
30 HD23 LEU 3 HD23 LEU 3 5.697 4.768 -0.514
31 H LYS 4 HN LYS 4 6.057 1.958 3.537
32 HA LYS 4 HA LYS 4 8.439 1.019 4.522
33 HB2 LYS 4 HB2 LYS 4 5.717 -0.281 4.639
34 HB3 LYS 4 HB1 LYS 4 7.051 -0.598 5.748
35 HG2 LYS 4 HG2 LYS 4 6.414 2.255 5.453
36 HG3 LYS 4 HG1 LYS 4 5.087 1.309 6.128
37 HD2 LYS 4 HD2 LYS 4 6.555 0.436 7.875
38 HD3 LYS 4 HD1 LYS 4 7.936 1.282 7.171
39 HE2 LYS 4 HE2 LYS 4 5.443 2.778 7.982
40 HE3 LYS 4 HE1 LYS 4 6.709 2.421 9.150
41 HZ1 LYS 4 HZ1 LYS 4 6.673 4.356 7.047
42 HZ2 LYS 4 HZ2 LYS 4 8.068 3.388 7.006
43 HZ3 LYS 4 HZ3 LYS 4 7.674 4.262 8.408
44 H ALA 5 HN ALA 5 6.176 -0.630 2.337
45 HA ALA 5 HA ALA 5 7.574 -3.057 2.099
46 HB1 ALA 5 HB1 ALA 5 5.570 -1.607 0.409
47 HB2 ALA 5 HB2 ALA 5 5.450 -3.190 1.172
48 HB3 ALA 5 HB3 ALA 5 6.416 -2.987 -0.287
49 H LEU 6 HN LEU 6 7.779 -0.020 0.302
50 HA LEU 6 HA LEU 6 9.724 -0.871 -1.580
51 HB2 LEU 6 HB2 LEU 6 9.181 1.922 -0.565
52 HB3 LEU 6 HB1 LEU 6 9.922 1.475 -2.102
53 HG LEU 6 HG LEU 6 7.104 0.757 -1.269
54 HD11 LEU 6 HD11 LEU 6 7.997 3.244 -2.013
55 HD12 LEU 6 HD12 LEU 6 6.347 2.653 -2.214
56 HD13 LEU 6 HD13 LEU 6 7.489 2.553 -3.556
57 HD21 LEU 6 HD21 LEU 6 8.793 0.222 -3.701
58 HD22 LEU 6 HD22 LEU 6 7.038 0.351 -3.857
59 HD23 LEU 6 HD23 LEU 6 7.746 -0.878 -2.810
60 H ALA 7 HN ALA 7 9.785 0.680 1.562
61 HA ALA 7 HA ALA 7 12.479 1.389 1.712
62 HB1 ALA 7 HB1 ALA 7 10.324 1.409 3.463
63 HB2 ALA 7 HB2 ALA 7 11.959 1.952 3.838
64 HB3 ALA 7 HB3 ALA 7 11.466 0.304 4.229
65 H ALA 8 HN ALA 8 10.917 -1.711 2.076
66 HA ALA 8 HA ALA 8 13.023 -3.154 3.252
67 HB1 ALA 8 HB1 ALA 8 11.727 -4.984 2.875
68 HB2 ALA 8 HB2 ALA 8 11.465 -4.570 1.180
69 HB3 ALA 8 HB3 ALA 8 10.503 -3.791 2.437
70 H LEU 9 HN LEU 9 12.238 -2.402 -0.068
71 HA LEU 9 HA LEU 9 14.472 -3.780 -1.227
72 HB2 LEU 9 HB2 LEU 9 13.217 -1.488 -2.659
73 HB3 LEU 9 HB1 LEU 9 13.650 -3.089 -3.257
74 HG LEU 9 HG LEU 9 11.289 -2.451 -1.455
75 HD11 LEU 9 HD11 LEU 9 11.500 -3.177 -4.384
76 HD12 LEU 9 HD12 LEU 9 10.865 -1.681 -3.702
77 HD13 LEU 9 HD13 LEU 9 9.990 -3.194 -3.477
78 HD21 LEU 9 HD21 LEU 9 12.134 -5.051 -2.767
79 HD22 LEU 9 HD22 LEU 9 10.688 -4.806 -1.789
80 HD23 LEU 9 HD23 LEU 9 12.285 -4.688 -1.049
81 H ALA 10 HN ALA 10 13.679 -0.440 -0.427
82 HA ALA 10 HA ALA 10 16.050 0.795 -1.326
83 HB1 ALA 10 HB1 ALA 10 13.792 1.828 -0.539
84 HB2 ALA 10 HB2 ALA 10 15.289 2.710 -0.223
85 HB3 ALA 10 HB3 ALA 10 14.525 1.779 1.067
86 H LYS 11 HN LYS 11 15.257 -0.835 1.696
87 HA LYS 11 HA LYS 11 17.220 0.063 3.382
88 HB2 LYS 11 HB2 LYS 11 15.780 -2.470 3.080
89 HB3 LYS 11 HB1 LYS 11 17.234 -2.531 4.066
90 HG2 LYS 11 HG2 LYS 11 16.247 -0.407 5.223
91 HG3 LYS 11 HG1 LYS 11 14.723 -0.908 4.493
92 HD2 LYS 11 HD2 LYS 11 14.509 -2.717 5.873
93 HD3 LYS 11 HD1 LYS 11 16.246 -3.042 5.894
94 HE2 LYS 11 HE2 LYS 11 14.895 -0.746 7.349
95 HE3 LYS 11 HE1 LYS 11 15.425 -2.249 8.103
96 HZ1 LYS 11 HZ1 LYS 11 17.456 -1.425 8.262
97 HZ2 LYS 11 HZ2 LYS 11 16.927 0.034 7.578
98 HZ3 LYS 11 HZ3 LYS 11 17.535 -1.205 6.589
99 H LYS 12 HN LYS 12 17.567 -2.220 0.742
100 HA LYS 12 HA LYS 12 20.237 -2.989 1.396
101 HB2 LYS 12 HB2 LYS 12 18.513 -3.266 -1.061
102 HB3 LYS 12 HB1 LYS 12 20.213 -3.743 -1.079
103 HG2 LYS 12 HG2 LYS 12 19.118 -5.730 -0.439
104 HG3 LYS 12 HG1 LYS 12 19.648 -5.045 1.099
105 HD2 LYS 12 HD2 LYS 12 17.476 -5.274 1.731
106 HD3 LYS 12 HD1 LYS 12 17.200 -3.831 0.761
107 HE2 LYS 12 HE2 LYS 12 16.628 -5.166 -1.181
108 HE3 LYS 12 HE1 LYS 12 17.084 -6.645 -0.342
109 HZ1 LYS 12 HZ1 LYS 12 15.027 -4.896 0.829
110 HZ2 LYS 12 HZ2 LYS 12 15.234 -6.579 0.984
111 HZ3 LYS 12 HZ3 LYS 12 14.609 -5.932 -0.449
112 H ILE 13 HN ILE 13 18.776 -0.424 -0.464
113 HA ILE 13 HA ILE 13 21.290 0.466 -1.587
114 HB ILE 13 HB ILE 13 18.726 2.014 -1.546
115 HG12 ILE 13 HG12 ILE 13 18.296 -0.314 -2.355
116 HG13 ILE 13 HG11 ILE 13 18.082 0.896 -3.618
117 HG21 ILE 13 HG21 ILE 13 20.653 3.239 -2.346
118 HG22 ILE 13 HG22 ILE 13 19.642 2.829 -3.731
119 HG23 ILE 13 HG23 ILE 13 21.109 1.907 -3.409
120 HD11 ILE 13 HD11 ILE 13 20.438 0.442 -4.366
121 HD12 ILE 13 HD12 ILE 13 19.358 -0.942 -4.545
122 HD13 ILE 13 HD13 ILE 13 20.504 -0.886 -3.204
123 H LEU 14 HN LEU 14 19.041 1.384 0.948
124 HA LEU 14 HA LEU 14 20.437 3.743 1.746
125 HB2 LEU 14 HB2 LEU 14 17.974 2.658 2.303
126 HB3 LEU 14 HB1 LEU 14 18.845 2.378 3.809
127 HG LEU 14 HG LEU 14 19.534 4.815 3.756
128 HD11 LEU 14 HD12 LEU 14 17.820 4.657 1.308
129 HD12 LEU 14 HD13 LEU 14 19.270 5.620 1.606
130 HD13 LEU 14 HD11 LEU 14 17.720 6.121 2.288
131 HD21 LEU 14 HD22 LEU 14 17.727 4.156 5.215
132 HD22 LEU 14 HD23 LEU 14 16.594 4.079 3.864
133 HD23 LEU 14 HD21 LEU 14 17.225 5.633 4.396
134 HN1 NH2 15 H1 LEU 14 20.573 0.338 2.799
Start of MODEL 4
1 H1 ILE 1 HT1 ILE 1 1.434 -4.617 -0.210
2 H2 ILE 1 HT2 ILE 1 1.292 -3.026 -0.775
3 H3 ILE 1 HT3 ILE 1 -0.043 -3.800 -0.061
4 HA ILE 1 HA ILE 1 0.579 -3.275 1.979
5 HB ILE 1 HB ILE 1 2.237 -4.919 2.233
6 HG12 ILE 1 HG12 ILE 1 3.791 -2.357 2.501
7 HG13 ILE 1 HG11 ILE 1 2.622 -2.933 3.681
8 HG21 ILE 1 HG21 ILE 1 3.203 -5.118 0.088
9 HG22 ILE 1 HG22 ILE 1 4.538 -4.598 1.113
10 HG23 ILE 1 HG23 ILE 1 3.716 -3.431 0.073
11 HD11 ILE 1 HD11 ILE 1 4.487 -5.035 3.001
12 HD12 ILE 1 HD12 ILE 1 4.132 -4.330 4.578
13 HD13 ILE 1 HD13 ILE 1 5.349 -3.593 3.535
14 H ASN 2 HN ASN 2 1.696 -1.487 3.129
15 HA ASN 2 HA ASN 2 1.566 0.914 1.613
16 HB2 ASN 2 HB2 ASN 2 2.106 2.029 3.706
17 HB3 ASN 2 HB1 ASN 2 0.892 0.780 3.978
18 HD21 ASN 2 HD21 ASN 2 1.801 -1.399 4.748
19 HD22 ASN 2 HD22 ASN 2 3.172 -1.375 5.745
20 H LEU 3 HN LEU 3 3.409 2.548 2.487
21 HA LEU 3 HA LEU 3 5.543 2.278 0.750
22 HB2 LEU 3 HB2 LEU 3 5.474 3.897 3.236
23 HB3 LEU 3 HB1 LEU 3 6.428 4.230 1.801
24 HG LEU 3 HG LEU 3 3.971 4.115 0.684
25 HD11 LEU 3 HD11 LEU 3 2.312 4.167 2.201
26 HD12 LEU 3 HD12 LEU 3 2.915 5.716 2.784
