Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
641674 | 6gik RC | 34273 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 PHE 1 HT1 PHE 1 34.063 9.958 -11.214
2 H2 PHE 1 HT2 PHE 1 33.991 11.170 -10.025
3 H3 PHE 1 HT3 PHE 1 32.584 10.327 -10.472
4 HA PHE 1 HA PHE 1 33.076 8.518 -9.293
5 HB2 PHE 1 HB2 PHE 1 35.181 8.151 -10.605
6 HB3 PHE 1 HB1 PHE 1 36.025 9.247 -9.484
7 HD1 PHE 1 HD1 PHE 1 36.777 8.471 -7.347
8 HD2 PHE 1 HD2 PHE 1 34.038 6.070 -9.664
9 HE1 PHE 1 HE1 PHE 1 37.079 6.583 -5.750
10 HE2 PHE 1 HE2 PHE 1 34.342 4.183 -8.066
11 HZ PHE 1 HZ PHE 1 35.927 4.412 -6.158
12 H LEU 2 HN LEU 2 31.916 9.887 -7.796
13 HA LEU 2 HA LEU 2 33.552 10.430 -5.398
14 HB2 LEU 2 HB2 LEU 2 32.607 12.738 -5.137
15 HB3 LEU 2 HB1 LEU 2 33.781 12.587 -6.461
16 HG LEU 2 HG LEU 2 30.849 12.170 -7.133
17 HD11 LEU 2 HD11 LEU 2 30.811 14.196 -5.718
18 HD12 LEU 2 HD12 LEU 2 30.517 14.604 -7.426
19 HD13 LEU 2 HD13 LEU 2 32.113 14.912 -6.699
20 HD21 LEU 2 HD21 LEU 2 33.203 13.524 -8.539
21 HD22 LEU 2 HD22 LEU 2 31.564 13.380 -9.212
22 HD23 LEU 2 HD23 LEU 2 32.531 11.921 -8.913
23 HA PRO 3 HA PRO 3 29.115 9.060 -4.770
24 HB2 PRO 3 HB2 PRO 3 29.480 6.476 -4.033
25 HB3 PRO 3 HB1 PRO 3 29.481 6.962 -5.761
26 HG2 PRO 3 HG2 PRO 3 31.819 6.437 -3.933
27 HG3 PRO 3 HG1 PRO 3 31.553 5.893 -5.620
28 HD2 PRO 3 HD2 PRO 3 33.099 8.105 -4.962
29 HD3 PRO 3 HD1 PRO 3 32.233 7.934 -6.524
30 H ILE 4 HN ILE 4 29.259 10.573 -2.997
31 HA ILE 4 HA ILE 4 30.650 9.854 -0.548
32 HB ILE 4 HB ILE 4 28.335 11.815 -0.843
33 HG12 ILE 4 HG12 ILE 4 30.329 12.155 -2.488
34 HG13 ILE 4 HG11 ILE 4 29.837 13.533 -1.489
35 HG21 ILE 4 HG21 ILE 4 29.588 12.941 1.071
36 HG22 ILE 4 HG22 ILE 4 30.583 11.469 1.179
37 HG23 ILE 4 HG23 ILE 4 28.828 11.381 1.460
38 HD11 ILE 4 HD1 ILE 4 32.094 11.643 -0.693
39 HD12 ILE 4 HD2 ILE 4 31.695 13.222 0.017
40 HD13 ILE 4 HD3 ILE 4 32.351 13.127 -1.633
41 H VAL 5 HN VAL 5 27.237 9.804 -1.615
42 HA VAL 5 HA VAL 5 25.487 8.493 -0.922
43 HB VAL 5 HB VAL 5 27.312 6.954 0.957
44 HG11 VAL 5 HG11 VAL 5 24.753 6.270 -0.556
45 HG12 VAL 5 HG12 VAL 5 24.917 6.500 1.199
46 HG13 VAL 5 HG13 VAL 5 25.695 5.112 0.411
47 HG21 VAL 5 HG21 VAL 5 28.473 6.832 -1.144
48 HG22 VAL 5 HG22 VAL 5 26.953 6.718 -2.061
49 HG23 VAL 5 HG23 VAL 5 27.504 5.347 -1.070
50 H GLY 6 HN GLY 6 27.444 10.251 1.079
51 HA2 GLY 6 HA1 GLY 6 25.518 10.241 3.368
52 HA3 GLY 6 HA2 GLY 6 27.157 10.931 3.374
53 H LEU 7 HN LEU 7 25.961 11.669 0.454
54 HA LEU 7 HA LEU 7 24.430 14.065 1.252
55 HB2 LEU 7 HB2 LEU 7 26.910 14.651 1.125
56 HB3 LEU 7 HB1 LEU 7 26.818 14.201 -0.593
57 HG LEU 7 HG LEU 7 24.797 15.918 -0.673
58 HD11 LEU 7 HD11 LEU 7 25.156 17.825 0.926
59 HD12 LEU 7 HD12 LEU 7 26.312 16.816 1.823
60 HD13 LEU 7 HD13 LEU 7 24.600 16.342 1.732
61 HD21 LEU 7 HD21 LEU 7 26.929 16.249 -1.858
62 HD22 LEU 7 HD22 LEU 7 27.695 16.823 -0.357
63 HD23 LEU 7 HD23 LEU 7 26.399 17.777 -1.117
64 H LEU 8 HN LEU 8 25.536 11.759 -0.851
65 HA LEU 8 HA LEU 8 23.776 12.558 -3.113
66 HB2 LEU 8 HB2 LEU 8 26.207 11.585 -3.279
67 HB3 LEU 8 HB1 LEU 8 25.434 10.019 -2.959
68 HG LEU 8 HG LEU 8 23.788 10.736 -4.923
69 HD11 LEU 8 HD11 LEU 8 25.026 12.070 -6.672
70 HD12 LEU 8 HD12 LEU 8 26.243 12.476 -5.443
71 HD13 LEU 8 HD13 LEU 8 24.563 13.027 -5.249
72 HD21 LEU 8 HD21 LEU 8 25.364 8.827 -5.015
73 HD22 LEU 8 HD22 LEU 8 26.684 9.937 -5.456
74 HD23 LEU 8 HD23 LEU 8 25.317 9.692 -6.569
75 H LYS 9 HN LYS 9 23.455 10.996 -0.223
76 HA LYS 9 HA LYS 9 20.888 9.891 -0.939
77 HB2 LYS 9 HB2 LYS 9 22.448 8.126 -1.858
78 HB3 LYS 9 HB1 LYS 9 23.027 7.861 -0.197
79 HG2 LYS 9 HG2 LYS 9 20.876 7.100 0.542
80 HG3 LYS 9 HG1 LYS 9 20.076 7.687 -0.936
81 HD2 LYS 9 HD2 LYS 9 21.271 6.024 -2.285
82 HD3 LYS 9 HD1 LYS 9 22.179 5.479 -0.854
83 HE2 LYS 9 HE2 LYS 9 20.301 3.951 -1.278
84 HE3 LYS 9 HE1 LYS 9 20.024 4.842 0.237
85 HZ1 LYS 9 HZ1 LYS 9 19.008 6.223 -2.062
86 HZ2 LYS 9 HZ2 LYS 9 18.228 5.817 -0.609
87 HZ3 LYS 9 HZ3 LYS 9 18.304 4.691 -1.879
88 H SER 10 HN SER 10 23.219 10.997 1.123
89 HA SER 10 HA SER 10 23.351 11.262 3.433
90 HB2 SER 10 HB2 SER 10 20.328 11.253 3.094
91 HB3 SER 10 HB1 SER 10 21.203 11.857 4.519
92 HG SER 10 HG SER 10 20.747 13.045 2.123
93 H LEU 11 HN LEU 11 24.174 8.942 3.396
94 HA LEU 11 HA LEU 11 22.513 6.759 4.122
95 HB2 LEU 11 HB2 LEU 11 25.128 7.007 3.508
96 HB3 LEU 11 HB1 LEU 11 25.303 6.947 5.274
97 HG LEU 11 HG LEU 11 23.849 4.880 3.555
98 HD11 LEU 11 HD11 LEU 11 25.752 3.415 4.165
99 HD12 LEU 11 HD12 LEU 11 26.512 4.765 5.042
100 HD13 LEU 11 HD13 LEU 11 26.311 4.852 3.275
101 HD21 LEU 11 HD21 LEU 11 24.008 3.577 5.798
102 HD22 LEU 11 HD22 LEU 11 22.794 4.871 5.694
103 HD23 LEU 11 HD23 LEU 11 24.329 5.159 6.550
104 H LEU 12 HN LEU 12 24.333 9.079 6.159
105 HA LEU 12 HA LEU 12 22.578 8.285 8.486
106 HB2 LEU 12 HB2 LEU 12 25.158 7.681 8.473
107 HB3 LEU 12 HB1 LEU 12 25.377 9.405 8.838
108 HG LEU 12 HG LEU 12 23.638 7.465 10.436
109 HD11 LEU 12 HD11 LEU 12 26.351 8.720 11.048
110 HD12 LEU 12 HD12 LEU 12 26.056 7.006 10.665
111 HD13 LEU 12 HD13 LEU 12 25.402 7.710 12.164
112 HD21 LEU 12 HD21 LEU 12 23.799 9.466 12.109
113 HD22 LEU 12 HD22 LEU 12 22.688 9.625 10.732
114 HD23 LEU 12 HD23 LEU 12 24.275 10.432 10.691
115 H LYS 13 HN LYS 13 24.821 10.896 7.401
116 HA LYS 13 HA LYS 13 23.745 12.977 8.936
117 HB2 LYS 13 HB2 LYS 13 24.670 13.270 6.054
118 HB3 LYS 13 HB1 LYS 13 24.719 14.499 7.341
119 HG2 LYS 13 HG2 LYS 13 26.234 12.911 8.645
120 HG3 LYS 13 HG1 LYS 13 26.335 11.923 7.166
121 HD2 LYS 13 HD2 LYS 13 27.124 13.978 5.929
122 HD3 LYS 13 HD1 LYS 13 27.183 14.834 7.489
123 HE2 LYS 13 HE2 LYS 13 28.713 12.283 6.813
124 HE3 LYS 13 HE1 LYS 13 29.409 13.920 6.875
125 HZ1 LYS 13 HZ1 LYS 13 29.654 12.516 8.941
126 HZ2 LYS 13 HZ2 LYS 13 27.982 12.703 9.177
127 HZ3 LYS 13 HZ3 LYS 13 29.000 14.063 9.172
Start of MODEL 2
1 H1 PHE 1 HT1 PHE 1 33.217 7.562 -11.698
2 H2 PHE 1 HT2 PHE 1 33.924 6.598 -10.491
3 H3 PHE 1 HT3 PHE 1 34.842 7.792 -11.276
4 HA PHE 1 HA PHE 1 34.392 8.966 -9.467
5 HB2 PHE 1 HB2 PHE 1 31.674 9.230 -10.802
6 HB3 PHE 1 HB1 PHE 1 32.543 10.449 -9.839
7 HD1 PHE 1 HD1 PHE 1 34.488 11.641 -10.759
8 HD2 PHE 1 HD2 PHE 1 32.350 8.714 -13.101
9 HE1 PHE 1 HE1 PHE 1 35.620 12.463 -12.821
10 HE2 PHE 1 HE2 PHE 1 33.483 9.535 -15.164
11 HZ PHE 1 HZ PHE 1 35.092 11.433 -15.029
12 H LEU 2 HN LEU 2 34.313 7.903 -7.564
13 HA LEU 2 HA LEU 2 32.159 6.086 -6.892
14 HB2 LEU 2 HB2 LEU 2 34.035 7.438 -4.921
15 HB3 LEU 2 HB1 LEU 2 33.267 5.839 -4.794
16 HG LEU 2 HG LEU 2 35.420 6.670 -6.788
17 HD11 LEU 2 HD11 LEU 2 36.106 6.221 -4.391
18 HD12 LEU 2 HD12 LEU 2 36.830 5.110 -5.578
19 HD13 LEU 2 HD13 LEU 2 35.461 4.573 -4.576
20 HD21 LEU 2 HD21 LEU 2 35.331 4.125 -7.302
21 HD22 LEU 2 HD22 LEU 2 34.023 5.130 -7.964
22 HD23 LEU 2 HD23 LEU 2 33.737 4.145 -6.508
23 HA PRO 3 HA PRO 3 29.262 9.109 -5.358
24 HB2 PRO 3 HB2 PRO 3 27.685 7.610 -3.714
25 HB3 PRO 3 HB1 PRO 3 27.694 7.371 -5.491
26 HG2 PRO 3 HG2 PRO 3 29.148 5.816 -3.357
27 HG3 PRO 3 HG1 PRO 3 28.207 5.211 -4.757
28 HD2 PRO 3 HD2 PRO 3 30.952 5.403 -4.797
29 HD3 PRO 3 HD1 PRO 3 29.947 5.607 -6.270
30 H ILE 4 HN ILE 4 28.955 10.524 -3.629
31 HA ILE 4 HA ILE 4 31.001 10.434 -1.561
32 HB ILE 4 HB ILE 4 28.554 12.248 -1.567
33 HG12 ILE 4 HG12 ILE 4 31.181 12.572 -3.093
34 HG13 ILE 4 HG11 ILE 4 29.584 12.286 -3.822
35 HG21 ILE 4 HG21 ILE 4 30.206 12.127 0.407
36 HG22 ILE 4 HG22 ILE 4 29.939 13.734 -0.306
37 HG23 ILE 4 HG23 ILE 4 31.415 12.819 -0.699
38 HD11 ILE 4 HD1 ILE 4 29.879 14.637 -3.977
39 HD12 ILE 4 HD2 ILE 4 30.573 14.747 -2.344
40 HD13 ILE 4 HD3 ILE 4 28.833 14.431 -2.552
41 H VAL 5 HN VAL 5 27.422 10.080 -1.587
42 HA VAL 5 HA VAL 5 26.058 8.909 -0.144
43 HB VAL 5 HB VAL 5 28.383 8.001 1.594
44 HG11 VAL 5 HG11 VAL 5 25.747 6.733 0.723
45 HG12 VAL 5 HG12 VAL 5 26.107 7.440 2.314
46 HG13 VAL 5 HG13 VAL 5 26.947 5.967 1.791
47 HG21 VAL 5 HG21 VAL 5 29.345 7.320 -0.449
48 HG22 VAL 5 HG22 VAL 5 27.770 7.166 -1.260
49 HG23 VAL 5 HG23 VAL 5 28.310 5.922 -0.111
50 H GLY 6 HN GLY 6 25.292 9.029 2.139
51 HA2 GLY 6 HA1 GLY 6 24.683 10.448 3.869
52 HA3 GLY 6 HA2 GLY 6 26.428 10.695 4.101
53 H LEU 7 HN LEU 7 25.371 11.465 0.982
54 HA LEU 7 HA LEU 7 24.527 14.172 1.476
55 HB2 LEU 7 HB2 LEU 7 26.913 14.512 1.882
56 HB3 LEU 7 HB1 LEU 7 27.289 13.652 0.372
57 HG LEU 7 HG LEU 7 26.259 15.425 -0.959
58 HD11 LEU 7 HD11 LEU 7 25.384 16.464 1.764
59 HD12 LEU 7 HD12 LEU 7 24.401 16.194 0.304
60 HD13 LEU 7 HD13 LEU 7 25.532 17.563 0.371
61 HD21 LEU 7 HD21 LEU 7 27.777 17.291 -0.373
62 HD22 LEU 7 HD22 LEU 7 28.609 15.725 -0.234
63 HD23 LEU 7 HD23 LEU 7 28.051 16.569 1.230
64 H LEU 8 HN LEU 8 25.564 11.655 -0.415
65 HA LEU 8 HA LEU 8 24.108 12.684 -2.848
66 HB2 LEU 8 HB2 LEU 8 26.635 11.959 -2.895
67 HB3 LEU 8 HB1 LEU 8 25.994 10.305 -2.831
68 HG LEU 8 HG LEU 8 24.440 11.149 -4.839
69 HD11 LEU 8 HD11 LEU 8 26.819 13.058 -4.970
70 HD12 LEU 8 HD12 LEU 8 25.108 13.512 -4.782
71 HD13 LEU 8 HD13 LEU 8 25.671 12.773 -6.297
72 HD21 LEU 8 HD21 LEU 8 26.163 10.402 -6.451
73 HD22 LEU 8 HD22 LEU 8 26.155 9.363 -5.006
74 HD23 LEU 8 HD23 LEU 8 27.420 10.599 -5.208
75 H LYS 9 HN LYS 9 23.531 10.910 -0.166
76 HA LYS 9 HA LYS 9 21.313 9.516 -1.424
77 HB2 LYS 9 HB2 LYS 9 23.364 8.017 -1.852
78 HB3 LYS 9 HB1 LYS 9 23.377 7.733 -0.096
79 HG2 LYS 9 HG2 LYS 9 21.112 6.818 -0.176
80 HG3 LYS 9 HG1 LYS 9 20.968 7.231 -1.901
81 HD2 LYS 9 HD2 LYS 9 22.950 5.731 -2.352
82 HD3 LYS 9 HD1 LYS 9 22.882 5.220 -0.648
83 HE2 LYS 9 HE2 LYS 9 20.574 4.414 -0.959
84 HE3 LYS 9 HE1 LYS 9 20.595 4.965 -2.652
85 HZ1 LYS 9 HZ1 LYS 9 21.122 2.695 -2.716
86 HZ2 LYS 9 HZ2 LYS 9 22.195 2.799 -1.403
87 HZ3 LYS 9 HZ3 LYS 9 22.613 3.481 -2.902
88 H SER 10 HN SER 10 22.922 10.894 1.112
89 HA SER 10 HA SER 10 22.463 11.117 3.393
90 HB2 SER 10 HB2 SER 10 19.593 10.755 2.467
91 HB3 SER 10 HB1 SER 10 20.166 11.656 3.889
92 HG SER 10 HG SER 10 21.488 12.772 2.075
93 H LEU 11 HN LEU 11 23.460 9.096 3.993
94 HA LEU 11 HA LEU 11 21.953 6.655 4.135
95 HB2 LEU 11 HB2 LEU 11 24.553 7.156 4.306
96 HB3 LEU 11 HB1 LEU 11 24.221 7.297 6.040
97 HG LEU 11 HG LEU 11 24.883 5.028 5.659
98 HD11 LEU 11 HD11 LEU 11 21.841 4.926 5.733
99 HD12 LEU 11 HD12 LEU 11 22.845 5.435 7.110
100 HD13 LEU 11 HD13 LEU 11 22.995 3.788 6.461
101 HD21 LEU 11 HD21 LEU 11 22.694 4.541 3.601
102 HD22 LEU 11 HD22 LEU 11 24.180 3.622 3.905
103 HD23 LEU 11 HD23 LEU 11 24.267 5.198 3.095
104 H LEU 12 HN LEU 12 22.963 8.922 6.739
105 HA LEU 12 HA LEU 12 21.533 7.796 8.860
106 HB2 LEU 12 HB2 LEU 12 21.691 10.794 8.382
107 HB3 LEU 12 HB1 LEU 12 21.641 9.932 9.937
108 HG LEU 12 HG LEU 12 23.911 9.913 7.899
109 HD11 LEU 12 HD11 LEU 12 23.758 10.861 10.794
110 HD12 LEU 12 HD12 LEU 12 23.720 11.921 9.364
111 HD13 LEU 12 HD13 LEU 12 25.177 10.965 9.725
112 HD21 LEU 12 HD21 LEU 12 23.880 7.691 8.776
113 HD22 LEU 12 HD22 LEU 12 23.406 8.246 10.400
114 HD23 LEU 12 HD23 LEU 12 25.054 8.549 9.798
115 H LYS 13 HN LYS 13 20.313 10.706 7.151
116 HA LYS 13 HA LYS 13 17.608 10.240 8.030
117 HB2 LYS 13 HB2 LYS 13 18.558 11.914 5.675
118 HB3 LYS 13 HB1 LYS 13 17.019 12.079 6.555
119 HG2 LYS 13 HG2 LYS 13 18.441 12.464 8.670
120 HG3 LYS 13 HG1 LYS 13 19.832 12.643 7.575
121 HD2 LYS 13 HD2 LYS 13 17.272 14.306 7.538
122 HD3 LYS 13 HD1 LYS 13 18.877 14.851 8.079
123 HE2 LYS 13 HE2 LYS 13 17.962 14.161 5.267
124 HE3 LYS 13 HE1 LYS 13 18.703 15.667 5.856
125 HZ1 LYS 13 HZ1 LYS 13 20.343 14.418 4.678
126 HZ2 LYS 13 HZ2 LYS 13 20.019 13.011 5.574
127 HZ3 LYS 13 HZ3 LYS 13 20.737 14.354 6.326
Start of MODEL 3
1 H1 PHE 1 HT1 PHE 1 33.418 4.482 -5.883
2 H2 PHE 1 HT2 PHE 1 32.645 3.042 -5.419
3 H3 PHE 1 HT3 PHE 1 34.341 3.125 -5.462
4 HA PHE 1 HA PHE 1 32.514 3.877 -3.418
5 HB2 PHE 1 HB2 PHE 1 35.548 3.620 -3.475
6 HB3 PHE 1 HB1 PHE 1 34.503 3.606 -2.034
7 HD1 PHE 1 HD1 PHE 1 35.653 1.696 -4.979
8 HD2 PHE 1 HD2 PHE 1 33.023 1.689 -1.557
9 HE1 PHE 1 HE1 PHE 1 35.314 -0.758 -5.245
10 HE2 PHE 1 HE2 PHE 1 32.686 -0.766 -1.822
11 HZ PHE 1 HZ PHE 1 33.881 -1.999 -3.627
12 H LEU 2 HN LEU 2 33.806 5.713 -5.812
13 HA LEU 2 HA LEU 2 34.965 7.887 -4.316
14 HB2 LEU 2 HB2 LEU 2 34.856 7.224 -6.972
15 HB3 LEU 2 HB1 LEU 2 33.624 8.501 -6.937
16 HG LEU 2 HG LEU 2 36.489 8.767 -5.911
17 HD11 LEU 2 HD11 LEU 2 36.270 8.619 -8.396
18 HD12 LEU 2 HD12 LEU 2 36.802 10.233 -7.861
19 HD13 LEU 2 HD13 LEU 2 35.112 9.969 -8.355
20 HD21 LEU 2 HD21 LEU 2 35.111 10.235 -4.613
21 HD22 LEU 2 HD22 LEU 2 34.107 10.666 -6.018
22 HD23 LEU 2 HD23 LEU 2 35.784 11.257 -5.904