27 HD13 LEU 3 HD13 LEU 3 3.477 4.217 3.525
28 HD21 LEU 3 HD21 LEU 3 5.150 6.520 2.122
29 HD22 LEU 3 HD22 LEU 3 3.948 6.590 0.833
30 HD23 LEU 3 HD23 LEU 3 5.569 5.981 0.497
31 H LYS 4 HN LYS 4 5.119 1.041 3.943
32 HA LYS 4 HA LYS 4 7.714 0.882 4.861
33 HB2 LYS 4 HB2 LYS 4 5.249 -0.637 5.330
34 HB3 LYS 4 HB1 LYS 4 6.716 -1.560 5.618
35 HG2 LYS 4 HG2 LYS 4 5.817 -0.251 7.624
36 HG3 LYS 4 HG1 LYS 4 7.516 -0.002 7.237
37 HD2 LYS 4 HD2 LYS 4 7.184 2.196 6.862
38 HD3 LYS 4 HD1 LYS 4 5.856 1.863 5.752
39 HE2 LYS 4 HE2 LYS 4 5.655 1.958 8.775
40 HE3 LYS 4 HE1 LYS 4 5.068 3.192 7.660
41 HZ1 LYS 4 HZ1 LYS 4 4.054 0.462 8.097
42 HZ2 LYS 4 HZ2 LYS 4 3.776 1.252 6.613
43 HZ3 LYS 4 HZ3 LYS 4 3.205 1.929 8.066
44 H ALA 5 HN ALA 5 6.054 -1.131 2.534
45 HA ALA 5 HA ALA 5 7.959 -3.173 2.242
46 HB1 ALA 5 HB1 ALA 5 6.769 -2.410 -0.298
47 HB2 ALA 5 HB2 ALA 5 5.563 -2.464 0.988
48 HB3 ALA 5 HB3 ALA 5 6.548 -3.888 0.639
49 H LEU 6 HN LEU 6 7.679 0.000 0.664
50 HA LEU 6 HA LEU 6 9.834 -0.236 -1.124
51 HB2 LEU 6 HB2 LEU 6 8.901 2.247 0.336
52 HB3 LEU 6 HB1 LEU 6 9.782 2.185 -1.194
53 HG LEU 6 HG LEU 6 7.042 0.963 -0.766
54 HD11 LEU 6 HD11 LEU 6 7.026 3.449 -0.584
55 HD12 LEU 6 HD12 LEU 6 6.166 2.867 -2.010
56 HD13 LEU 6 HD13 LEU 6 7.789 3.542 -2.173
57 HD21 LEU 6 HD21 LEU 6 8.938 1.222 -3.077
58 HD22 LEU 6 HD22 LEU 6 7.200 1.207 -3.382
59 HD23 LEU 6 HD23 LEU 6 7.973 -0.162 -2.581
60 H ALA 7 HN ALA 7 9.631 0.947 2.198
61 HA ALA 7 HA ALA 7 12.317 1.716 2.511
62 HB1 ALA 7 HB1 ALA 7 10.865 2.435 4.213
63 HB2 ALA 7 HB2 ALA 7 11.826 1.184 5.002
64 HB3 ALA 7 HB3 ALA 7 10.192 0.824 4.448
65 H ALA 8 HN ALA 8 10.771 -1.383 2.519
66 HA ALA 8 HA ALA 8 12.847 -2.849 3.802
67 HB1 ALA 8 HB1 ALA 8 11.247 -4.280 1.778
68 HB2 ALA 8 HB2 ALA 8 10.306 -3.473 3.033
69 HB3 ALA 8 HB3 ALA 8 11.527 -4.669 3.473
70 H LEU 9 HN LEU 9 12.023 -2.244 0.442
71 HA LEU 9 HA LEU 9 14.252 -3.662 -0.654
72 HB2 LEU 9 HB2 LEU 9 13.038 -1.467 -2.235
73 HB3 LEU 9 HB1 LEU 9 13.377 -3.132 -2.693
74 HG LEU 9 HG LEU 9 11.087 -2.220 -0.920
75 HD11 LEU 9 HD11 LEU 9 9.802 -2.147 -2.766
76 HD12 LEU 9 HD12 LEU 9 10.485 -3.642 -3.406
77 HD13 LEU 9 HD13 LEU 9 11.312 -2.109 -3.679
78 HD21 LEU 9 HD21 LEU 9 12.354 -4.668 -0.874
79 HD22 LEU 9 HD22 LEU 9 11.080 -4.938 -2.060
80 HD23 LEU 9 HD23 LEU 9 10.667 -4.400 -0.432
81 H ALA 10 HN ALA 10 13.525 -0.248 -0.076
82 HA ALA 10 HA ALA 10 15.827 0.914 -1.133
83 HB1 ALA 10 HB1 ALA 10 15.343 2.821 0.267
84 HB2 ALA 10 HB2 ALA 10 14.408 1.826 1.384
85 HB3 ALA 10 HB3 ALA 10 13.802 2.132 -0.245
86 H LYS 11 HN LYS 11 15.329 -0.670 1.974
87 HA LYS 11 HA LYS 11 17.568 0.157 3.366
88 HB2 LYS 11 HB2 LYS 11 15.656 -1.444 4.083
89 HB3 LYS 11 HB1 LYS 11 16.669 -2.724 3.415
90 HG2 LYS 11 HG2 LYS 11 17.113 -2.472 5.812
91 HG3 LYS 11 HG1 LYS 11 18.534 -1.981 4.892
92 HD2 LYS 11 HD2 LYS 11 18.239 0.262 5.388
93 HD3 LYS 11 HD1 LYS 11 16.495 0.094 5.597
94 HE2 LYS 11 HE2 LYS 11 17.690 0.442 7.761
95 HE3 LYS 11 HE1 LYS 11 16.816 -1.084 7.704
96 HZ1 LYS 11 HZ1 LYS 11 19.276 -0.995 8.512
97 HZ2 LYS 11 HZ2 LYS 11 19.626 -1.025 6.851
98 HZ3 LYS 11 HZ3 LYS 11 18.739 -2.287 7.560
99 H LYS 12 HN LYS 12 17.323 -2.173 0.773
100 HA LYS 12 HA LYS 12 20.015 -3.133 1.061
101 HB2 LYS 12 HB2 LYS 12 17.820 -3.549 -0.955
102 HB3 LYS 12 HB1 LYS 12 19.455 -4.116 -1.286
103 HG2 LYS 12 HG2 LYS 12 18.401 -5.968 -0.237
104 HG3 LYS 12 HG1 LYS 12 19.353 -5.225 1.044
105 HD2 LYS 12 HD2 LYS 12 17.399 -5.261 2.211
106 HD3 LYS 12 HD1 LYS 12 17.000 -3.839 1.254
107 HE2 LYS 12 HE2 LYS 12 15.783 -5.117 -0.343
108 HE3 LYS 12 HE1 LYS 12 16.412 -6.634 0.292
109 HZ1 LYS 12 HZ1 LYS 12 15.197 -6.354 2.286
110 HZ2 LYS 12 HZ2 LYS 12 14.117 -6.098 1.001
111 HZ3 LYS 12 HZ3 LYS 12 14.736 -4.770 1.872
112 H ILE 13 HN ILE 13 18.428 -0.583 -0.695
113 HA ILE 13 HA ILE 13 20.730 -0.132 -2.395
114 HB ILE 13 HB ILE 13 18.346 1.656 -2.177
115 HG12 ILE 13 HG12 ILE 13 17.547 -0.691 -2.468
116 HG13 ILE 13 HG11 ILE 13 17.225 0.303 -3.886
117 HG21 ILE 13 HG21 ILE 13 19.794 2.690 -3.629
118 HG22 ILE 13 HG22 ILE 13 18.985 1.618 -4.769
119 HG23 ILE 13 HG23 ILE 13 20.558 1.177 -4.111
120 HD11 ILE 13 HD11 ILE 13 18.998 -2.028 -3.590
121 HD12 ILE 13 HD12 ILE 13 19.727 -0.674 -4.453
122 HD13 ILE 13 HD13 ILE 13 18.220 -1.378 -5.032
123 H LEU 14 HN LEU 14 19.040 1.401 0.290
124 HA LEU 14 HA LEU 14 20.943 3.592 0.395
125 HB2 LEU 14 HB2 LEU 14 18.453 2.841 1.888
126 HB3 LEU 14 HB1 LEU 14 19.562 4.008 2.602
127 HG LEU 14 HG LEU 14 19.418 5.408 0.585
128 HD11 LEU 14 HD12 LEU 14 17.425 4.661 -0.985
129 HD12 LEU 14 HD13 LEU 14 17.839 3.055 -0.387
130 HD13 LEU 14 HD11 LEU 14 19.047 4.019 -1.236
131 HD21 LEU 14 HD22 LEU 14 17.278 4.839 2.405
132 HD22 LEU 14 HD23 LEU 14 16.584 5.221 0.830
133 HD23 LEU 14 HD21 LEU 14 17.664 6.367 1.618
134 HN1 NH2 15 H1 LEU 14 22.623 1.575 0.668
Start of MODEL 5
1 H1 ILE 1 HT1 ILE 1 2.270 -2.282 1.032
2 H2 ILE 1 HT2 ILE 1 3.546 -1.470 0.263
3 H3 ILE 1 HT3 ILE 1 2.639 -2.627 -0.581
4 HA ILE 1 HA ILE 1 1.591 -0.845 -1.390
5 HB ILE 1 HB ILE 1 -0.338 -0.161 0.123
6 HG12 ILE 1 HG12 ILE 1 1.381 -1.104 2.134
7 HG13 ILE 1 HG11 ILE 1 -0.305 -0.648 2.332
8 HG21 ILE 1 HG21 ILE 1 0.187 -3.129 -0.229
9 HG22 ILE 1 HG22 ILE 1 -0.464 -2.054 -1.463
10 HG23 ILE 1 HG23 ILE 1 -1.395 -2.379 -0.000
11 HD11 ILE 1 HD11 ILE 1 0.241 -2.956 3.172
12 HD12 ILE 1 HD12 ILE 1 0.589 -3.423 1.507
13 HD13 ILE 1 HD13 ILE 1 -1.038 -2.917 1.962
14 H ASN 2 HN ASN 2 2.873 -0.185 1.837
15 HA ASN 2 HA ASN 2 2.935 2.701 1.230
16 HB2 ASN 2 HB2 ASN 2 3.778 1.579 3.864
17 HB3 ASN 2 HB1 ASN 2 2.982 3.107 3.500
18 HD21 ASN 2 HD21 ASN 2 0.815 2.055 1.893
19 HD22 ASN 2 HD22 ASN 2 -0.187 1.146 2.917
20 H LEU 3 HN LEU 3 4.955 3.604 2.642
21 HA LEU 3 HA LEU 3 7.235 3.164 1.095
22 HB2 LEU 3 HB2 LEU 3 7.158 4.141 3.896