23 HA PRO 3 HA PRO 3 30.379 9.678 -4.876
24 HB2 PRO 3 HB2 PRO 3 28.973 7.094 -4.191
25 HB3 PRO 3 HB1 PRO 3 28.471 8.403 -5.309
26 HG2 PRO 3 HG2 PRO 3 29.424 6.107 -6.261
27 HG3 PRO 3 HG1 PRO 3 29.893 7.666 -7.010
28 HD2 PRO 3 HD2 PRO 3 31.479 5.915 -5.117
29 HD3 PRO 3 HD1 PRO 3 32.037 6.824 -6.560
30 H ILE 4 HN ILE 4 29.477 10.651 -3.077
31 HA ILE 4 HA ILE 4 30.651 9.937 -0.512
32 HB ILE 4 HB ILE 4 28.326 11.858 -0.944
33 HG12 ILE 4 HG12 ILE 4 31.318 12.349 -1.317
34 HG13 ILE 4 HG11 ILE 4 30.090 12.366 -2.602
35 HG21 ILE 4 HG21 ILE 4 30.666 12.021 0.997
36 HG22 ILE 4 HG22 ILE 4 29.157 11.168 1.397
37 HG23 ILE 4 HG23 ILE 4 29.127 12.912 1.050
38 HD11 ILE 4 HD1 ILE 4 30.381 14.658 -2.052
39 HD12 ILE 4 HD2 ILE 4 30.451 14.321 -0.308
40 HD13 ILE 4 HD3 ILE 4 28.903 14.194 -1.179
41 H VAL 5 HN VAL 5 27.251 10.093 -1.690
42 HA VAL 5 HA VAL 5 25.444 8.774 -1.172
43 HB VAL 5 HB VAL 5 27.144 6.989 0.609
44 HG11 VAL 5 HG11 VAL 5 25.453 5.290 -0.109
45 HG12 VAL 5 HG12 VAL 5 24.607 6.556 -1.031
46 HG13 VAL 5 HG13 VAL 5 24.713 6.665 0.742
47 HG21 VAL 5 HG21 VAL 5 26.892 7.054 -2.428
48 HG22 VAL 5 HG22 VAL 5 27.282 5.548 -1.566
49 HG23 VAL 5 HG23 VAL 5 28.371 6.943 -1.446
50 H GLY 6 HN GLY 6 27.462 10.253 0.986
51 HA2 GLY 6 HA1 GLY 6 25.543 10.146 3.269
52 HA3 GLY 6 HA2 GLY 6 27.184 10.834 3.291
53 H LEU 7 HN LEU 7 25.815 11.664 0.426
54 HA LEU 7 HA LEU 7 24.399 14.055 1.385
55 HB2 LEU 7 HB2 LEU 7 27.031 14.342 0.949
56 HB3 LEU 7 HB1 LEU 7 26.488 14.449 -0.731
57 HG LEU 7 HG LEU 7 26.614 16.696 0.098
58 HD11 LEU 7 HD11 LEU 7 24.414 17.507 -0.282
59 HD12 LEU 7 HD12 LEU 7 23.658 16.030 0.354
60 HD13 LEU 7 HD13 LEU 7 24.524 15.990 -1.200
61 HD21 LEU 7 HD21 LEU 7 24.725 16.092 2.409
62 HD22 LEU 7 HD22 LEU 7 25.795 17.486 2.172
63 HD23 LEU 7 HD23 LEU 7 26.484 15.903 2.584
64 H LEU 8 HN LEU 8 25.376 11.875 -0.910
65 HA LEU 8 HA LEU 8 23.424 12.754 -2.986
66 HB2 LEU 8 HB2 LEU 8 25.172 10.268 -3.050
67 HB3 LEU 8 HB1 LEU 8 24.443 11.143 -4.418
68 HG LEU 8 HG LEU 8 26.647 12.160 -2.573
69 HD11 LEU 8 HD11 LEU 8 28.047 12.052 -4.560
70 HD12 LEU 8 HD12 LEU 8 26.654 11.596 -5.569
71 HD13 LEU 8 HD13 LEU 8 27.271 10.467 -4.340
72 HD21 LEU 8 HD21 LEU 8 26.649 14.077 -4.334
73 HD22 LEU 8 HD22 LEU 8 25.354 14.089 -3.117
74 HD23 LEU 8 HD23 LEU 8 25.019 13.507 -4.766
75 H LYS 9 HN LYS 9 23.290 11.060 -0.157
76 HA LYS 9 HA LYS 9 20.696 9.963 -0.770
77 HB2 LYS 9 HB2 LYS 9 22.346 8.286 -1.858
78 HB3 LYS 9 HB1 LYS 9 22.794 7.842 -0.195
79 HG2 LYS 9 HG2 LYS 9 20.470 7.235 0.309
80 HG3 LYS 9 HG1 LYS 9 19.947 7.788 -1.299
81 HD2 LYS 9 HD2 LYS 9 21.315 6.071 -2.381
82 HD3 LYS 9 HD1 LYS 9 21.966 5.557 -0.806
83 HE2 LYS 9 HE2 LYS 9 20.113 4.074 -1.601
84 HE3 LYS 9 HE1 LYS 9 19.725 4.882 -0.062
85 HZ1 LYS 9 HZ1 LYS 9 18.470 6.538 -1.279
86 HZ2 LYS 9 HZ2 LYS 9 17.887 4.985 -1.647
87 HZ3 LYS 9 HZ3 LYS 9 18.870 5.813 -2.759
88 H SER 10 HN SER 10 23.125 11.021 1.200
89 HA SER 10 HA SER 10 23.387 11.189 3.503
90 HB2 SER 10 HB2 SER 10 21.358 11.685 4.743
91 HB3 SER 10 HB1 SER 10 21.233 12.409 3.124
92 HG SER 10 HG SER 10 19.409 11.323 3.133
93 H LEU 11 HN LEU 11 23.033 8.396 2.172
94 HA LEU 11 HA LEU 11 23.082 6.204 2.901
95 HB2 LEU 11 HB2 LEU 11 24.817 7.251 4.450
96 HB3 LEU 11 HB1 LEU 11 23.542 7.343 5.681
97 HG LEU 11 HG LEU 11 23.205 4.764 5.169
98 HD11 LEU 11 HD11 LEU 11 26.027 5.281 4.119
99 HD12 LEU 11 HD12 LEU 11 24.669 4.543 3.237
100 HD13 LEU 11 HD13 LEU 11 25.423 3.679 4.595
101 HD21 LEU 11 HD21 LEU 11 24.925 4.206 6.869
102 HD22 LEU 11 HD22 LEU 11 24.029 5.678 7.314
103 HD23 LEU 11 HD23 LEU 11 25.670 5.805 6.638
104 H LEU 12 HN LEU 12 21.785 7.625 5.927
105 HA LEU 12 HA LEU 12 19.066 6.701 5.306
106 HB2 LEU 12 HB2 LEU 12 20.554 4.676 6.157
107 HB3 LEU 12 HB1 LEU 12 20.331 5.425 7.752
108 HG LEU 12 HG LEU 12 18.128 4.519 5.840
109 HD11 LEU 12 HD11 LEU 12 19.391 2.752 7.136
110 HD12 LEU 12 HD12 LEU 12 17.657 2.840 7.528
111 HD13 LEU 12 HD13 LEU 12 18.858 3.548 8.636
112 HD21 LEU 12 HD21 LEU 12 16.673 5.085 7.918
113 HD22 LEU 12 HD22 LEU 12 17.254 6.450 6.939
114 HD23 LEU 12 HD23 LEU 12 18.063 6.048 8.474
115 H LYS 13 HN LYS 13 21.069 7.210 8.257
116 HA LYS 13 HA LYS 13 19.010 8.807 9.517
117 HB2 LYS 13 HB2 LYS 13 20.805 7.495 10.715
118 HB3 LYS 13 HB1 LYS 13 21.976 8.726 10.183
119 HG2 LYS 13 HG2 LYS 13 20.710 10.482 11.339
120 HG3 LYS 13 HG1 LYS 13 19.458 9.305 11.804
121 HD2 LYS 13 HD2 LYS 13 21.151 8.019 13.089
122 HD3 LYS 13 HD1 LYS 13 22.389 9.219 12.645
123 HE2 LYS 13 HE2 LYS 13 21.542 9.751 14.872
124 HE3 LYS 13 HE1 LYS 13 20.980 10.997 13.730
125 HZ1 LYS 13 HZ1 LYS 13 19.333 9.837 15.384
126 HZ2 LYS 13 HZ2 LYS 13 19.291 8.634 14.185
127 HZ3 LYS 13 HZ3 LYS 13 18.844 10.230 13.808
Start of MODEL 4
1 H1 PHE 1 HT1 PHE 1 28.443 9.045 -11.458
2 H2 PHE 1 HT2 PHE 1 28.013 9.336 -9.840
3 H3 PHE 1 HT3 PHE 1 27.221 8.124 -10.730
4 HA PHE 1 HA PHE 1 28.612 6.740 -9.773
5 HB2 PHE 1 HB2 PHE 1 30.711 8.065 -11.524
6 HB3 PHE 1 HB1 PHE 1 30.601 6.354 -11.041
7 HD1 PHE 1 HD1 PHE 1 28.912 4.861 -12.041
8 HD2 PHE 1 HD2 PHE 1 29.258 8.987 -13.261
9 HE1 PHE 1 HE1 PHE 1 27.507 4.387 -14.044
10 HE2 PHE 1 HE2 PHE 1 27.853 8.513 -15.264
11 HZ PHE 1 HZ PHE 1 26.908 6.232 -15.607
12 H LEU 2 HN LEU 2 30.677 6.351 -8.558
13 HA LEU 2 HA LEU 2 31.927 6.905 -6.675
14 HB2 LEU 2 HB2 LEU 2 32.392 9.595 -8.005
15 HB3 LEU 2 HB1 LEU 2 33.494 8.669 -6.959
16 HG LEU 2 HG LEU 2 32.580 7.879 -9.761
17 HD11 LEU 2 HD11 LEU 2 35.278 8.768 -8.647
18 HD12 LEU 2 HD12 LEU 2 34.228 9.714 -9.729
19 HD13 LEU 2 HD13 LEU 2 34.985 8.212 -10.312
20 HD21 LEU 2 HD21 LEU 2 32.880 5.840 -8.544
21 HD22 LEU 2 HD22 LEU 2 34.287 6.479 -7.661
22 HD23 LEU 2 HD23 LEU 2 34.420 6.093 -9.394
23 HA PRO 3 HA PRO 3 28.603 9.686 -4.967
24 HB2 PRO 3 HB2 PRO 3 27.158 7.895 -3.536
25 HB3 PRO 3 HB1 PRO 3 26.947 8.060 -5.310
26 HG2 PRO 3 HG2 PRO 3 28.506 6.002 -3.762
27 HG3 PRO 3 HG1 PRO 3 27.430 5.785 -5.179
28 HD2 PRO 3 HD2 PRO 3 30.216 5.948 -5.349
29 HD3 PRO 3 HD1 PRO 3 29.105 6.355 -6.696
30 H ILE 4 HN ILE 4 29.086 10.831 -3.185
31 HA ILE 4 HA ILE 4 31.142 9.912 -1.362
32 HB ILE 4 HB ILE 4 29.224 12.233 -0.882
33 HG12 ILE 4 HG12 ILE 4 31.747 12.140 -2.603
34 HG13 ILE 4 HG11 ILE 4 30.087 12.389 -3.191
35 HG21 ILE 4 HG21 ILE 4 31.012 13.141 0.428