23 HB3 LEU 3 HB1 LEU 3 8.362 4.538 2.683
24 HG LEU 3 HG LEU 3 5.838 5.218 1.580
25 HD11 LEU 3 HD11 LEU 3 4.917 5.161 3.862
26 HD12 LEU 3 HD12 LEU 3 4.987 6.819 3.273
27 HD13 LEU 3 HD13 LEU 3 6.197 6.237 4.420
28 HD21 LEU 3 HD21 LEU 3 8.055 6.909 2.786
29 HD22 LEU 3 HD22 LEU 3 6.772 7.535 1.750
30 HD23 LEU 3 HD23 LEU 3 7.933 6.377 1.108
31 H LYS 4 HN LYS 4 6.020 1.637 3.957
32 HA LYS 4 HA LYS 4 8.280 0.452 4.985
33 HB2 LYS 4 HB2 LYS 4 5.399 -0.401 4.880
34 HB3 LYS 4 HB1 LYS 4 6.617 -1.383 5.694
35 HG2 LYS 4 HG2 LYS 4 6.822 0.078 7.428
36 HG3 LYS 4 HG1 LYS 4 6.712 1.490 6.379
37 HD2 LYS 4 HD2 LYS 4 4.372 1.522 6.441
38 HD3 LYS 4 HD1 LYS 4 4.260 -0.187 6.863
39 HE2 LYS 4 HE2 LYS 4 5.363 1.966 8.694
40 HE3 LYS 4 HE1 LYS 4 3.728 1.306 8.798
41 HZ1 LYS 4 HZ1 LYS 4 6.214 0.187 9.689
42 HZ2 LYS 4 HZ2 LYS 4 5.305 -0.904 8.751
43 HZ3 LYS 4 HZ3 LYS 4 4.631 -0.208 10.137
44 H ALA 5 HN ALA 5 6.089 -0.807 2.476
45 HA ALA 5 HA ALA 5 7.447 -3.247 2.057
46 HB1 ALA 5 HB1 ALA 5 5.385 -3.306 1.059
47 HB2 ALA 5 HB2 ALA 5 6.358 -2.875 -0.347
48 HB3 ALA 5 HB3 ALA 5 5.470 -1.625 0.529
49 H LEU 6 HN LEU 6 7.697 -0.092 0.495
50 HA LEU 6 HA LEU 6 9.679 -0.797 -1.407
51 HB2 LEU 6 HB2 LEU 6 9.002 1.893 -0.201
52 HB3 LEU 6 HB1 LEU 6 9.912 1.614 -1.691
53 HG LEU 6 HG LEU 6 7.126 0.513 -1.295
54 HD11 LEU 6 HD11 LEU 6 6.455 2.511 -2.740
55 HD12 LEU 6 HD12 LEU 6 8.003 3.225 -2.286
56 HD13 LEU 6 HD13 LEU 6 6.801 2.854 -1.045
57 HD21 LEU 6 HD21 LEU 6 9.066 0.870 -3.555
58 HD22 LEU 6 HD22 LEU 6 7.336 0.870 -3.897
59 HD23 LEU 6 HD23 LEU 6 8.084 -0.535 -3.139
60 H ALA 7 HN ALA 7 9.745 0.699 1.784
61 HA ALA 7 HA ALA 7 12.463 1.310 1.954
62 HB1 ALA 7 HB1 ALA 7 10.911 2.092 3.638
63 HB2 ALA 7 HB2 ALA 7 12.158 1.123 4.422
64 HB3 ALA 7 HB3 ALA 7 10.559 0.436 4.133
65 H ALA 8 HN ALA 8 10.795 -1.731 2.354
66 HA ALA 8 HA ALA 8 12.849 -3.207 3.588
67 HB1 ALA 8 HB1 ALA 8 11.051 -4.386 1.477
68 HB2 ALA 8 HB2 ALA 8 10.413 -3.933 3.059
69 HB3 ALA 8 HB3 ALA 8 11.680 -5.151 2.936
70 H LEU 9 HN LEU 9 12.096 -2.643 0.194
71 HA LEU 9 HA LEU 9 14.401 -4.032 -0.803
72 HB2 LEU 9 HB2 LEU 9 12.998 -1.943 -2.422
73 HB3 LEU 9 HB1 LEU 9 13.590 -3.531 -2.910
74 HG LEU 9 HG LEU 9 11.150 -3.005 -1.171
75 HD11 LEU 9 HD11 LEU 9 11.279 -4.206 -3.945
76 HD12 LEU 9 HD12 LEU 9 11.003 -2.488 -3.660
77 HD13 LEU 9 HD13 LEU 9 9.849 -3.679 -3.057
78 HD21 LEU 9 HD21 LEU 9 12.192 -5.628 -2.308
79 HD22 LEU 9 HD22 LEU 9 10.789 -5.410 -1.264
80 HD23 LEU 9 HD23 LEU 9 12.406 -5.116 -0.633
81 H ALA 10 HN ALA 10 13.440 -0.675 -0.403
82 HA ALA 10 HA ALA 10 15.734 0.566 -1.431
83 HB1 ALA 10 HB1 ALA 10 13.378 1.510 -0.637
84 HB2 ALA 10 HB2 ALA 10 14.807 2.544 -0.669
85 HB3 ALA 10 HB3 ALA 10 14.269 1.831 0.850
86 H LYS 11 HN LYS 11 15.059 -0.684 1.815
87 HA LYS 11 HA LYS 11 17.015 0.538 3.295
88 HB2 LYS 11 HB2 LYS 11 15.490 -1.884 3.508
89 HB3 LYS 11 HB1 LYS 11 17.116 -2.134 4.131
90 HG2 LYS 11 HG2 LYS 11 16.806 0.031 5.445
91 HG3 LYS 11 HG1 LYS 11 15.103 -0.036 4.995
92 HD2 LYS 11 HD2 LYS 11 14.764 -1.390 6.771
93 HD3 LYS 11 HD1 LYS 11 15.726 -2.623 5.953
94 HE2 LYS 11 HE2 LYS 11 17.168 -0.430 7.407
95 HE3 LYS 11 HE1 LYS 11 16.419 -1.711 8.359
96 HZ1 LYS 11 HZ1 LYS 11 18.731 -2.190 7.740
97 HZ2 LYS 11 HZ2 LYS 11 18.297 -2.165 6.101
98 HZ3 LYS 11 HZ3 LYS 11 17.651 -3.351 7.139
99 H LYS 12 HN LYS 12 17.402 -2.176 1.100
100 HA LYS 12 HA LYS 12 20.129 -2.640 1.746
101 HB2 LYS 12 HB2 LYS 12 18.422 -3.435 -0.607
102 HB3 LYS 12 HB1 LYS 12 20.112 -3.915 -0.439
103 HG2 LYS 12 HG2 LYS 12 19.085 -5.707 0.607
104 HG3 LYS 12 HG1 LYS 12 19.321 -4.635 1.985
105 HD2 LYS 12 HD2 LYS 12 17.094 -4.849 2.324
106 HD3 LYS 12 HD1 LYS 12 16.920 -3.754 0.954
107 HE2 LYS 12 HE2 LYS 12 16.793 -5.622 -0.597
108 HE3 LYS 12 HE1 LYS 12 17.105 -6.763 0.708
109 HZ1 LYS 12 HZ1 LYS 12 14.993 -6.674 1.398
110 HZ2 LYS 12 HZ2 LYS 12 14.658 -6.007 -0.132
111 HZ3 LYS 12 HZ3 LYS 12 14.888 -4.988 1.214
112 H ILE 13 HN ILE 13 18.462 -0.651 -0.618
113 HA ILE 13 HA ILE 13 20.831 0.098 -2.043
114 HB ILE 13 HB ILE 13 18.263 1.632 -2.040
115 HG12 ILE 13 HG12 ILE 13 17.736 -0.791 -2.264
116 HG13 ILE 13 HG11 ILE 13 17.410 0.097 -3.751
117 HG21 ILE 13 HG21 ILE 13 20.336 1.036 -4.165
118 HG22 ILE 13 HG22 ILE 13 20.167 2.559 -3.295
119 HG23 ILE 13 HG23 ILE 13 18.897 2.028 -4.394
120 HD11 ILE 13 HD11 ILE 13 18.570 -1.852 -4.446
121 HD12 ILE 13 HD12 ILE 13 19.747 -1.717 -3.142
122 HD13 ILE 13 HD13 ILE 13 19.780 -0.574 -4.482
123 H LEU 14 HN LEU 14 18.814 1.484 0.485
124 HA LEU 14 HA LEU 14 20.327 3.925 0.658
125 HB2 LEU 14 HB2 LEU 14 18.063 2.651 2.132
126 HB3 LEU 14 HB1 LEU 14 18.991 3.896 2.971
127 HG LEU 14 HG LEU 14 18.636 5.427 1.034
128 HD11 LEU 14 HD12 LEU 14 17.005 3.084 0.028
129 HD12 LEU 14 HD13 LEU 14 18.319 3.931 -0.791
130 HD13 LEU 14 HD11 LEU 14 16.759 4.729 -0.558
131 HD21 LEU 14 HD22 LEU 14 15.992 5.434 1.363
132 HD22 LEU 14 HD23 LEU 14 17.076 5.909 2.668
133 HD23 LEU 14 HD21 LEU 14 16.384 4.288 2.644
134 HN1 NH2 15 H1 LEU 14 20.221 0.887 2.584
Start of MODEL 6
1 H1 ILE 1 HT1 ILE 1 4.405 -1.939 -2.224
2 H2 ILE 1 HT2 ILE 1 3.802 -3.513 -2.005
3 H3 ILE 1 HT3 ILE 1 4.158 -2.549 -0.663
4 HA ILE 1 HA ILE 1 2.090 -1.899 -2.681
5 HB ILE 1 HB ILE 1 0.481 -2.525 -0.855
6 HG12 ILE 1 HG12 ILE 1 3.035 -3.384 0.436
7 HG13 ILE 1 HG11 ILE 1 1.706 -2.472 1.134
8 HG21 ILE 1 HG21 ILE 1 0.346 -4.684 -1.605
9 HG22 ILE 1 HG22 ILE 1 2.066 -4.985 -1.367
10 HG23 ILE 1 HG23 ILE 1 1.517 -4.074 -2.773
11 HD11 ILE 1 HD11 ILE 1 0.333 -4.663 0.629
12 HD12 ILE 1 HD12 ILE 1 1.346 -4.577 2.069
13 HD13 ILE 1 HD13 ILE 1 1.924 -5.421 0.633
14 H ASN 2 HN ASN 2 3.284 -1.364 0.662
15 HA ASN 2 HA ASN 2 2.243 1.397 0.512
16 HB2 ASN 2 HB2 ASN 2 3.086 -0.163 2.963
17 HB3 ASN 2 HB1 ASN 2 2.273 1.394 2.931
18 HD21 ASN 2 HD21 ASN 2 0.542 0.384 0.573