36 HG22 ILE 4 HG22 ILE 4 32.185 11.967 -0.217
37 HG23 ILE 4 HG23 ILE 4 30.906 11.430 0.897
38 HD11 ILE 4 HD1 ILE 4 30.981 14.584 -3.049
39 HD12 ILE 4 HD2 ILE 4 31.797 14.247 -1.505
40 HD13 ILE 4 HD3 ILE 4 30.025 14.419 -1.558
41 H VAL 5 HN VAL 5 27.625 9.891 -1.388
42 HA VAL 5 HA VAL 5 26.153 8.750 -0.038
43 HB VAL 5 HB VAL 5 28.314 7.882 1.914
44 HG11 VAL 5 HG11 VAL 5 26.845 5.872 2.066
45 HG12 VAL 5 HG12 VAL 5 25.750 6.604 0.869
46 HG13 VAL 5 HG13 VAL 5 25.979 7.373 2.457
47 HG21 VAL 5 HG21 VAL 5 28.345 5.741 0.272
48 HG22 VAL 5 HG22 VAL 5 29.444 7.102 -0.001
49 HG23 VAL 5 HG23 VAL 5 27.951 6.965 -0.955
50 H GLY 6 HN GLY 6 25.200 8.964 2.130
51 HA2 GLY 6 HA1 GLY 6 24.480 10.406 3.793
52 HA3 GLY 6 HA2 GLY 6 26.201 10.707 4.116
53 H LEU 7 HN LEU 7 25.642 11.430 0.911
54 HA LEU 7 HA LEU 7 24.622 14.132 1.305
55 HB2 LEU 7 HB2 LEU 7 27.434 13.567 0.379
56 HB3 LEU 7 HB1 LEU 7 26.614 15.104 0.035
57 HG LEU 7 HG LEU 7 27.110 13.973 2.830
58 HD11 LEU 7 HD11 LEU 7 29.195 14.616 1.660
59 HD12 LEU 7 HD12 LEU 7 28.827 15.738 2.993
60 HD13 LEU 7 HD13 LEU 7 28.502 16.218 1.311
61 HD21 LEU 7 HD21 LEU 7 26.617 16.555 3.309
62 HD22 LEU 7 HD22 LEU 7 25.267 15.420 3.115
63 HD23 LEU 7 HD23 LEU 7 25.746 16.469 1.759
64 H LEU 8 HN LEU 8 25.704 11.589 -0.528
65 HA LEU 8 HA LEU 8 24.256 12.581 -2.986
66 HB2 LEU 8 HB2 LEU 8 26.599 10.707 -2.583
67 HB3 LEU 8 HB1 LEU 8 25.601 10.559 -4.038
68 HG LEU 8 HG LEU 8 27.702 12.028 -4.215
69 HD11 LEU 8 HD11 LEU 8 26.693 13.546 -5.742
70 HD12 LEU 8 HD12 LEU 8 25.147 13.549 -4.872
71 HD13 LEU 8 HD13 LEU 8 25.658 12.104 -5.771
72 HD21 LEU 8 HD21 LEU 8 27.223 13.132 -1.936
73 HD22 LEU 8 HD22 LEU 8 26.019 14.123 -2.790
74 HD23 LEU 8 HD23 LEU 8 27.731 14.202 -3.258
75 H LYS 9 HN LYS 9 23.677 10.876 -0.294
76 HA LYS 9 HA LYS 9 21.497 9.394 -1.540
77 HB2 LYS 9 HB2 LYS 9 23.671 7.951 -1.793
78 HB3 LYS 9 HB1 LYS 9 23.500 7.668 -0.046
79 HG2 LYS 9 HG2 LYS 9 21.082 6.952 -0.536
80 HG3 LYS 9 HG1 LYS 9 21.524 6.970 -2.258
81 HD2 LYS 9 HD2 LYS 9 22.935 5.341 -0.097
82 HD3 LYS 9 HD1 LYS 9 21.750 4.696 -1.256
83 HE2 LYS 9 HE2 LYS 9 23.803 4.186 -2.296
84 HE3 LYS 9 HE1 LYS 9 23.366 5.723 -3.079
85 HZ1 LYS 9 HZ1 LYS 9 25.537 5.117 -1.278
86 HZ2 LYS 9 HZ2 LYS 9 24.681 6.519 -0.848
87 HZ3 LYS 9 HZ3 LYS 9 25.373 6.383 -2.394
88 H SER 10 HN SER 10 22.978 11.023 0.921
89 HA SER 10 HA SER 10 22.402 11.477 3.124
90 HB2 SER 10 HB2 SER 10 20.069 11.686 3.585
91 HB3 SER 10 HB1 SER 10 20.253 12.014 1.847
92 HG SER 10 HG SER 10 18.709 10.227 2.957
93 H LEU 11 HN LEU 11 22.901 8.507 2.092
94 HA LEU 11 HA LEU 11 23.201 6.480 3.172
95 HB2 LEU 11 HB2 LEU 11 23.951 8.233 5.019
96 HB3 LEU 11 HB1 LEU 11 22.462 7.723 5.840
97 HG LEU 11 HG LEU 11 24.723 5.885 4.919
98 HD11 LEU 11 HD11 LEU 11 23.808 6.760 7.696
99 HD12 LEU 11 HD12 LEU 11 25.299 7.285 6.877
100 HD13 LEU 11 HD13 LEU 11 25.096 5.581 7.352
101 HD21 LEU 11 HD21 LEU 11 22.717 4.600 4.792
102 HD22 LEU 11 HD22 LEU 11 22.022 5.378 6.235
103 HD23 LEU 11 HD23 LEU 11 23.372 4.230 6.402
104 H LEU 12 HN LEU 12 21.706 5.009 2.686
105 HA LEU 12 HA LEU 12 18.942 5.275 2.764
106 HB2 LEU 12 HB2 LEU 12 20.514 2.741 3.370
107 HB3 LEU 12 HB1 LEU 12 18.828 2.811 2.813
108 HG LEU 12 HG LEU 12 21.090 4.091 1.217
109 HD11 LEU 12 HD11 LEU 12 21.661 1.711 1.533
110 HD12 LEU 12 HD12 LEU 12 21.154 2.015 -0.146
111 HD13 LEU 12 HD13 LEU 12 20.032 1.238 0.998
112 HD21 LEU 12 HD21 LEU 12 18.900 4.805 0.488
113 HD22 LEU 12 HD22 LEU 12 18.253 3.150 0.586
114 HD23 LEU 12 HD23 LEU 12 19.436 3.572 -0.672
115 H LYS 13 HN LYS 13 17.348 5.273 4.212
116 HA LYS 13 HA LYS 13 17.789 5.740 6.939
117 HB2 LYS 13 HB2 LYS 13 15.640 6.062 5.627
118 HB3 LYS 13 HB1 LYS 13 15.352 4.315 5.810
119 HG2 LYS 13 HG2 LYS 13 15.518 4.583 8.294
120 HG3 LYS 13 HG1 LYS 13 15.692 6.340 8.065
121 HD2 LYS 13 HD2 LYS 13 13.492 6.362 6.864
122 HD3 LYS 13 HD1 LYS 13 13.310 4.628 7.228
123 HE2 LYS 13 HE2 LYS 13 12.098 5.855 8.927
124 HE3 LYS 13 HE1 LYS 13 13.572 5.207 9.685
125 HZ1 LYS 13 HZ1 LYS 13 14.036 7.284 10.266
126 HZ2 LYS 13 HZ2 LYS 13 12.767 7.917 9.330
127 HZ3 LYS 13 HZ3 LYS 13 14.291 7.648 8.629
Start of MODEL 5
1 H1 PHE 1 HT1 PHE 1 33.128 5.168 -11.775
2 H2 PHE 1 HT2 PHE 1 33.693 6.495 -10.875
3 H3 PHE 1 HT3 PHE 1 32.135 6.524 -11.554
4 HA PHE 1 HA PHE 1 31.248 5.531 -9.845
5 HB2 PHE 1 HB2 PHE 1 32.152 3.406 -10.853
6 HB3 PHE 1 HB1 PHE 1 33.593 3.592 -9.827
7 HD1 PHE 1 HD1 PHE 1 33.565 2.789 -7.590
8 HD2 PHE 1 HD2 PHE 1 29.836 3.433 -9.669
9 HE1 PHE 1 HE1 PHE 1 32.327 1.753 -5.692
10 HE2 PHE 1 HE2 PHE 1 28.600 2.396 -7.770
11 HZ PHE 1 HZ PHE 1 29.842 1.599 -5.762
12 H LEU 2 HN LEU 2 31.422 7.193 -8.406
13 HA LEU 2 HA LEU 2 33.252 6.785 -6.180
14 HB2 LEU 2 HB2 LEU 2 34.698 7.944 -7.934
15 HB3 LEU 2 HB1 LEU 2 33.612 9.341 -7.781
16 HG LEU 2 HG LEU 2 34.110 9.123 -5.183
17 HD11 LEU 2 HD11 LEU 2 36.479 8.329 -4.797
18 HD12 LEU 2 HD12 LEU 2 36.470 7.640 -6.435
19 HD13 LEU 2 HD13 LEU 2 35.347 7.022 -5.200
20 HD21 LEU 2 HD21 LEU 2 36.108 10.584 -5.453
21 HD22 LEU 2 HD22 LEU 2 34.801 11.038 -6.571
22 HD23 LEU 2 HD23 LEU 2 36.204 10.120 -7.169
23 HA PRO 3 HA PRO 3 29.353 9.178 -5.372
24 HB2 PRO 3 HB2 PRO 3 28.024 7.390 -3.817
25 HB3 PRO 3 HB1 PRO 3 28.029 7.259 -5.605
26 HG2 PRO 3 HG2 PRO 3 29.653 5.740 -3.580
27 HG3 PRO 3 HG1 PRO 3 28.848 5.150 -5.066
28 HD2 PRO 3 HD2 PRO 3 31.571 5.777 -4.899
29 HD3 PRO 3 HD1 PRO 3 30.631 5.776 -6.428
30 H ILE 4 HN ILE 4 28.948 10.440 -3.559
31 HA ILE 4 HA ILE 4 31.026 10.344 -1.477
32 HB ILE 4 HB ILE 4 28.628 12.211 -1.793
33 HG12 ILE 4 HG12 ILE 4 30.438 13.836 -2.520
34 HG13 ILE 4 HG11 ILE 4 31.585 12.480 -2.533
35 HG21 ILE 4 HG21 ILE 4 30.050 13.648 -0.223
36 HG22 ILE 4 HG22 ILE 4 31.044 12.200 0.062
37 HG23 ILE 4 HG23 ILE 4 29.325 12.206 0.516
38 HD11 ILE 4 HD1 ILE 4 30.284 13.234 -4.766
39 HD12 ILE 4 HD2 ILE 4 29.018 12.172 -4.110
40 HD13 ILE 4 HD3 ILE 4 30.642 11.523 -4.449
41 H VAL 5 HN VAL 5 27.436 10.046 -1.623
42 HA VAL 5 HA VAL 5 26.006 8.894 -0.231
43 HB VAL 5 HB VAL 5 28.283 7.853 1.498
44 HG11 VAL 5 HG11 VAL 5 26.002 7.346 2.219
45 HG12 VAL 5 HG12 VAL 5 26.765 5.862 1.622
46 HG13 VAL 5 HG13 VAL 5 25.591 6.728 0.604
47 HG21 VAL 5 HG21 VAL 5 27.604 7.082 -1.364
48 HG22 VAL 5 HG22 VAL 5 28.176 5.831 -0.236
49 HG23 VAL 5 HG23 VAL 5 29.201 7.231 -0.594
50 H GLY 6 HN GLY 6 25.220 8.954 2.062
51 HA2 GLY 6 HA1 GLY 6 24.658 10.317 3.855
52 HA3 GLY 6 HA2 GLY 6 26.407 10.575 4.052
53 H LEU 7 HN LEU 7 25.342 11.379 0.963
54 HA LEU 7 HA LEU 7 24.448 14.058 1.484
55 HB2 LEU 7 HB2 LEU 7 27.112 13.909 1.714
56 HB3 LEU 7 HB1 LEU 7 27.023 13.983 -0.051
57 HG LEU 7 HG LEU 7 27.310 16.234 0.709
58 HD11 LEU 7 HD11 LEU 7 25.498 15.761 -1.040
59 HD12 LEU 7 HD12 LEU 7 25.430 17.342 -0.229
60 HD13 LEU 7 HD13 LEU 7 24.310 16.050 0.253
61 HD21 LEU 7 HD21 LEU 7 24.853 16.082 2.504
62 HD22 LEU 7 HD22 LEU 7 26.156 17.286 2.489
63 HD23 LEU 7 HD23 LEU 7 26.468 15.652 3.109
64 H LEU 8 HN LEU 8 25.571 11.613 -0.451
65 HA LEU 8 HA LEU 8 24.085 12.605 -2.869
66 HB2 LEU 8 HB2 LEU 8 26.586 11.793 -2.907
67 HB3 LEU 8 HB1 LEU 8 25.890 10.164 -2.808
68 HG LEU 8 HG LEU 8 24.360 11.004 -4.827
69 HD11 LEU 8 HD11 LEU 8 25.058 13.351 -4.845
70 HD12 LEU 8 HD12 LEU 8 25.650 12.566 -6.324
71 HD13 LEU 8 HD13 LEU 8 26.768 12.878 -4.978
72 HD21 LEU 8 HD21 LEU 8 27.326 10.389 -5.191
73 HD22 LEU 8 HD22 LEU 8 26.065 10.196 -6.431
74 HD23 LEU 8 HD23 LEU 8 26.038 9.183 -4.968
75 H LYS 9 HN LYS 9 23.527 10.893 -0.146
76 HA LYS 9 HA LYS 9 21.229 9.534 -1.316
77 HB2 LYS 9 HB2 LYS 9 23.199 7.934 -1.692
78 HB3 LYS 9 HB1 LYS 9 23.280 7.783 0.079
79 HG2 LYS 9 HG2 LYS 9 20.996 6.926 0.164
80 HG3 LYS 9 HG1 LYS 9 20.776 7.229 -1.575
81 HD2 LYS 9 HD2 LYS 9 22.496 5.580 -2.123
82 HD3 LYS 9 HD1 LYS 9 22.862 5.343 -0.397
83 HE2 LYS 9 HE2 LYS 9 20.503 4.577 -0.040
84 HE3 LYS 9 HE1 LYS 9 20.224 4.714 -1.792
85 HZ1 LYS 9 HZ1 LYS 9 22.014 2.857 -0.342
86 HZ2 LYS 9 HZ2 LYS 9 22.263 3.206 -1.986
87 HZ3 LYS 9 HZ3 LYS 9 20.804 2.500 -1.476
88 H SER 10 HN SER 10 22.952 10.976 1.106
89 HA SER 10 HA SER 10 22.568 11.340 3.385
90 HB2 SER 10 HB2 SER 10 19.700 11.187 2.380
91 HB3 SER 10 HB1 SER 10 20.225 11.929 3.908
92 HG SER 10 HG SER 10 20.749 13.631 2.802
93 H LEU 11 HN LEU 11 23.333 8.839 3.290
94 HA LEU 11 HA LEU 11 21.431 6.843 4.022
95 HB2 LEU 11 HB2 LEU 11 23.990 6.713 3.336
96 HB3 LEU 11 HB1 LEU 11 24.269 6.803 5.089
97 HG LEU 11 HG LEU 11 22.570 4.736 3.616
98 HD11 LEU 11 HD11 LEU 11 24.293 3.160 4.470
99 HD12 LEU 11 HD12 LEU 11 25.183 4.529 5.179
100 HD13 LEU 11 HD13 LEU 11 25.008 4.400 3.413
101 HD21 LEU 11 HD21 LEU 11 21.474 5.078 5.708
102 HD22 LEU 11 HD22 LEU 11 23.014 5.299 6.576
103 HD23 LEU 11 HD23 LEU 11 22.542 3.686 5.992
104 H LEU 12 HN LEU 12 23.808 8.482 6.180
105 HA LEU 12 HA LEU 12 22.634 7.604 8.606
106 HB2 LEU 12 HB2 LEU 12 24.029 10.269 8.143
107 HB3 LEU 12 HB1 LEU 12 23.886 9.389 9.680
108 HG LEU 12 HG LEU 12 25.298 8.295 7.204
109 HD11 LEU 12 HD11 LEU 12 26.450 10.298 8.075
110 HD12 LEU 12 HD12 LEU 12 27.393 8.830 8.420
111 HD13 LEU 12 HD13 LEU 12 26.443 9.601 9.711
112 HD21 LEU 12 HD21 LEU 12 24.983 7.352 10.085
113 HD22 LEU 12 HD22 LEU 12 26.337 6.803 9.071
114 HD23 LEU 12 HD23 LEU 12 24.666 6.453 8.583
115 H LYS 13 HN LYS 13 20.631 7.874 9.301
116 HA LYS 13 HA LYS 13 18.875 9.913 8.274
117 HB2 LYS 13 HB2 LYS 13 17.341 9.154 10.075
118 HB3 LYS 13 HB1 LYS 13 18.028 7.790 9.161
119 HG2 LYS 13 HG2 LYS 13 19.820 7.612 10.953
120 HG3 LYS 13 HG1 LYS 13 18.899 8.807 11.898
121 HD2 LYS 13 HD2 LYS 13 16.911 7.314 11.833
122 HD3 LYS 13 HD1 LYS 13 17.855 6.112 10.920
123 HE2 LYS 13 HE2 LYS 13 18.664 7.169 13.661
124 HE3 LYS 13 HE1 LYS 13 17.742 5.666 13.410
125 HZ1 LYS 13 HZ1 LYS 13 19.987 5.720 11.691
126 HZ2 LYS 13 HZ2 LYS 13 19.611 4.610 12.920
127 HZ3 LYS 13 HZ3 LYS 13 20.499 6.013 13.280
Start of MODEL 6
1 H1 PHE 1 HT1 PHE 1 36.043 5.462 -5.408
2 H2 PHE 1 HT2 PHE 1 35.211 4.070 -5.919
3 H3 PHE 1 HT3 PHE 1 35.938 4.116 -4.383
4 HA PHE 1 HA PHE 1 33.421 4.449 -4.622
5 HB2 PHE 1 HB2 PHE 1 35.135 6.334 -2.955
6 HB3 PHE 1 HB1 PHE 1 33.458 5.840 -2.615
7 HD1 PHE 1 HD1 PHE 1 32.937 3.594 -1.799
8 HD2 PHE 1 HD2 PHE 1 36.998 4.734 -2.716
9 HE1 PHE 1 HE1 PHE 1 33.772 1.565 -0.621
10 HE2 PHE 1 HE2 PHE 1 37.833 2.703 -1.537
11 HZ PHE 1 HZ PHE 1 36.214 1.069 -0.580
12 H LEU 2 HN LEU 2 32.566 5.334 -6.478
13 HA LEU 2 HA LEU 2 33.237 8.056 -7.296
14 HB2 LEU 2 HB2 LEU 2 30.800 6.515 -8.232
15 HB3 LEU 2 HB1 LEU 2 31.795 7.689 -9.123
16 HG LEU 2 HG LEU 2 32.626 4.884 -8.253
17 HD11 LEU 2 HD11 LEU 2 32.214 6.164 -10.993
18 HD12 LEU 2 HD12 LEU 2 31.132 4.977 -10.225
19 HD13 LEU 2 HD13 LEU 2 32.782 4.504 -10.699
20 HD21 LEU 2 HD21 LEU 2 34.583 6.269 -8.062
21 HD22 LEU 2 HD22 LEU 2 34.173 7.175 -9.538
22 HD23 LEU 2 HD23 LEU 2 34.704 5.479 -9.651
23 HA PRO 3 HA PRO 3 29.058 9.108 -5.314
24 HB2 PRO 3 HB2 PRO 3 27.750 7.396 -3.691
25 HB3 PRO 3 HB1 PRO 3 27.729 7.181 -5.471
26 HG2 PRO 3 HG2 PRO 3 29.295 5.693 -3.389
27 HG3 PRO 3 HG1 PRO 3 28.565 5.097 -4.910
28 HD2 PRO 3 HD2 PRO 3 31.299 5.848 -4.533
29 HD3 PRO 3 HD1 PRO 3 30.496 5.548 -6.108
30 H ILE 4 HN ILE 4 28.837 10.467 -3.565
31 HA ILE 4 HA ILE 4 30.962 10.377 -1.557
32 HB ILE 4 HB ILE 4 28.512 12.186 -1.551
33 HG12 ILE 4 HG12 ILE 4 29.393 12.444 -3.759
34 HG13 ILE 4 HG11 ILE 4 30.051 13.805 -2.831
35 HG21 ILE 4 HG21 ILE 4 30.299 13.768 -0.529
36 HG22 ILE 4 HG22 ILE 4 31.284 12.306 -0.304
37 HG23 ILE 4 HG23 ILE 4 29.698 12.438 0.480
38 HD11 ILE 4 HD1 ILE 4 31.879 12.929 -4.105
39 HD12 ILE 4 HD2 ILE 4 31.471 11.251 -3.685
40 HD13 ILE 4 HD3 ILE 4 32.140 12.342 -2.450
41 H VAL 5 HN VAL 5 27.385 10.035 -1.531
42 HA VAL 5 HA VAL 5 26.043 8.851 -0.075
43 HB VAL 5 HB VAL 5 28.376 8.021 1.691
44 HG11 VAL 5 HG11 VAL 5 25.762 6.693 0.848
45 HG12 VAL 5 HG12 VAL 5 26.110 7.444 2.421
46 HG13 VAL 5 HG13 VAL 5 26.970 5.971 1.934
47 HG21 VAL 5 HG21 VAL 5 28.318 5.894 0.025
48 HG22 VAL 5 HG22 VAL 5 29.367 7.282 -0.312
49 HG23 VAL 5 HG23 VAL 5 27.806 7.126 -1.151
50 H GLY 6 HN GLY 6 25.266 9.014 2.194
51 HA2 GLY 6 HA1 GLY 6 24.602 10.480 3.865
52 HA3 GLY 6 HA2 GLY 6 26.343 10.699 4.152
53 H LEU 7 HN LEU 7 25.362 11.480 0.994
54 HA LEU 7 HA LEU 7 24.575 14.209 1.477
55 HB2 LEU 7 HB2 LEU 7 27.096 14.237 1.856
56 HB3 LEU 7 HB1 LEU 7 27.245 13.768 0.147
57 HG LEU 7 HG LEU 7 25.700 15.877 -0.302
58 HD11 LEU 7 HD11 LEU 7 25.140 16.398 2.029
59 HD12 LEU 7 HD12 LEU 7 26.140 17.707 1.364
60 HD13 LEU 7 HD13 LEU 7 26.865 16.502 2.453
61 HD21 LEU 7 HD21 LEU 7 27.746 17.345 -0.344