19 HD22 ASN 2 HD22 ASN 2 -0.615 -0.608 1.324
20 H LEU 3 HN LEU 3 3.667 2.657 2.379
21 HA LEU 3 HA LEU 3 6.087 3.273 1.075
22 HB2 LEU 3 HB2 LEU 3 5.054 3.967 3.783
23 HB3 LEU 3 HB1 LEU 3 6.541 4.626 3.131
24 HG LEU 3 HG LEU 3 5.092 5.350 1.106
25 HD11 LEU 3 HD11 LEU 3 3.026 4.321 1.330
26 HD12 LEU 3 HD12 LEU 3 2.684 5.851 2.137
27 HD13 LEU 3 HD13 LEU 3 3.052 4.416 3.092
28 HD21 LEU 3 HD21 LEU 3 4.139 6.857 3.482
29 HD22 LEU 3 HD22 LEU 3 5.004 7.434 2.056
30 HD23 LEU 3 HD23 LEU 3 5.888 6.654 3.365
31 H LYS 4 HN LYS 4 5.219 1.221 3.753
32 HA LYS 4 HA LYS 4 7.686 0.744 4.905
33 HB2 LYS 4 HB2 LYS 4 5.340 -1.096 4.456
34 HB3 LYS 4 HB1 LYS 4 6.663 -1.426 5.569
35 HG2 LYS 4 HG2 LYS 4 4.580 0.754 5.716
36 HG3 LYS 4 HG1 LYS 4 4.957 -0.473 6.922
37 HD2 LYS 4 HD2 LYS 4 7.220 0.588 7.212
38 HD3 LYS 4 HD1 LYS 4 6.704 1.880 6.129
39 HE2 LYS 4 HE2 LYS 4 4.805 2.382 7.658
40 HE3 LYS 4 HE1 LYS 4 5.393 1.140 8.763
41 HZ1 LYS 4 HZ1 LYS 4 6.145 3.377 9.353
42 HZ2 LYS 4 HZ2 LYS 4 6.971 3.492 7.875
43 HZ3 LYS 4 HZ3 LYS 4 7.441 2.335 9.031
44 H ALA 5 HN ALA 5 6.122 -0.843 2.161
45 HA ALA 5 HA ALA 5 8.073 -2.794 1.661
46 HB1 ALA 5 HB1 ALA 5 6.366 -3.276 0.261
47 HB2 ALA 5 HB2 ALA 5 7.149 -2.157 -0.855
48 HB3 ALA 5 HB3 ALA 5 5.835 -1.597 0.180
49 H LEU 6 HN LEU 6 7.772 0.546 0.471
50 HA LEU 6 HA LEU 6 9.977 0.564 -1.257
51 HB2 LEU 6 HB2 LEU 6 9.008 2.853 0.466
52 HB3 LEU 6 HB1 LEU 6 9.840 2.960 -1.086
53 HG LEU 6 HG LEU 6 7.053 1.898 -0.573
54 HD11 LEU 6 HD11 LEU 6 6.749 3.739 -2.477
55 HD12 LEU 6 HD12 LEU 6 8.245 4.366 -1.789
56 HD13 LEU 6 HD13 LEU 6 6.810 4.198 -0.778
57 HD21 LEU 6 HD21 LEU 6 7.866 0.454 -2.253
58 HD22 LEU 6 HD22 LEU 6 8.864 1.715 -2.982
59 HD23 LEU 6 HD23 LEU 6 7.111 1.756 -3.171
60 H ALA 7 HN ALA 7 9.667 1.312 2.186
61 HA ALA 7 HA ALA 7 12.321 2.075 2.668
62 HB1 ALA 7 HB1 ALA 7 10.791 2.481 4.415
63 HB2 ALA 7 HB2 ALA 7 11.835 1.205 5.036
64 HB3 ALA 7 HB3 ALA 7 10.226 0.812 4.429
65 H ALA 8 HN ALA 8 10.796 -1.054 2.430
66 HA ALA 8 HA ALA 8 12.903 -2.627 3.426
67 HB1 ALA 8 HB1 ALA 8 11.665 -4.426 2.750
68 HB2 ALA 8 HB2 ALA 8 11.298 -3.707 1.184
69 HB3 ALA 8 HB3 ALA 8 10.404 -3.197 2.614
70 H LEU 9 HN LEU 9 12.161 -1.509 0.182
71 HA LEU 9 HA LEU 9 14.326 -2.791 -1.131
72 HB2 LEU 9 HB2 LEU 9 13.377 -0.168 -2.174
73 HB3 LEU 9 HB1 LEU 9 13.631 -1.689 -3.028
74 HG LEU 9 HG LEU 9 11.317 -1.078 -1.160
75 HD11 LEU 9 HD11 LEU 9 11.540 -1.250 -4.175
76 HD12 LEU 9 HD12 LEU 9 11.037 0.143 -3.215
77 HD13 LEU 9 HD13 LEU 9 10.003 -1.281 -3.314
78 HD21 LEU 9 HD21 LEU 9 11.663 -3.403 -1.009
79 HD22 LEU 9 HD22 LEU 9 12.163 -3.527 -2.697
80 HD23 LEU 9 HD23 LEU 9 10.468 -3.250 -2.296
81 H ALA 10 HN ALA 10 13.872 0.429 0.234
82 HA ALA 10 HA ALA 10 16.283 1.606 -0.493
83 HB1 ALA 10 HB1 ALA 10 14.488 2.861 0.594
84 HB2 ALA 10 HB2 ALA 10 15.991 3.048 1.499
85 HB3 ALA 10 HB3 ALA 10 14.736 1.956 2.087
86 H LYS 11 HN LYS 11 15.587 -0.530 2.247
87 HA LYS 11 HA LYS 11 17.984 -0.302 3.638
88 HB2 LYS 11 HB2 LYS 11 15.753 -1.991 3.757
89 HB3 LYS 11 HB1 LYS 11 17.120 -3.077 3.495
90 HG2 LYS 11 HG2 LYS 11 18.325 -1.937 5.380
91 HG3 LYS 11 HG1 LYS 11 16.868 -0.985 5.687
92 HD2 LYS 11 HD2 LYS 11 16.061 -2.671 6.942
93 HD3 LYS 11 HD1 LYS 11 16.068 -3.716 5.519
94 HE2 LYS 11 HE2 LYS 11 18.422 -3.253 7.381
95 HE3 LYS 11 HE1 LYS 11 17.418 -4.702 7.329
96 HZ1 LYS 11 HZ1 LYS 11 19.069 -5.351 5.943
97 HZ2 LYS 11 HZ2 LYS 11 19.439 -3.775 5.442
98 HZ3 LYS 11 HZ3 LYS 11 18.087 -4.572 4.792
99 H LYS 12 HN LYS 12 17.206 -2.271 0.810
100 HA LYS 12 HA LYS 12 19.780 -3.522 0.712
101 HB2 LYS 12 HB2 LYS 12 17.419 -3.388 -1.158
102 HB3 LYS 12 HB1 LYS 12 18.939 -4.132 -1.662
103 HG2 LYS 12 HG2 LYS 12 17.749 -5.948 -0.764
104 HG3 LYS 12 HG1 LYS 12 18.771 -5.449 0.585
105 HD2 LYS 12 HD2 LYS 12 16.804 -5.403 1.748
106 HD3 LYS 12 HD1 LYS 12 16.597 -3.840 0.970
107 HE2 LYS 12 HE2 LYS 12 14.603 -4.851 0.378
108 HE3 LYS 12 HE1 LYS 12 15.610 -5.286 -1.001
109 HZ1 LYS 12 HZ1 LYS 12 15.102 -6.971 1.391
110 HZ2 LYS 12 HZ2 LYS 12 16.124 -7.384 0.107
111 HZ3 LYS 12 HZ3 LYS 12 14.454 -7.214 -0.155
112 H ILE 13 HN ILE 13 18.280 -0.711 -0.741
113 HA ILE 13 HA ILE 13 20.360 -0.171 -2.607
114 HB ILE 13 HB ILE 13 18.372 1.746 -1.421
115 HG12 ILE 13 HG12 ILE 13 17.419 -0.399 -2.464
116 HG13 ILE 13 HG11 ILE 13 16.834 1.126 -3.127
117 HG21 ILE 13 HG21 ILE 13 20.379 2.609 -2.767
118 HG22 ILE 13 HG22 ILE 13 18.780 3.109 -3.319
119 HG23 ILE 13 HG23 ILE 13 19.638 1.819 -4.157
120 HD11 ILE 13 HD11 ILE 13 19.251 -0.156 -4.356
121 HD12 ILE 13 HD12 ILE 13 18.040 0.887 -5.099
122 HD13 ILE 13 HD13 ILE 13 17.654 -0.795 -4.740
123 H LEU 14 HN LEU 14 19.617 0.813 0.677
124 HA LEU 14 HA LEU 14 21.937 2.562 0.841
125 HB2 LEU 14 HB2 LEU 14 19.527 2.067 2.406
126 HB3 LEU 14 HB1 LEU 14 20.963 2.116 3.424
127 HG LEU 14 HG LEU 14 21.600 4.264 2.185
128 HD11 LEU 14 HD12 LEU 14 20.222 4.204 0.256
129 HD12 LEU 14 HD13 LEU 14 19.494 5.444 1.277
130 HD13 LEU 14 HD11 LEU 14 18.778 3.836 1.198
131 HD21 LEU 14 HD22 LEU 14 19.808 5.594 3.473
132 HD22 LEU 14 HD23 LEU 14 20.837 4.512 4.410
133 HD23 LEU 14 HD21 LEU 14 19.193 4.025 3.989
134 HN1 NH2 15 H1 LEU 14 21.332 -0.809 1.292
Start of MODEL 7
1 H1 ILE 1 HT1 ILE 1 1.484 -2.051 -2.206
2 H2 ILE 1 HT2 ILE 1 2.894 -2.217 -1.275
3 H3 ILE 1 HT3 ILE 1 2.610 -0.790 -2.141
4 HA ILE 1 HA ILE 1 0.436 -0.779 -0.696
5 HB ILE 1 HB ILE 1 1.090 -1.503 1.624
6 HG12 ILE 1 HG12 ILE 1 3.634 -1.643 0.808
7 HG13 ILE 1 HG11 ILE 1 3.026 -2.705 2.078
8 HG21 ILE 1 HG21 ILE 1 -0.402 -2.879 0.261
9 HG22 ILE 1 HG22 ILE 1 0.665 -3.914 1.208
10 HG23 ILE 1 HG23 ILE 1 0.980 -3.663 -0.508
11 HD11 ILE 1 HD11 ILE 1 4.236 -3.525 -0.306
12 HD12 ILE 1 HD12 ILE 1 2.519 -3.831 -0.559
13 HD13 ILE 1 HD13 ILE 1 3.343 -4.545 0.820
14 H ASN 2 HN ASN 2 2.164 -0.182 1.891