62 HD22 LEU 7 HD22 LEU 7 28.011 15.745 -1.075
63 HD23 LEU 7 HD23 LEU 7 28.619 16.087 0.563
64 H LEU 8 HN LEU 8 25.537 11.661 -0.411
65 HA LEU 8 HA LEU 8 24.059 12.726 -2.815
66 HB2 LEU 8 HB2 LEU 8 26.603 12.087 -2.933
67 HB3 LEU 8 HB1 LEU 8 26.022 10.411 -2.887
68 HG LEU 8 HG LEU 8 24.401 11.219 -4.845
69 HD11 LEU 8 HD11 LEU 8 26.667 13.263 -4.962
70 HD12 LEU 8 HD12 LEU 8 24.931 13.607 -4.781
71 HD13 LEU 8 HD13 LEU 8 25.548 12.922 -6.301
72 HD21 LEU 8 HD21 LEU 8 27.395 10.801 -5.249
73 HD22 LEU 8 HD22 LEU 8 26.154 10.626 -6.512
74 HD23 LEU 8 HD23 LEU 8 26.166 9.521 -5.116
75 H LYS 9 HN LYS 9 23.738 10.771 -0.174
76 HA LYS 9 HA LYS 9 21.522 9.292 -1.443
77 HB2 LYS 9 HB2 LYS 9 23.871 7.870 -0.139
78 HB3 LYS 9 HB1 LYS 9 22.307 7.100 -0.499
79 HG2 LYS 9 HG2 LYS 9 22.653 7.856 -2.932
80 HG3 LYS 9 HG1 LYS 9 24.326 8.250 -2.468
81 HD2 LYS 9 HD2 LYS 9 24.624 5.900 -1.664
82 HD3 LYS 9 HD1 LYS 9 22.983 5.522 -2.241
83 HE2 LYS 9 HE2 LYS 9 25.204 6.630 -4.012
84 HE3 LYS 9 HE1 LYS 9 24.799 4.901 -3.880
85 HZ1 LYS 9 HZ1 LYS 9 23.637 5.779 -5.737
86 HZ2 LYS 9 HZ2 LYS 9 23.048 7.102 -4.848
87 HZ3 LYS 9 HZ3 LYS 9 22.485 5.534 -4.515
88 H SER 10 HN SER 10 22.933 10.934 1.052
89 HA SER 10 HA SER 10 22.411 11.210 3.321
90 HB2 SER 10 HB2 SER 10 20.597 12.432 2.284
91 HB3 SER 10 HB1 SER 10 19.672 10.934 2.027
92 HG SER 10 HG SER 10 18.867 11.568 3.903
93 H LEU 11 HN LEU 11 23.390 9.104 3.882
94 HA LEU 11 HA LEU 11 21.745 6.757 4.157
95 HB2 LEU 11 HB2 LEU 11 24.303 6.898 4.102
96 HB3 LEU 11 HB1 LEU 11 24.212 7.439 5.792
97 HG LEU 11 HG LEU 11 22.731 5.280 6.152
98 HD11 LEU 11 HD11 LEU 11 23.522 3.400 4.624
99 HD12 LEU 11 HD12 LEU 11 24.174 4.645 3.536
100 HD13 LEU 11 HD13 LEU 11 22.427 4.566 3.854
101 HD21 LEU 11 HD21 LEU 11 24.780 3.937 6.569
102 HD22 LEU 11 HD22 LEU 11 24.976 5.615 7.129
103 HD23 LEU 11 HD23 LEU 11 25.728 5.093 5.602
104 H LEU 12 HN LEU 12 19.912 6.847 5.320
105 HA LEU 12 HA LEU 12 19.712 8.448 7.755
106 HB2 LEU 12 HB2 LEU 12 17.812 6.243 6.886
107 HB3 LEU 12 HB1 LEU 12 17.457 7.695 7.853
108 HG LEU 12 HG LEU 12 18.259 7.634 4.909
109 HD11 LEU 12 HD11 LEU 12 15.958 8.518 4.574
110 HD12 LEU 12 HD12 LEU 12 15.657 8.374 6.323
111 HD13 LEU 12 HD13 LEU 12 15.937 6.914 5.342
112 HD21 LEU 12 HD21 LEU 12 19.182 9.649 5.804
113 HD22 LEU 12 HD22 LEU 12 17.791 9.907 6.884
114 HD23 LEU 12 HD23 LEU 12 17.613 10.140 5.129
115 H LYS 13 HN LYS 13 18.197 6.740 9.398
116 HA LYS 13 HA LYS 13 18.568 5.343 11.212
117 HB2 LYS 13 HB2 LYS 13 20.047 3.767 9.069
118 HB3 LYS 13 HB1 LYS 13 19.620 3.135 10.678
119 HG2 LYS 13 HG2 LYS 13 17.258 3.393 10.239
120 HG3 LYS 13 HG1 LYS 13 17.578 4.289 8.735
121 HD2 LYS 13 HD2 LYS 13 18.622 2.292 7.740
122 HD3 LYS 13 HD1 LYS 13 18.369 1.389 9.253
123 HE2 LYS 13 HE2 LYS 13 16.107 2.660 7.657
124 HE3 LYS 13 HE1 LYS 13 16.616 0.966 7.462
125 HZ1 LYS 13 HZ1 LYS 13 16.226 1.728 10.209
126 HZ2 LYS 13 HZ2 LYS 13 15.622 0.389 9.356
127 HZ3 LYS 13 HZ3 LYS 13 14.815 1.882 9.281
Start of MODEL 7
1 H1 PHE 1 HT1 PHE 1 30.608 7.526 -11.278
2 H2 PHE 1 HT2 PHE 1 31.390 8.843 -12.016
3 H3 PHE 1 HT3 PHE 1 30.606 9.044 -10.522
4 HA PHE 1 HA PHE 1 32.314 7.029 -10.025
5 HB2 PHE 1 HB2 PHE 1 33.630 9.093 -11.835
6 HB3 PHE 1 HB1 PHE 1 34.503 7.897 -10.846
7 HD1 PHE 1 HD1 PHE 1 32.446 8.435 -13.852
8 HD2 PHE 1 HD2 PHE 1 34.296 5.465 -11.326
9 HE1 PHE 1 HE1 PHE 1 32.141 6.725 -15.639
10 HE2 PHE 1 HE2 PHE 1 33.991 3.755 -13.112
11 HZ PHE 1 HZ PHE 1 32.995 4.409 -15.301
12 H LEU 2 HN LEU 2 30.741 8.724 -8.597
13 HA LEU 2 HA LEU 2 32.725 9.954 -6.820
14 HB2 LEU 2 HB2 LEU 2 31.207 12.186 -6.931
15 HB3 LEU 2 HB1 LEU 2 32.614 11.956 -7.986
16 HG LEU 2 HG LEU 2 31.150 11.118 -9.795
17 HD11 LEU 2 HD11 LEU 2 28.664 11.356 -9.519
18 HD12 LEU 2 HD12 LEU 2 28.921 11.682 -7.789
19 HD13 LEU 2 HD13 LEU 2 29.359 10.098 -8.472
20 HD21 LEU 2 HD21 LEU 2 30.273 13.755 -8.542
21 HD22 LEU 2 HD22 LEU 2 29.924 13.264 -10.215
22 HD23 LEU 2 HD23 LEU 2 31.607 13.519 -9.695
23 HA PRO 3 HA PRO 3 28.757 8.384 -4.922
24 HB2 PRO 3 HB2 PRO 3 29.653 6.109 -3.744
25 HB3 PRO 3 HB1 PRO 3 29.229 6.154 -5.486
26 HG2 PRO 3 HG2 PRO 3 31.940 6.312 -4.183
27 HG3 PRO 3 HG1 PRO 3 31.423 5.370 -5.617
28 HD2 PRO 3 HD2 PRO 3 32.725 7.825 -5.781
29 HD3 PRO 3 HD1 PRO 3 31.622 7.201 -7.050
30 H ILE 4 HN ILE 4 29.032 10.300 -3.614
31 HA ILE 4 HA ILE 4 30.971 10.313 -1.435
32 HB ILE 4 HB ILE 4 28.477 12.050 -1.631
33 HG12 ILE 4 HG12 ILE 4 31.178 12.376 -3.018
34 HG13 ILE 4 HG11 ILE 4 29.611 12.103 -3.814
35 HG21 ILE 4 HG21 ILE 4 30.000 12.020 0.447
36 HG22 ILE 4 HG22 ILE 4 29.737 13.604 -0.319
37 HG23 ILE 4 HG23 ILE 4 31.259 12.723 -0.596
38 HD11 ILE 4 HD1 ILE 4 30.565 14.564 -2.313
39 HD12 ILE 4 HD2 ILE 4 28.831 14.265 -2.591
40 HD13 ILE 4 HD3 ILE 4 29.938 14.450 -3.973
41 H VAL 5 HN VAL 5 27.391 9.935 -1.624
42 HA VAL 5 HA VAL 5 25.956 8.814 -0.209
43 HB VAL 5 HB VAL 5 28.226 7.806 1.548
44 HG11 VAL 5 HG11 VAL 5 25.921 7.316 2.230
45 HG12 VAL 5 HG12 VAL 5 26.721 5.822 1.706
46 HG13 VAL 5 HG13 VAL 5 25.563 6.636 0.627
47 HG21 VAL 5 HG21 VAL 5 28.148 5.756 -0.153
48 HG22 VAL 5 HG22 VAL 5 29.169 7.156 -0.524
49 HG23 VAL 5 HG23 VAL 5 27.582 6.984 -1.309
50 H GLY 6 HN GLY 6 25.168 8.934 2.081
51 HA2 GLY 6 HA1 GLY 6 24.589 10.368 3.815
52 HA3 GLY 6 HA2 GLY 6 26.341 10.551 4.064
53 H LEU 7 HN LEU 7 25.334 11.362 0.941
54 HA LEU 7 HA LEU 7 24.609 14.108 1.429
55 HB2 LEU 7 HB2 LEU 7 27.290 13.720 1.575
56 HB3 LEU 7 HB1 LEU 7 27.121 13.912 -0.181
57 HG LEU 7 HG LEU 7 26.115 15.892 1.921
58 HD11 LEU 7 HD11 LEU 7 28.502 15.999 0.023
59 HD12 LEU 7 HD12 LEU 7 28.580 15.812 1.791
60 HD13 LEU 7 HD13 LEU 7 27.965 17.324 1.083
61 HD21 LEU 7 HD21 LEU 7 26.069 15.840 -1.124
62 HD22 LEU 7 HD22 LEU 7 25.968 17.368 -0.212
63 HD23 LEU 7 HD23 LEU 7 24.720 16.122 0.001
64 H LEU 8 HN LEU 8 25.568 11.570 -0.476
65 HA LEU 8 HA LEU 8 24.071 12.583 -2.882
66 HB2 LEU 8 HB2 LEU 8 26.559 11.755 -2.979
67 HB3 LEU 8 HB1 LEU 8 25.860 10.130 -2.835
68 HG LEU 8 HG LEU 8 24.282 10.949 -4.830
69 HD11 LEU 8 HD11 LEU 8 25.016 13.289 -4.889
70 HD12 LEU 8 HD12 LEU 8 25.530 12.475 -6.382
71 HD13 LEU 8 HD13 LEU 8 26.710 12.783 -5.089
72 HD21 LEU 8 HD21 LEU 8 25.913 9.104 -5.001
73 HD22 LEU 8 HD22 LEU 8 27.232 10.276 -5.230
74 HD23 LEU 8 HD23 LEU 8 25.962 10.115 -6.465
75 H LYS 9 HN LYS 9 23.662 10.772 -0.152
76 HA LYS 9 HA LYS 9 21.303 9.413 -1.298
77 HB2 LYS 9 HB2 LYS 9 23.592 7.873 -0.013
78 HB3 LYS 9 HB1 LYS 9 21.964 7.208 -0.275
79 HG2 LYS 9 HG2 LYS 9 22.256 7.824 -2.753
80 HG3 LYS 9 HG1 LYS 9 23.970 8.119 -2.376
81 HD2 LYS 9 HD2 LYS 9 24.143 5.794 -1.473
82 HD3 LYS 9 HD1 LYS 9 22.455 5.506 -1.960
83 HE2 LYS 9 HE2 LYS 9 22.983 5.795 -4.290
84 HE3 LYS 9 HE1 LYS 9 24.605 6.422 -3.911
85 HZ1 LYS 9 HZ1 LYS 9 25.121 4.267 -4.343
86 HZ2 LYS 9 HZ2 LYS 9 23.605 3.669 -3.864
87 HZ3 LYS 9 HZ3 LYS 9 24.760 4.098 -2.694
88 H SER 10 HN SER 10 22.898 11.073 1.070
89 HA SER 10 HA SER 10 22.417 11.590 3.287
90 HB2 SER 10 HB2 SER 10 19.602 11.014 2.291
91 HB3 SER 10 HB1 SER 10 20.011 11.911 3.770
92 HG SER 10 HG SER 10 21.384 13.176 2.137
93 H LEU 11 HN LEU 11 23.351 9.007 3.111
94 HA LEU 11 HA LEU 11 21.834 7.715 5.347
95 HB2 LEU 11 HB2 LEU 11 22.561 6.464 2.678
96 HB3 LEU 11 HB1 LEU 11 22.384 5.461 4.134
97 HG LEU 11 HG LEU 11 20.183 7.425 3.379
98 HD11 LEU 11 HD11 LEU 11 19.078 5.604 2.092
99 HD12 LEU 11 HD12 LEU 11 20.545 4.608 2.264
100 HD13 LEU 11 HD13 LEU 11 20.600 6.123 1.332
101 HD21 LEU 11 HD21 LEU 11 20.260 4.726 4.817
102 HD22 LEU 11 HD22 LEU 11 18.778 5.640 4.467
103 HD23 LEU 11 HD23 LEU 11 19.996 6.317 5.566
104 H LEU 12 HN LEU 12 23.228 7.644 6.970
105 HA LEU 12 HA LEU 12 26.097 7.747 6.542
106 HB2 LEU 12 HB2 LEU 12 24.737 6.892 9.119
107 HB3 LEU 12 HB1 LEU 12 26.279 7.757 8.907
108 HG LEU 12 HG LEU 12 23.485 8.837 8.326
109 HD11 LEU 12 HD11 LEU 12 23.931 10.346 10.173
110 HD12 LEU 12 HD12 LEU 12 25.606 9.760 10.311
111 HD13 LEU 12 HD13 LEU 12 24.249 8.689 10.737
112 HD21 LEU 12 HD21 LEU 12 26.269 9.964 7.806
113 HD22 LEU 12 HD22 LEU 12 24.834 11.009 7.948
114 HD23 LEU 12 HD23 LEU 12 24.921 9.789 6.657
115 H LYS 13 HN LYS 13 27.564 6.172 6.354
116 HA LYS 13 HA LYS 13 26.646 3.444 5.967
117 HB2 LYS 13 HB2 LYS 13 29.491 4.472 6.300
118 HB3 LYS 13 HB1 LYS 13 28.987 2.934 5.554
119 HG2 LYS 13 HG2 LYS 13 27.611 4.367 3.903
120 HG3 LYS 13 HG1 LYS 13 28.522 5.763 4.529
121 HD2 LYS 13 HD2 LYS 13 29.708 3.263 3.243
122 HD3 LYS 13 HD1 LYS 13 29.620 4.883 2.513
123 HE2 LYS 13 HE2 LYS 13 30.955 5.685 4.595
124 HE3 LYS 13 HE1 LYS 13 31.299 3.959 4.870
125 HZ1 LYS 13 HZ1 LYS 13 33.046 4.842 3.556
126 HZ2 LYS 13 HZ2 LYS 13 31.969 5.581 2.469
127 HZ3 LYS 13 HZ3 LYS 13 32.100 3.887 2.522
Start of MODEL 8
1 H1 PHE 1 HT1 PHE 1 35.499 9.442 -10.573
2 H2 PHE 1 HT2 PHE 1 35.155 7.782 -10.450
3 H3 PHE 1 HT3 PHE 1 35.327 8.725 -9.047
4 HA PHE 1 HA PHE 1 33.412 10.078 -9.888
5 HB2 PHE 1 HB2 PHE 1 33.127 7.573 -11.597
6 HB3 PHE 1 HB1 PHE 1 31.902 8.854 -11.421
7 HD1 PHE 1 HD1 PHE 1 32.214 11.053 -12.441
8 HD2 PHE 1 HD2 PHE 1 35.243 7.998 -12.791
9 HE1 PHE 1 HE1 PHE 1 33.340 12.374 -14.229
10 HE2 PHE 1 HE2 PHE 1 36.369 9.320 -14.580
11 HZ PHE 1 HZ PHE 1 35.400 11.492 -15.320
12 H LEU 2 HN LEU 2 34.487 8.337 -7.770
13 HA LEU 2 HA LEU 2 32.479 6.359 -7.120
14 HB2 LEU 2 HB2 LEU 2 34.692 7.746 -5.574
15 HB3 LEU 2 HB1 LEU 2 33.564 6.640 -4.758
16 HG LEU 2 HG LEU 2 34.187 4.818 -6.270
17 HD11 LEU 2 HD11 LEU 2 36.196 5.275 -7.844
18 HD12 LEU 2 HD12 LEU 2 35.809 7.001 -7.636
19 HD13 LEU 2 HD13 LEU 2 34.610 5.897 -8.353
20 HD21 LEU 2 HD21 LEU 2 36.478 4.484 -5.517
21 HD22 LEU 2 HD22 LEU 2 35.587 5.331 -4.228
22 HD23 LEU 2 HD23 LEU 2 36.701 6.235 -5.283
23 HA PRO 3 HA PRO 3 29.402 9.071 -5.405
24 HB2 PRO 3 HB2 PRO 3 28.023 7.425 -3.731
25 HB3 PRO 3 HB1 PRO 3 28.014 7.182 -5.509
26 HG2 PRO 3 HG2 PRO 3 29.674 5.789 -3.414
27 HG3 PRO 3 HG1 PRO 3 28.754 5.086 -4.781
28 HD2 PRO 3 HD2 PRO 3 31.466 5.551 -4.909
29 HD3 PRO 3 HD1 PRO 3 30.397 5.640 -6.348
30 H ILE 4 HN ILE 4 28.921 10.377 -3.602
31 HA ILE 4 HA ILE 4 31.039 10.432 -1.556
32 HB ILE 4 HB ILE 4 28.544 12.177 -1.620
33 HG12 ILE 4 HG12 ILE 4 31.161 12.497 -3.159
34 HG13 ILE 4 HG11 ILE 4 29.550 12.230 -3.863
35 HG21 ILE 4 HG21 ILE 4 30.187 12.135 0.365
36 HG22 ILE 4 HG22 ILE 4 29.877 13.722 -0.375
37 HG23 ILE 4 HG23 ILE 4 31.382 12.845 -0.746
38 HD11 ILE 4 HD1 ILE 4 29.878 14.576 -4.036
39 HD12 ILE 4 HD2 ILE 4 30.593 14.685 -2.411
40 HD13 ILE 4 HD3 ILE 4 28.846 14.391 -2.599
41 H VAL 5 HN VAL 5 27.450 10.079 -1.587
42 HA VAL 5 HA VAL 5 26.087 8.888 -0.162
43 HB VAL 5 HB VAL 5 28.410 7.965 1.573
44 HG11 VAL 5 HG11 VAL 5 26.962 5.931 1.758
45 HG12 VAL 5 HG12 VAL 5 25.756 6.725 0.721
46 HG13 VAL 5 HG13 VAL 5 26.148 7.406 2.316
47 HG21 VAL 5 HG21 VAL 5 27.781 7.142 -1.282
48 HG22 VAL 5 HG22 VAL 5 28.316 5.890 -0.140
49 HG23 VAL 5 HG23 VAL 5 29.359 7.282 -0.475
50 H GLY 6 HN GLY 6 25.313 8.981 2.110
51 HA2 GLY 6 HA1 GLY 6 24.698 10.356 3.866
52 HA3 GLY 6 HA2 GLY 6 26.438 10.659 4.081
53 H LEU 7 HN LEU 7 25.375 11.405 0.973
54 HA LEU 7 HA LEU 7 24.408 14.070 1.469
55 HB2 LEU 7 HB2 LEU 7 26.922 14.272 1.837
56 HB3 LEU 7 HB1 LEU 7 27.095 13.817 0.128
57 HG LEU 7 HG LEU 7 25.435 15.806 -0.343
58 HD11 LEU 7 HD11 LEU 7 26.408 16.458 2.478
59 HD12 LEU 7 HD12 LEU 7 24.724 16.325 1.920
60 HD13 LEU 7 HD13 LEU 7 25.742 17.669 1.361
61 HD21 LEU 7 HD21 LEU 7 27.834 15.793 -0.973
62 HD22 LEU 7 HD22 LEU 7 28.268 16.344 0.662
63 HD23 LEU 7 HD23 LEU 7 27.327 17.404 -0.415
64 H LEU 8 HN LEU 8 25.537 11.596 -0.424
65 HA LEU 8 HA LEU 8 24.170 12.611 -2.895
66 HB2 LEU 8 HB2 LEU 8 26.605 11.637 -2.839
67 HB3 LEU 8 HB1 LEU 8 25.804 10.058 -2.707
68 HG LEU 8 HG LEU 8 24.382 10.967 -4.801
69 HD11 LEU 8 HD11 LEU 8 27.005 12.513 -5.032
70 HD12 LEU 8 HD12 LEU 8 25.400 13.237 -4.780
71 HD13 LEU 8 HD13 LEU 8 25.759 12.378 -6.294
72 HD21 LEU 8 HD21 LEU 8 27.277 10.034 -5.042
73 HD22 LEU 8 HD22 LEU 8 26.042 9.928 -6.320
74 HD23 LEU 8 HD23 LEU 8 25.861 8.978 -4.826
75 H LYS 9 HN LYS 9 23.470 10.899 -0.161
76 HA LYS 9 HA LYS 9 21.059 9.804 -1.336
77 HB2 LYS 9 HB2 LYS 9 23.002 8.115 -1.865
78 HB3 LYS 9 HB1 LYS 9 22.877 7.695 -0.146
79 HG2 LYS 9 HG2 LYS 9 21.376 6.155 -1.093
80 HG3 LYS 9 HG1 LYS 9 20.275 7.484 -0.672
81 HD2 LYS 9 HD2 LYS 9 20.312 8.310 -2.975
82 HD3 LYS 9 HD1 LYS 9 21.561 7.124 -3.421
83 HE2 LYS 9 HE2 LYS 9 19.256 6.418 -4.108
84 HE3 LYS 9 HE1 LYS 9 20.028 5.274 -2.983
85 HZ1 LYS 9 HZ1 LYS 9 18.816 6.293 -1.165
86 HZ2 LYS 9 HZ2 LYS 9 17.732 5.762 -2.360
87 HZ3 LYS 9 HZ3 LYS 9 18.101 7.414 -2.219