15 HA ASN 2 HA ASN 2 2.637 2.574 1.167
16 HB2 ASN 2 HB2 ASN 2 3.644 2.351 3.688
17 HB3 ASN 2 HB1 ASN 2 1.958 2.689 3.303
18 HD21 ASN 2 HD21 ASN 2 0.515 0.663 3.104
19 HD22 ASN 2 HD22 ASN 2 0.873 -0.642 4.128
20 H LEU 3 HN LEU 3 4.691 3.472 2.473
21 HA LEU 3 HA LEU 3 6.902 2.886 0.829
22 HB2 LEU 3 HB2 LEU 3 6.926 4.275 3.456
23 HB3 LEU 3 HB1 LEU 3 8.078 4.484 2.147
24 HG LEU 3 HG LEU 3 5.712 5.035 0.876
25 HD11 LEU 3 HD11 LEU 3 4.889 4.943 3.486
26 HD12 LEU 3 HD12 LEU 3 4.105 5.911 2.240
27 HD13 LEU 3 HD13 LEU 3 5.289 6.651 3.319
28 HD21 LEU 3 HD21 LEU 3 7.814 6.386 0.868
29 HD22 LEU 3 HD22 LEU 3 7.367 7.045 2.442
30 HD23 LEU 3 HD23 LEU 3 6.372 7.387 1.025
31 H LYS 4 HN LYS 4 5.813 1.649 3.866
32 HA LYS 4 HA LYS 4 8.164 0.727 4.988
33 HB2 LYS 4 HB2 LYS 4 5.331 -0.182 5.076
34 HB3 LYS 4 HB1 LYS 4 6.566 -1.249 5.733
35 HG2 LYS 4 HG2 LYS 4 6.460 -0.029 7.630
36 HG3 LYS 4 HG1 LYS 4 7.254 1.264 6.735
37 HD2 LYS 4 HD2 LYS 4 5.363 2.388 7.428
38 HD3 LYS 4 HD1 LYS 4 4.780 1.744 5.894
39 HE2 LYS 4 HE2 LYS 4 4.388 0.431 8.604
40 HE3 LYS 4 HE1 LYS 4 3.158 1.353 7.740
41 HZ1 LYS 4 HZ1 LYS 4 4.466 -1.149 6.799
42 HZ2 LYS 4 HZ2 LYS 4 3.351 -0.233 5.889
43 HZ3 LYS 4 HZ3 LYS 4 2.868 -0.988 7.331
44 H ALA 5 HN ALA 5 6.096 -0.869 2.582
45 HA ALA 5 HA ALA 5 7.718 -3.199 2.387
46 HB1 ALA 5 HB1 ALA 5 5.423 -3.279 1.628
47 HB2 ALA 5 HB2 ALA 5 6.484 -3.591 0.254
48 HB3 ALA 5 HB3 ALA 5 5.733 -2.008 0.447
49 H LEU 6 HN LEU 6 7.612 -0.129 0.661
50 HA LEU 6 HA LEU 6 9.496 -0.782 -1.348
51 HB2 LEU 6 HB2 LEU 6 8.872 1.934 -0.176
52 HB3 LEU 6 HB1 LEU 6 9.525 1.595 -1.779
53 HG LEU 6 HG LEU 6 6.809 0.676 -0.792
54 HD11 LEU 6 HD11 LEU 6 6.499 2.459 -2.912
55 HD12 LEU 6 HD12 LEU 6 7.740 3.202 -1.901
56 HD13 LEU 6 HD13 LEU 6 6.166 2.786 -1.216
57 HD21 LEU 6 HD21 LEU 6 7.599 -0.826 -2.488
58 HD22 LEU 6 HD22 LEU 6 8.254 0.500 -3.452
59 HD23 LEU 6 HD23 LEU 6 6.508 0.292 -3.307
60 H ALA 7 HN ALA 7 9.684 0.784 1.798
61 HA ALA 7 HA ALA 7 12.386 1.490 1.798
62 HB1 ALA 7 HB1 ALA 7 10.889 0.531 4.235
63 HB2 ALA 7 HB2 ALA 7 10.612 2.118 3.514
64 HB3 ALA 7 HB3 ALA 7 12.203 1.708 4.161
65 H ALA 8 HN ALA 8 10.822 -1.567 2.367
66 HA ALA 8 HA ALA 8 12.914 -2.964 3.604
67 HB1 ALA 8 HB1 ALA 8 11.845 -4.994 2.802
68 HB2 ALA 8 HB2 ALA 8 10.939 -4.075 1.597
69 HB3 ALA 8 HB3 ALA 8 10.602 -3.854 3.316
70 H LEU 9 HN LEU 9 12.168 -2.430 0.222
71 HA LEU 9 HA LEU 9 14.450 -3.858 -0.780
72 HB2 LEU 9 HB2 LEU 9 13.178 -1.685 -2.383
73 HB3 LEU 9 HB1 LEU 9 13.685 -3.301 -2.879
74 HG LEU 9 HG LEU 9 11.246 -2.657 -1.165
75 HD11 LEU 9 HD11 LEU 9 11.525 -3.576 -4.045
76 HD12 LEU 9 HD12 LEU 9 10.902 -2.019 -3.496
77 HD13 LEU 9 HD13 LEU 9 10.004 -3.498 -3.157
78 HD21 LEU 9 HD21 LEU 9 12.031 -5.304 -2.406
79 HD22 LEU 9 HD22 LEU 9 10.786 -5.004 -1.195
80 HD23 LEU 9 HD23 LEU 9 12.488 -4.869 -0.757
81 H ALA 10 HN ALA 10 13.578 -0.493 -0.253
82 HA ALA 10 HA ALA 10 15.891 0.751 -1.200
83 HB1 ALA 10 HB1 ALA 10 14.838 2.028 1.203
84 HB2 ALA 10 HB2 ALA 10 13.566 1.581 0.065
85 HB3 ALA 10 HB3 ALA 10 14.888 2.623 -0.456
86 H LYS 11 HN LYS 11 15.284 -0.776 1.933
87 HA LYS 11 HA LYS 11 17.394 0.182 3.419
88 HB2 LYS 11 HB2 LYS 11 16.288 -2.581 3.310
89 HB3 LYS 11 HB1 LYS 11 17.401 -2.036 4.551
90 HG2 LYS 11 HG2 LYS 11 15.290 -0.111 4.342
91 HG3 LYS 11 HG1 LYS 11 14.562 -1.709 4.458
92 HD2 LYS 11 HD2 LYS 11 15.503 -2.135 6.546
93 HD3 LYS 11 HD1 LYS 11 16.813 -0.975 6.302
94 HE2 LYS 11 HE2 LYS 11 13.968 -0.017 6.363
95 HE3 LYS 11 HE1 LYS 11 14.820 -0.336 7.874
96 HZ1 LYS 11 HZ1 LYS 11 16.378 1.160 5.988
97 HZ2 LYS 11 HZ2 LYS 11 16.071 1.466 7.627
98 HZ3 LYS 11 HZ3 LYS 11 14.957 1.959 6.443
99 H LYS 12 HN LYS 12 17.443 -2.169 0.831
100 HA LYS 12 HA LYS 12 20.185 -2.939 1.269
101 HB2 LYS 12 HB2 LYS 12 18.126 -3.525 -0.848
102 HB3 LYS 12 HB1 LYS 12 19.812 -3.983 -1.078
103 HG2 LYS 12 HG2 LYS 12 18.829 -5.887 -0.065
104 HG3 LYS 12 HG1 LYS 12 19.653 -5.063 1.257
105 HD2 LYS 12 HD2 LYS 12 17.652 -5.194 2.320
106 HD3 LYS 12 HD1 LYS 12 17.188 -3.840 1.299
107 HE2 LYS 12 HE2 LYS 12 16.169 -5.268 -0.310
108 HE3 LYS 12 HE1 LYS 12 16.866 -6.709 0.425
109 HZ1 LYS 12 HZ1 LYS 12 15.531 -6.358 2.375
110 HZ2 LYS 12 HZ2 LYS 12 14.524 -6.386 1.004
111 HZ3 LYS 12 HZ3 LYS 12 14.911 -4.905 1.754
112 H ILE 13 HN ILE 13 18.495 -0.490 -0.477
113 HA ILE 13 HA ILE 13 20.792 0.186 -2.129
114 HB ILE 13 HB ILE 13 18.197 1.671 -1.911
115 HG12 ILE 13 HG12 ILE 13 17.920 -0.795 -2.497
116 HG13 ILE 13 HG11 ILE 13 17.333 0.331 -3.716
117 HG21 ILE 13 HG21 ILE 13 18.788 2.463 -4.159
118 HG22 ILE 13 HG22 ILE 13 20.253 1.481 -4.129
119 HG23 ILE 13 HG23 ILE 13 20.082 2.839 -3.018
120 HD11 ILE 13 HD11 ILE 13 19.283 0.015 -5.076
121 HD12 ILE 13 HD12 ILE 13 18.736 -1.596 -4.610
122 HD13 ILE 13 HD13 ILE 13 20.115 -0.865 -3.793
123 H LEU 14 HN LEU 14 18.938 1.413 0.578
124 HA LEU 14 HA LEU 14 20.317 3.884 0.862
125 HB2 LEU 14 HB2 LEU 14 18.396 2.285 2.477
126 HB3 LEU 14 HB1 LEU 14 19.398 3.434 3.359
127 HG LEU 14 HG LEU 14 18.663 5.253 1.904
128 HD11 LEU 14 HD12 LEU 14 18.351 4.162 -0.206
129 HD12 LEU 14 HD13 LEU 14 16.754 4.726 0.283
130 HD13 LEU 14 HD11 LEU 14 17.186 3.028 0.473
131 HD21 LEU 14 HD22 LEU 14 16.726 3.554 3.381
132 HD22 LEU 14 HD23 LEU 14 16.033 4.790 2.331
133 HD23 LEU 14 HD21 LEU 14 17.149 5.248 3.618
134 HN1 NH2 15 H1 LEU 14 22.402 2.117 0.474
Start of MODEL 8
1 H1 ILE 1 HT1 ILE 1 3.594 -2.295 -2.231
2 H2 ILE 1 HT2 ILE 1 3.281 -2.759 -0.632
3 H3 ILE 1 HT3 ILE 1 4.246 -1.401 -0.952
4 HA ILE 1 HA ILE 1 1.847 -0.974 -2.267
5 HB ILE 1 HB ILE 1 0.443 -0.946 -0.032
6 HG12 ILE 1 HG12 ILE 1 2.735 -2.083 0.983
7 HG13 ILE 1 HG11 ILE 1 1.135 -2.259 1.699
8 HG21 ILE 1 HG21 ILE 1 0.983 -3.410 -1.704
9 HG22 ILE 1 HG22 ILE 1 -0.239 -2.174 -2.000
10 HG23 ILE 1 HG23 ILE 1 -0.389 -3.248 -0.609
11 HD11 ILE 1 HD11 ILE 1 0.794 -4.381 0.696
12 HD12 ILE 1 HD12 ILE 1 2.467 -4.419 1.261
13 HD13 ILE 1 HD13 ILE 1 2.120 -4.146 -0.444
14 H ASN 2 HN ASN 2 3.205 -0.488 1.017
15 HA ASN 2 HA ASN 2 2.997 2.419 0.579
16 HB2 ASN 2 HB2 ASN 2 3.770 1.308 3.224
17 HB3 ASN 2 HB1 ASN 2 2.771 2.698 2.830
18 HD21 ASN 2 HD21 ASN 2 0.719 1.732 1.333
19 HD22 ASN 2 HD22 ASN 2 -0.111 0.488 2.136
20 H LEU 3 HN LEU 3 4.776 3.425 2.250
21 HA LEU 3 HA LEU 3 7.204 3.350 0.853
22 HB2 LEU 3 HB2 LEU 3 6.699 4.222 3.653
23 HB3 LEU 3 HB1 LEU 3 8.069 4.704 2.665
24 HG LEU 3 HG LEU 3 5.347 5.170 1.548
25 HD11 LEU 3 HD11 LEU 3 4.628 6.618 3.104
26 HD12 LEU 3 HD12 LEU 3 6.185 7.443 3.140
27 HD13 LEU 3 HD13 LEU 3 5.911 6.034 4.164
28 HD21 LEU 3 HD21 LEU 3 7.947 6.723 1.624
29 HD22 LEU 3 HD22 LEU 3 6.499 7.237 0.762
30 HD23 LEU 3 HD23 LEU 3 7.338 5.765 0.274
31 H LYS 4 HN LYS 4 6.088 1.848 3.807
32 HA LYS 4 HA LYS 4 8.429 0.731 4.730
33 HB2 LYS 4 HB2 LYS 4 5.552 -0.105 4.865
34 HB3 LYS 4 HB1 LYS 4 6.803 -1.113 5.591
35 HG2 LYS 4 HG2 LYS 4 6.727 1.840 6.181
36 HG3 LYS 4 HG1 LYS 4 5.645 0.745 7.040
37 HD2 LYS 4 HD2 LYS 4 7.317 0.125 8.398
38 HD3 LYS 4 HD1 LYS 4 8.273 -0.412 7.017
39 HE2 LYS 4 HE2 LYS 4 9.325 1.700 6.781
40 HE3 LYS 4 HE1 LYS 4 8.109 2.514 7.768
41 HZ1 LYS 4 HZ1 LYS 4 8.904 1.146 9.665
42 HZ2 LYS 4 HZ2 LYS 4 10.064 2.227 9.070
43 HZ3 LYS 4 HZ3 LYS 4 10.163 0.576 8.688
44 H ALA 5 HN ALA 5 6.118 -0.591 2.378
45 HA ALA 5 HA ALA 5 7.393 -3.058 1.958
46 HB1 ALA 5 HB1 ALA 5 5.916 -3.347 0.223
47 HB2 ALA 5 HB2 ALA 5 6.122 -1.700 -0.369
48 HB3 ALA 5 HB3 ALA 5 5.107 -2.010 1.039
49 H LEU 6 HN LEU 6 7.801 0.086 0.401
50 HA LEU 6 HA LEU 6 9.793 -0.732 -1.453
51 HB2 LEU 6 HB2 LEU 6 9.267 2.015 -0.310
52 HB3 LEU 6 HB1 LEU 6 10.092 1.642 -1.824
53 HG LEU 6 HG LEU 6 7.225 0.884 -1.226
54 HD11 LEU 6 HD11 LEU 6 6.599 2.753 -2.677
55 HD12 LEU 6 HD12 LEU 6 8.297 3.167 -2.915
56 HD13 LEU 6 HD13 LEU 6 7.557 3.353 -1.325
57 HD21 LEU 6 HD21 LEU 6 9.033 0.715 -3.641
58 HD22 LEU 6 HD22 LEU 6 7.277 0.704 -3.803
59 HD23 LEU 6 HD23 LEU 6 8.084 -0.569 -2.890
60 H ALA 7 HN ALA 7 9.786 0.661 1.758
61 HA ALA 7 HA ALA 7 12.473 1.305 2.045
62 HB1 ALA 7 HB1 ALA 7 10.816 1.924 3.728
63 HB2 ALA 7 HB2 ALA 7 12.119 1.003 4.484
64 HB3 ALA 7 HB3 ALA 7 10.574 0.228 4.138
65 H ALA 8 HN ALA 8 10.869 -1.786 2.218
66 HA ALA 8 HA ALA 8 12.920 -3.297 3.398
67 HB1 ALA 8 HB1 ALA 8 10.694 -4.244 3.060
68 HB2 ALA 8 HB2 ALA 8 11.897 -5.233 2.229
69 HB3 ALA 8 HB3 ALA 8 10.893 -4.118 1.311
70 H LEU 9 HN LEU 9 12.222 -2.546 0.044
71 HA LEU 9 HA LEU 9 14.534 -3.858 -1.028
72 HB2 LEU 9 HB2 LEU 9 13.209 -1.624 -2.503
73 HB3 LEU 9 HB1 LEU 9 13.765 -3.189 -3.096
74 HG LEU 9 HG LEU 9 11.309 -2.737 -1.358
75 HD11 LEU 9 HD11 LEU 9 10.132 -3.562 -3.438
76 HD12 LEU 9 HD12 LEU 9 11.658 -3.361 -4.294
77 HD13 LEU 9 HD13 LEU 9 10.858 -1.961 -3.582
78 HD21 LEU 9 HD21 LEU 9 11.996 -5.287 -2.786
79 HD22 LEU 9 HD22 LEU 9 10.977 -5.043 -1.363
80 HD23 LEU 9 HD23 LEU 9 12.732 -4.948 -1.218
81 H ALA 10 HN ALA 10 13.603 -0.522 -0.368
82 HA ALA 10 HA ALA 10 15.956 0.742 -1.229
83 HB1 ALA 10 HB1 ALA 10 14.498 2.407 -0.791
84 HB2 ALA 10 HB2 ALA 10 15.102 2.309 0.866
85 HB3 ALA 10 HB3 ALA 10 13.628 1.451 0.410
86 H LYS 11 HN LYS 11 15.156 -0.844 1.816
87 HA LYS 11 HA LYS 11 17.130 0.094 3.482
88 HB2 LYS 11 HB2 LYS 11 15.456 -2.237 3.350
89 HB3 LYS 11 HB1 LYS 11 17.038 -2.648 4.011
90 HG2 LYS 11 HG2 LYS 11 16.820 -0.736 5.597
91 HG3 LYS 11 HG1 LYS 11 15.196 -0.438 4.973
92 HD2 LYS 11 HD2 LYS 11 14.314 -2.234 6.071
93 HD3 LYS 11 HD1 LYS 11 15.755 -3.222 5.825
94 HE2 LYS 11 HE2 LYS 11 15.369 -2.583 8.225
95 HE3 LYS 11 HE1 LYS 11 16.931 -2.074 7.594
96 HZ1 LYS 11 HZ1 LYS 11 14.797 -0.161 7.229
97 HZ2 LYS 11 HZ2 LYS 11 16.390 0.074 7.750
98 HZ3 LYS 11 HZ3 LYS 11 15.206 -0.454 8.848
99 H LYS 12 HN LYS 12 17.460 -2.114 0.812
100 HA LYS 12 HA LYS 12 20.122 -2.923 1.523
101 HB2 LYS 12 HB2 LYS 12 18.385 -3.342 -0.894
102 HB3 LYS 12 HB1 LYS 12 20.084 -3.832 -0.879
103 HG2 LYS 12 HG2 LYS 12 19.063 -5.770 -0.092
104 HG3 LYS 12 HG1 LYS 12 19.434 -4.950 1.425
105 HD2 LYS 12 HD2 LYS 12 17.210 -5.278 1.849
106 HD3 LYS 12 HD1 LYS 12 17.010 -3.843 0.852
107 HE2 LYS 12 HE2 LYS 12 15.559 -5.368 -0.176
108 HE3 LYS 12 HE1 LYS 12 17.022 -5.514 -1.146
109 HZ1 LYS 12 HZ1 LYS 12 17.481 -7.554 -0.333
110 HZ2 LYS 12 HZ2 LYS 12 15.799 -7.609 -0.114
111 HZ3 LYS 12 HZ3 LYS 12 16.819 -7.239 1.198
112 H ILE 13 HN ILE 13 18.656 -0.536 -0.589
113 HA ILE 13 HA ILE 13 21.203 0.264 -1.710
114 HB ILE 13 HB ILE 13 18.601 1.699 -2.040
115 HG12 ILE 13 HG12 ILE 13 18.361 -0.783 -2.494
116 HG13 ILE 13 HG11 ILE 13 18.033 0.259 -3.877
117 HG21 ILE 13 HG21 ILE 13 20.361 2.941 -2.992
118 HG22 ILE 13 HG22 ILE 13 19.714 2.029 -4.356
119 HG23 ILE 13 HG23 ILE 13 21.191 1.490 -3.556
120 HD11 ILE 13 HD11 ILE 13 20.193 -0.183 -4.833
121 HD12 ILE 13 HD12 ILE 13 19.498 -1.742 -4.382
122 HD13 ILE 13 HD13 ILE 13 20.738 -1.005 -3.368
123 H LEU 14 HN LEU 14 18.769 1.477 0.521
124 HA LEU 14 HA LEU 14 20.454 3.789 1.170
125 HB2 LEU 14 HB2 LEU 14 17.560 3.093 1.557
126 HB3 LEU 14 HB1 LEU 14 18.314 4.307 2.590
127 HG LEU 14 HG LEU 14 19.125 5.454 0.480
128 HD11 LEU 14 HD12 LEU 14 17.514 3.216 -0.687
129 HD12 LEU 14 HD13 LEU 14 18.999 3.960 -1.284
130 HD13 LEU 14 HD11 LEU 14 17.455 4.786 -1.489
131 HD21 LEU 14 HD22 LEU 14 16.156 5.139 0.973
132 HD22 LEU 14 HD23 LEU 14 16.856 6.393 -0.057
133 HD23 LEU 14 HD21 LEU 14 17.230 6.355 1.668
134 HN1 NH2 15 H1 LEU 14 18.240 2.239 3.454
Start of MODEL 9
1 H1 ILE 1 HT1 ILE 1 2.249 -3.054 -0.981
2 H2 ILE 1 HT2 ILE 1 3.612 -3.101 0.028
3 H3 ILE 1 HT3 ILE 1 3.423 -4.259 -1.195
4 HA ILE 1 HA ILE 1 5.039 -2.669 -1.907
5 HB ILE 1 HB ILE 1 3.968 -1.962 -3.982
6 HG12 ILE 1 HG12 ILE 1 1.713 -1.589 -2.317
7 HG13 ILE 1 HG11 ILE 1 1.806 -1.327 -4.063
8 HG21 ILE 1 HG21 ILE 1 4.486 -4.372 -3.654
9 HG22 ILE 1 HG22 ILE 1 3.106 -4.123 -4.727
10 HG23 ILE 1 HG23 ILE 1 2.843 -4.625 -3.056
11 HD11 ILE 1 HD11 ILE 1 1.146 -3.996 -2.785
12 HD12 ILE 1 HD12 ILE 1 1.120 -3.613 -4.508
13 HD13 ILE 1 HD13 ILE 1 -0.051 -2.866 -3.421
14 H ASN 2 HN ASN 2 4.007 -1.445 0.474
15 HA ASN 2 HA ASN 2 3.388 1.291 -0.445
16 HB2 ASN 2 HB2 ASN 2 3.093 0.343 2.378
17 HB3 ASN 2 HB1 ASN 2 2.224 1.625 1.534
18 HD21 ASN 2 HD21 ASN 2 1.584 0.132 -0.864
19 HD22 ASN 2 HD22 ASN 2 0.493 -1.097 -0.430
20 H LEU 3 HN LEU 3 4.067 2.677 1.843
21 HA LEU 3 HA LEU 3 6.737 3.320 1.407
22 HB2 LEU 3 HB2 LEU 3 4.603 4.060 3.184
23 HB3 LEU 3 HB1 LEU 3 6.141 4.035 4.043
24 HG LEU 3 HG LEU 3 5.753 5.400 1.370
25 HD11 LEU 3 HD11 LEU 3 5.270 6.340 4.180
26 HD12 LEU 3 HD12 LEU 3 4.370 6.710 2.710
27 HD13 LEU 3 HD13 LEU 3 5.931 7.478 3.006
28 HD21 LEU 3 HD21 LEU 3 8.005 5.557 1.504
29 HD22 LEU 3 HD22 LEU 3 8.006 4.817 3.106
30 HD23 LEU 3 HD23 LEU 3 7.799 6.560 2.938
31 H LYS 4 HN LYS 4 5.218 1.413 3.913
32 HA LYS 4 HA LYS 4 7.442 0.803 5.430
33 HB2 LYS 4 HB2 LYS 4 4.860 -0.628 4.902
34 HB3 LYS 4 HB1 LYS 4 6.100 -1.365 5.917
35 HG2 LYS 4 HG2 LYS 4 6.076 0.522 7.433
36 HG3 LYS 4 HG1 LYS 4 5.005 1.423 6.362
37 HD2 LYS 4 HD2 LYS 4 3.266 -0.329 6.685
38 HD3 LYS 4 HD1 LYS 4 4.330 -1.136 7.845
39 HE2 LYS 4 HE2 LYS 4 3.647 1.778 8.171
40 HE3 LYS 4 HE1 LYS 4 2.528 0.546 8.742
41 HZ1 LYS 4 HZ1 LYS 4 5.159 1.298 9.744
42 HZ2 LYS 4 HZ2 LYS 4 4.798 -0.362 9.767
43 HZ3 LYS 4 HZ3 LYS 4 3.793 0.741 10.580
44 H ALA 5 HN ALA 5 6.069 -0.859 2.636
45 HA ALA 5 HA ALA 5 7.983 -2.964 2.532
46 HB1 ALA 5 HB1 ALA 5 5.743 -3.066 1.439
47 HB2 ALA 5 HB2 ALA 5 7.068 -3.449 0.340
48 HB3 ALA 5 HB3 ALA 5 6.298 -1.865 0.274
49 H LEU 6 HN LEU 6 7.676 0.164 0.850
50 HA LEU 6 HA LEU 6 9.804 -0.063 -0.939
51 HB2 LEU 6 HB2 LEU 6 8.692 2.297 0.571
52 HB3 LEU 6 HB1 LEU 6 9.949 2.459 -0.657
53 HG LEU 6 HG LEU 6 7.402 0.969 -1.254
54 HD11 LEU 6 HD11 LEU 6 6.422 2.968 -0.656
55 HD12 LEU 6 HD12 LEU 6 6.815 3.300 -2.340
56 HD13 LEU 6 HD13 LEU 6 7.850 3.922 -1.054
57 HD21 LEU 6 HD21 LEU 6 7.985 1.524 -3.543
58 HD22 LEU 6 HD22 LEU 6 9.410 0.841 -2.760
59 HD23 LEU 6 HD23 LEU 6 9.289 2.586 -3.000
60 H ALA 7 HN ALA 7 9.765 1.035 2.420
61 HA ALA 7 HA ALA 7 12.450 1.778 2.670
62 HB1 ALA 7 HB1 ALA 7 10.564 0.564 4.694
63 HB2 ALA 7 HB2 ALA 7 10.928 2.274 4.462
64 HB3 ALA 7 HB3 ALA 7 12.160 1.190 5.108
65 H ALA 8 HN ALA 8 10.903 -1.368 2.906
66 HA ALA 8 HA ALA 8 13.107 -2.871 3.801
67 HB1 ALA 8 HB1 ALA 8 11.112 -3.991 1.861
68 HB2 ALA 8 HB2 ALA 8 10.613 -3.561 3.498
69 HB3 ALA 8 HB3 ALA 8 11.873 -4.772 3.248
70 H LEU 9 HN LEU 9 11.985 -2.091 0.564
71 HA LEU 9 HA LEU 9 14.090 -3.469 -0.807
72 HB2 LEU 9 HB2 LEU 9 12.666 -1.112 -2.002
73 HB3 LEU 9 HB1 LEU 9 13.166 -2.618 -2.769
74 HG LEU 9 HG LEU 9 10.926 -2.327 -0.745
75 HD11 LEU 9 HD11 LEU 9 10.117 -3.400 -3.269
76 HD12 LEU 9 HD12 LEU 9 11.001 -1.902 -3.567
77 HD13 LEU 9 HD13 LEU 9 9.597 -1.903 -2.499
78 HD21 LEU 9 HD21 LEU 9 12.069 -4.686 -2.241
79 HD22 LEU 9 HD22 LEU 9 10.489 -4.717 -1.459
80 HD23 LEU 9 HD23 LEU 9 11.948 -4.481 -0.494
81 H ALA 10 HN ALA 10 13.443 -0.102 0.032
82 HA ALA 10 HA ALA 10 15.725 1.084 -1.067
83 HB1 ALA 10 HB1 ALA 10 15.398 2.857 0.641
84 HB2 ALA 10 HB2 ALA 10 14.247 1.815 1.475
85 HB3 ALA 10 HB3 ALA 10 13.885 2.407 -0.146
86 H LYS 11 HN LYS 11 15.286 -0.652 1.971
87 HA LYS 11 HA LYS 11 17.615 -0.007 3.324
88 HB2 LYS 11 HB2 LYS 11 15.590 -1.722 3.794
89 HB3 LYS 11 HB1 LYS 11 16.838 -2.877 3.326
90 HG2 LYS 11 HG2 LYS 11 18.381 -1.704 4.973
91 HG3 LYS 11 HG1 LYS 11 16.965 -0.831 5.558
92 HD2 LYS 11 HD2 LYS 11 16.190 -2.645 6.690
93 HD3 LYS 11 HD1 LYS 11 16.548 -3.734 5.347
94 HE2 LYS 11 HE2 LYS 11 17.908 -4.011 7.549
95 HE3 LYS 11 HE1 LYS 11 18.777 -4.044 6.019
96 HZ1 LYS 11 HZ1 LYS 11 19.902 -2.250 6.598
97 HZ2 LYS 11 HZ2 LYS 11 19.202 -2.335 8.145
98 HZ3 LYS 11 HZ3 LYS 11 18.488 -1.383 6.939
99 H LYS 12 HN LYS 12 17.152 -2.115 0.581
100 HA LYS 12 HA LYS 12 19.811 -3.204 0.680
101 HB2 LYS 12 HB2 LYS 12 17.501 -3.397 -1.231
102 HB3 LYS 12 HB1 LYS 12 19.091 -4.009 -1.678
103 HG2 LYS 12 HG2 LYS 12 18.113 -5.882 -0.685
104 HG3 LYS 12 HG1 LYS 12 19.016 -5.191 0.663
105 HD2 LYS 12 HD2 LYS 12 16.980 -5.371 1.722
106 HD3 LYS 12 HD1 LYS 12 16.703 -3.820 0.930
107 HE2 LYS 12 HE2 LYS 12 14.812 -5.222 0.408
108 HE3 LYS 12 HE1 LYS 12 15.797 -5.086 -1.051
109 HZ1 LYS 12 HZ1 LYS 12 15.712 -7.301 -1.041
110 HZ2 LYS 12 HZ2 LYS 12 15.256 -7.396 0.590
111 HZ3 LYS 12 HZ3 LYS 12 16.890 -7.209 0.170
112 H ILE 13 HN ILE 13 18.249 -0.464 -0.757
113 HA ILE 13 HA ILE 13 20.395 0.050 -2.619
114 HB ILE 13 HB ILE 13 18.223 1.965 -1.847
115 HG12 ILE 13 HG12 ILE 13 17.191 -0.228 -2.395
116 HG13 ILE 13 HG11 ILE 13 16.842 0.977 -3.632
117 HG21 ILE 13 HG21 ILE 13 20.176 2.687 -3.303
118 HG22 ILE 13 HG22 ILE 13 18.586 2.878 -4.045
119 HG23 ILE 13 HG23 ILE 13 19.611 1.516 -4.498
120 HD11 ILE 13 HD11 ILE 13 18.473 -1.487 -3.807
121 HD12 ILE 13 HD12 ILE 13 19.175 -0.072 -4.594
122 HD13 ILE 13 HD13 ILE 13 17.572 -0.640 -5.063
123 H LEU 14 HN LEU 14 19.206 1.302 0.461
124 HA LEU 14 HA LEU 14 21.042 3.454 0.695
125 HB2 LEU 14 HB2 LEU 14 19.229 1.962 2.540
126 HB3 LEU 14 HB1 LEU 14 20.553 2.866 3.278
127 HG LEU 14 HG LEU 14 19.844 4.888 1.983
128 HD11 LEU 14 HD12 LEU 14 18.705 3.924 0.107
129 HD12 LEU 14 HD13 LEU 14 17.486 4.799 1.030
130 HD13 LEU 14 HD11 LEU 14 17.590 3.043 1.148
131 HD21 LEU 14 HD22 LEU 14 19.066 4.513 4.312
132 HD22 LEU 14 HD23 LEU 14 17.649 3.661 3.693
133 HD23 LEU 14 HD21 LEU 14 17.867 5.379 3.354
134 HN1 NH2 15 H1 LEU 14 21.234 0.050 1.747
Start of MODEL 10
1 H1 ILE 1 HT1 ILE 1 2.995 -1.653 0.934
2 H2 ILE 1 HT2 ILE 1 2.009 -2.682 0.008
3 H3 ILE 1 HT3 ILE 1 2.218 -2.967 1.663
4 HA ILE 1 HA ILE 1 0.373 -1.242 0.332
5 HB ILE 1 HB ILE 1 -0.520 -1.247 2.801
6 HG12 ILE 1 HG12 ILE 1 1.895 -2.257 3.448
7 HG13 ILE 1 HG11 ILE 1 0.442 -2.675 4.342
8 HG21 ILE 1 HG21 ILE 1 -1.728 -2.509 1.242
9 HG22 ILE 1 HG22 ILE 1 -1.242 -3.726 2.423
10 HG23 ILE 1 HG23 ILE 1 -0.366 -3.575 0.899
11 HD11 ILE 1 HD11 ILE 1 1.068 -4.329 1.936
12 HD12 ILE 1 HD12 ILE 1 0.346 -4.801 3.474
13 HD13 ILE 1 HD13 ILE 1 2.088 -4.549 3.359
14 H ASN 2 HN ASN 2 2.747 -0.836 2.962
15 HA ASN 2 HA ASN 2 2.286 2.082 2.827
16 HB2 ASN 2 HB2 ASN 2 3.682 0.561 5.033
17 HB3 ASN 2 HB1 ASN 2 3.148 2.237 5.050
18 HD21 ASN 2 HD21 ASN 2 0.561 1.514 3.660
19 HD22 ASN 2 HD22 ASN 2 -0.385 0.761 4.852
20 H LEU 3 HN LEU 3 4.505 3.110 3.851
21 HA LEU 3 HA LEU 3 6.351 3.058 1.720
22 HB2 LEU 3 HB2 LEU 3 6.668 4.070 4.504
23 HB3 LEU 3 HB1 LEU 3 7.726 4.469 3.163
24 HG LEU 3 HG LEU 3 5.466 5.212 2.009
25 HD11 LEU 3 HD11 LEU 3 4.223 6.355 4.153
26 HD12 LEU 3 HD12 LEU 3 4.731 4.821 4.857
27 HD13 LEU 3 HD13 LEU 3 3.708 4.839 3.418
28 HD21 LEU 3 HD21 LEU 3 5.776 7.493 3.035
29 HD22 LEU 3 HD22 LEU 3 7.270 6.761 2.453
30 HD23 LEU 3 HD23 LEU 3 6.904 6.766 4.179
31 H LYS 4 HN LYS 4 5.993 1.251 4.602
32 HA LYS 4 HA LYS 4 8.548 0.373 5.159
33 HB2 LYS 4 HB2 LYS 4 5.828 -0.850 5.422
34 HB3 LYS 4 HB1 LYS 4 7.261 -1.812 5.797
35 HG2 LYS 4 HG2 LYS 4 7.688 -0.657 7.713
36 HG3 LYS 4 HG1 LYS 4 7.316 0.893 6.967
37 HD2 LYS 4 HD2 LYS 4 4.896 0.408 7.172
38 HD3 LYS 4 HD1 LYS 4 5.283 -1.134 7.934
39 HE2 LYS 4 HE2 LYS 4 6.350 1.451 9.053
40 HE3 LYS 4 HE1 LYS 4 4.739 0.872 9.480
41 HZ1 LYS 4 HZ1 LYS 4 7.121 -0.866 9.717
42 HZ2 LYS 4 HZ2 LYS 4 5.599 -1.036 10.457
43 HZ3 LYS 4 HZ3 LYS 4 6.660 0.184 10.962
44 H ALA 5 HN ALA 5 6.240 -0.856 2.781
45 HA ALA 5 HA ALA 5 7.715 -3.089 1.917
46 HB1 ALA 5 HB1 ALA 5 6.462 -2.287 -0.366
47 HB2 ALA 5 HB2 ALA 5 5.497 -1.454 0.853
48 HB3 ALA 5 HB3 ALA 5 5.679 -3.207 0.917
49 H LEU 6 HN LEU 6 7.719 0.291 0.829
50 HA LEU 6 HA LEU 6 9.636 -0.065 -1.243
51 HB2 LEU 6 HB2 LEU 6 8.308 2.169 0.140
52 HB3 LEU 6 HB1 LEU 6 9.933 2.543 -0.431
53 HG LEU 6 HG LEU 6 7.837 1.250 -2.190
54 HD11 LEU 6 HD11 LEU 6 7.294 3.420 -3.034
55 HD12 LEU 6 HD12 LEU 6 8.616 4.176 -2.142
56 HD13 LEU 6 HD13 LEU 6 7.212 3.548 -1.278
57 HD21 LEU 6 HD21 LEU 6 9.872 0.906 -3.247
58 HD22 LEU 6 HD22 LEU 6 10.620 2.320 -2.505
59 HD23 LEU 6 HD23 LEU 6 9.502 2.519 -3.855
60 H ALA 7 HN ALA 7 9.809 1.033 2.092
61 HA ALA 7 HA ALA 7 12.542 1.588 2.245
62 HB1 ALA 7 HB1 ALA 7 12.290 1.204 4.688
63 HB2 ALA 7 HB2 ALA 7 10.689 0.526 4.390
64 HB3 ALA 7 HB3 ALA 7 11.009 2.221 4.031
65 H ALA 8 HN ALA 8 10.807 -1.440 2.483
66 HA ALA 8 HA ALA 8 12.872 -3.056 3.486
67 HB1 ALA 8 HB1 ALA 8 11.661 -4.930 2.313
68 HB2 ALA 8 HB2 ALA 8 10.591 -3.714 1.618
69 HB3 ALA 8 HB3 ALA 8 10.638 -3.949 3.364
70 H LEU 9 HN LEU 9 11.998 -2.253 0.178
71 HA LEU 9 HA LEU 9 14.169 -3.704 -1.000
72 HB2 LEU 9 HB2 LEU 9 12.991 -1.422 -2.495
73 HB3 LEU 9 HB1 LEU 9 13.302 -3.074 -3.021
74 HG LEU 9 HG LEU 9 11.047 -2.220 -1.180
75 HD11 LEU 9 HD11 LEU 9 9.693 -3.035 -3.242
76 HD12 LEU 9 HD12 LEU 9 11.199 -2.806 -4.133
77 HD13 LEU 9 HD13 LEU 9 10.443 -1.442 -3.316
78 HD21 LEU 9 HD21 LEU 9 12.275 -4.745 -1.565
79 HD22 LEU 9 HD22 LEU 9 10.741 -4.805 -2.433
80 HD23 LEU 9 HD23 LEU 9 10.771 -4.405 -0.715
81 H ALA 10 HN ALA 10 13.507 -0.310 -0.307
82 HA ALA 10 HA ALA 10 15.921 0.749 -1.309
83 HB1 ALA 10 HB1 ALA 10 14.947 2.698 -0.774
84 HB2 ALA 10 HB2 ALA 10 14.881 2.262 0.934
85 HB3 ALA 10 HB3 ALA 10 13.587 1.761 -0.154
86 H LYS 11 HN LYS 11 15.094 -0.564 1.862
87 HA LYS 11 HA LYS 11 17.135 0.390 3.436
88 HB2 LYS 11 HB2 LYS 11 15.341 -1.090 4.253
89 HB3 LYS 11 HB1 LYS 11 16.078 -2.447 3.402
90 HG2 LYS 11 HG2 LYS 11 16.882 -2.663 5.614
91 HG3 LYS 11 HG1 LYS 11 18.213 -1.884 4.764
92 HD2 LYS 11 HD2 LYS 11 17.749 0.222 5.707
93 HD3 LYS 11 HD1 LYS 11 16.104 -0.240 6.154
94 HE2 LYS 11 HE2 LYS 11 17.534 -0.218 8.141
95 HE3 LYS 11 HE1 LYS 11 17.020 -1.869 7.786
96 HZ1 LYS 11 HZ1 LYS 11 19.099 -2.475 7.148
97 HZ2 LYS 11 HZ2 LYS 11 19.534 -1.236 8.227
98 HZ3 LYS 11 HZ3 LYS 11 19.500 -0.937 6.559
99 H LYS 12 HN LYS 12 17.318 -2.289 1.131
100 HA LYS 12 HA LYS 12 20.040 -2.879 1.800
101 HB2 LYS 12 HB2 LYS 12 18.169 -3.836 -0.360
102 HB3 LYS 12 HB1 LYS 12 19.861 -4.338 -0.292
103 HG2 LYS 12 HG2 LYS 12 18.883 -6.014 0.985
104 HG3 LYS 12 HG1 LYS 12 19.289 -4.844 2.240
105 HD2 LYS 12 HD2 LYS 12 17.103 -5.058 2.816
106 HD3 LYS 12 HD1 LYS 12 16.824 -3.946 1.473
107 HE2 LYS 12 HE2 LYS 12 16.588 -5.886 -0.053
108 HE3 LYS 12 HE1 LYS 12 16.772 -6.969 1.325
109 HZ1 LYS 12 HZ1 LYS 12 14.754 -6.373 2.180
110 HZ2 LYS 12 HZ2 LYS 12 14.427 -6.241 0.518
111 HZ3 LYS 12 HZ3 LYS 12 14.756 -4.845 1.440
112 H ILE 13 HN ILE 13 18.431 -0.799 -0.484
113 HA ILE 13 HA ILE 13 20.843 -0.420 -2.042
114 HB ILE 13 HB ILE 13 18.332 1.180 -2.280
115 HG12 ILE 13 HG12 ILE 13 17.812 -1.279 -2.306
116 HG13 ILE 13 HG11 ILE 13 17.481 -0.491 -3.845
117 HG21 ILE 13 HG21 ILE 13 19.068 1.309 -4.649
118 HG22 ILE 13 HG22 ILE 13 20.496 0.365 -4.230
119 HG23 ILE 13 HG23 ILE 13 20.276 1.976 -3.548
120 HD11 ILE 13 HD11 ILE 13 20.081 -1.921 -3.231
121 HD12 ILE 13 HD12 ILE 13 19.531 -1.321 -4.793
122 HD13 ILE 13 HD13 ILE 13 18.715 -2.686 -4.041
123 H LEU 14 HN LEU 14 18.884 1.349 0.284
124 HA LEU 14 HA LEU 14 20.395 3.768 0.153
125 HB2 LEU 14 HB2 LEU 14 18.304 2.640 1.968
126 HB3 LEU 14 HB1 LEU 14 19.301 3.957 2.583
127 HG LEU 14 HG LEU 14 18.684 5.380 0.712
128 HD11 LEU 14 HD12 LEU 14 17.019 4.574 -0.964
129 HD12 LEU 14 HD13 LEU 14 17.142 2.960 -0.268
130 HD13 LEU 14 HD11 LEU 14 18.543 3.692 -1.048
131 HD21 LEU 14 HD22 LEU 14 16.144 5.374 1.049
132 HD22 LEU 14 HD23 LEU 14 17.119 5.513 2.511
133 HD23 LEU 14 HD21 LEU 14 16.390 3.966 2.082
134 HN1 NH2 15 H1 LEU 14 22.495 2.187 0.233