88 H SER 10 HN SER 10 22.904 10.941 1.156
89 HA SER 10 HA SER 10 22.534 11.191 3.442
90 HB2 SER 10 HB2 SER 10 19.638 10.910 2.557
91 HB3 SER 10 HB1 SER 10 20.200 11.618 4.088
92 HG SER 10 HG SER 10 21.495 13.040 2.617
93 H LEU 11 HN LEU 11 23.194 8.556 2.708
94 HA LEU 11 HA LEU 11 21.438 6.556 3.633
95 HB2 LEU 11 HB2 LEU 11 23.838 6.453 2.519
96 HB3 LEU 11 HB1 LEU 11 24.413 6.404 4.193
97 HG LEU 11 HG LEU 11 24.203 4.127 3.487
98 HD11 LEU 11 HD11 LEU 11 22.652 3.213 5.073
99 HD12 LEU 11 HD12 LEU 11 21.641 4.674 5.041
100 HD13 LEU 11 HD13 LEU 11 23.267 4.732 5.761
101 HD21 LEU 11 HD21 LEU 11 22.535 4.794 1.556
102 HD22 LEU 11 HD22 LEU 11 21.267 4.437 2.748
103 HD23 LEU 11 HD23 LEU 11 22.422 3.175 2.275
104 H LEU 12 HN LEU 12 24.233 7.812 5.515
105 HA LEU 12 HA LEU 12 23.085 6.866 8.005
106 HB2 LEU 12 HB2 LEU 12 25.560 7.154 7.491
107 HB3 LEU 12 HB1 LEU 12 25.304 8.907 7.628
108 HG LEU 12 HG LEU 12 24.317 8.453 9.962
109 HD11 LEU 12 HD11 LEU 12 23.869 6.127 10.048
110 HD12 LEU 12 HD12 LEU 12 25.378 6.267 10.969
111 HD13 LEU 12 HD13 LEU 12 25.418 5.698 9.286
112 HD21 LEU 12 HD21 LEU 12 27.244 7.748 9.455
113 HD22 LEU 12 HD22 LEU 12 26.564 8.326 10.995
114 HD23 LEU 12 HD23 LEU 12 26.580 9.394 9.573
115 H LYS 13 HN LYS 13 21.038 7.789 8.222
116 HA LYS 13 HA LYS 13 20.660 10.675 8.061
117 HB2 LYS 13 HB2 LYS 13 18.416 10.185 8.944
118 HB3 LYS 13 HB1 LYS 13 18.831 9.071 7.618
119 HG2 LYS 13 HG2 LYS 13 19.669 7.459 9.472
120 HG3 LYS 13 HG1 LYS 13 18.799 8.517 10.610
121 HD2 LYS 13 HD2 LYS 13 17.575 7.100 8.201
122 HD3 LYS 13 HD1 LYS 13 17.377 6.619 9.902
123 HE2 LYS 13 HE2 LYS 13 16.461 9.009 10.295
124 HE3 LYS 13 HE1 LYS 13 16.347 9.122 8.521
125 HZ1 LYS 13 HZ1 LYS 13 15.218 6.784 9.921
126 HZ2 LYS 13 HZ2 LYS 13 14.772 7.468 8.431
127 HZ3 LYS 13 HZ3 LYS 13 14.347 8.240 9.883
Start of MODEL 9
1 H1 PHE 1 HT1 PHE 1 35.146 7.586 -9.804
2 H2 PHE 1 HT2 PHE 1 35.695 8.998 -9.033
3 H3 PHE 1 HT3 PHE 1 35.600 8.931 -10.729
4 HA PHE 1 HA PHE 1 33.809 10.191 -9.557
5 HB2 PHE 1 HB2 PHE 1 33.164 7.875 -11.424
6 HB3 PHE 1 HB1 PHE 1 32.051 9.215 -11.059
7 HD1 PHE 1 HD1 PHE 1 35.259 8.275 -12.678
8 HD2 PHE 1 HD2 PHE 1 32.454 11.465 -11.913
9 HE1 PHE 1 HE1 PHE 1 36.387 9.679 -14.400
10 HE2 PHE 1 HE2 PHE 1 33.580 12.869 -13.637
11 HZ PHE 1 HZ PHE 1 35.587 11.999 -14.832
12 H LEU 2 HN LEU 2 34.686 8.210 -7.585
13 HA LEU 2 HA LEU 2 32.602 6.400 -6.926
14 HB2 LEU 2 HB2 LEU 2 33.660 6.188 -4.788
15 HB3 LEU 2 HB1 LEU 2 34.953 6.474 -5.968
16 HG LEU 2 HG LEU 2 33.729 8.574 -4.107
17 HD11 LEU 2 HD11 LEU 2 35.926 8.521 -3.020
18 HD12 LEU 2 HD12 LEU 2 36.489 7.289 -4.175
19 HD13 LEU 2 HD13 LEU 2 35.203 6.895 -3.010
20 HD21 LEU 2 HD21 LEU 2 35.844 8.713 -6.298
21 HD22 LEU 2 HD22 LEU 2 35.764 9.911 -4.986
22 HD23 LEU 2 HD23 LEU 2 34.398 9.730 -6.105
23 HA PRO 3 HA PRO 3 29.456 9.165 -5.407
24 HB2 PRO 3 HB2 PRO 3 27.948 7.515 -3.842
25 HB3 PRO 3 HB1 PRO 3 28.017 7.327 -5.625
26 HG2 PRO 3 HG2 PRO 3 29.521 5.814 -3.497
27 HG3 PRO 3 HG1 PRO 3 28.664 5.189 -4.941
28 HD2 PRO 3 HD2 PRO 3 31.388 5.571 -4.894
29 HD3 PRO 3 HD1 PRO 3 30.411 5.748 -6.390
30 H ILE 4 HN ILE 4 29.031 10.523 -3.661
31 HA ILE 4 HA ILE 4 31.017 10.482 -1.527
32 HB ILE 4 HB ILE 4 28.510 12.210 -1.604
33 HG12 ILE 4 HG12 ILE 4 31.174 12.617 -3.038
34 HG13 ILE 4 HG11 ILE 4 29.601 12.323 -3.816
35 HG21 ILE 4 HG21 ILE 4 29.796 13.728 -0.277
36 HG22 ILE 4 HG22 ILE 4 31.316 12.867 -0.622
37 HG23 ILE 4 HG23 ILE 4 30.089 12.124 0.431
38 HD11 ILE 4 HD1 ILE 4 28.791 14.436 -2.524
39 HD12 ILE 4 HD2 ILE 4 29.868 14.681 -3.921
40 HD13 ILE 4 HD3 ILE 4 30.521 14.770 -2.268
41 H VAL 5 HN VAL 5 27.436 10.071 -1.645
42 HA VAL 5 HA VAL 5 26.055 8.871 -0.244
43 HB VAL 5 HB VAL 5 28.369 7.887 1.468
44 HG11 VAL 5 HG11 VAL 5 26.916 5.859 1.594
45 HG12 VAL 5 HG12 VAL 5 25.724 6.671 0.554
46 HG13 VAL 5 HG13 VAL 5 26.089 7.319 2.169
47 HG21 VAL 5 HG21 VAL 5 29.317 7.289 -0.612
48 HG22 VAL 5 HG22 VAL 5 27.733 7.131 -1.405
49 HG23 VAL 5 HG23 VAL 5 28.305 5.870 -0.290
50 H GLY 6 HN GLY 6 25.286 8.919 2.048
51 HA2 GLY 6 HA1 GLY 6 24.698 10.271 3.838
52 HA3 GLY 6 HA2 GLY 6 26.444 10.547 4.044
53 H LEU 7 HN LEU 7 25.369 11.359 0.957
54 HA LEU 7 HA LEU 7 24.448 14.031 1.497
55 HB2 LEU 7 HB2 LEU 7 26.855 14.385 1.890
56 HB3 LEU 7 HB1 LEU 7 27.203 13.633 0.318
57 HG LEU 7 HG LEU 7 26.013 15.453 -0.848
58 HD11 LEU 7 HD11 LEU 7 24.276 16.175 0.591
59 HD12 LEU 7 HD12 LEU 7 25.435 17.517 0.689
60 HD13 LEU 7 HD13 LEU 7 25.361 16.310 1.996
61 HD21 LEU 7 HD21 LEU 7 28.420 15.713 -0.320
62 HD22 LEU 7 HD22 LEU 7 27.999 16.473 1.233
63 HD23 LEU 7 HD23 LEU 7 27.587 17.285 -0.297
64 H LEU 8 HN LEU 8 25.541 11.561 -0.422
65 HA LEU 8 HA LEU 8 24.139 12.583 -2.875
66 HB2 LEU 8 HB2 LEU 8 26.596 11.664 -2.865
67 HB3 LEU 8 HB1 LEU 8 25.835 10.067 -2.725
68 HG LEU 8 HG LEU 8 24.359 10.940 -4.791
69 HD11 LEU 8 HD11 LEU 8 25.696 12.383 -6.308
70 HD12 LEU 8 HD12 LEU 8 26.927 12.574 -5.037
71 HD13 LEU 8 HD13 LEU 8 25.293 13.236 -4.801
72 HD21 LEU 8 HD21 LEU 8 25.894 8.993 -4.845
73 HD22 LEU 8 HD22 LEU 8 27.275 10.089 -5.089
74 HD23 LEU 8 HD23 LEU 8 26.017 9.950 -6.341
75 H LYS 9 HN LYS 9 23.537 10.841 -0.138
76 HA LYS 9 HA LYS 9 21.156 9.619 -1.312
77 HB2 LYS 9 HB2 LYS 9 23.077 7.954 -1.720
78 HB3 LYS 9 HB1 LYS 9 23.124 7.747 0.045
79 HG2 LYS 9 HG2 LYS 9 20.796 7.001 0.069
80 HG3 LYS 9 HG1 LYS 9 20.633 7.341 -1.670
81 HD2 LYS 9 HD2 LYS 9 22.429 5.669 -2.137
82 HD3 LYS 9 HD1 LYS 9 22.496 5.290 -0.398
83 HE2 LYS 9 HE2 LYS 9 20.085 4.656 -0.466
84 HE3 LYS 9 HE1 LYS 9 20.067 4.974 -2.217
85 HZ1 LYS 9 HZ1 LYS 9 22.154 3.194 -1.203
86 HZ2 LYS 9 HZ2 LYS 9 21.273 3.126 -2.655
87 HZ3 LYS 9 HZ3 LYS 9 20.571 2.587 -1.205
88 H SER 10 HN SER 10 22.947 10.952 1.124
89 HA SER 10 HA SER 10 22.595 11.282 3.413
90 HB2 SER 10 HB2 SER 10 20.267 11.961 3.947
91 HB3 SER 10 HB1 SER 10 20.855 12.697 2.440
92 HG SER 10 HG SER 10 19.731 11.083 1.300
93 H LEU 11 HN LEU 11 23.228 8.747 3.293
94 HA LEU 11 HA LEU 11 21.635 7.554 5.408
95 HB2 LEU 11 HB2 LEU 11 20.415 7.099 3.101
96 HB3 LEU 11 HB1 LEU 11 21.694 5.896 2.872
97 HG LEU 11 HG LEU 11 19.848 4.736 3.853
98 HD11 LEU 11 HD11 LEU 11 22.146 4.301 4.823
99 HD12 LEU 11 HD12 LEU 11 20.787 3.844 5.874
100 HD13 LEU 11 HD13 LEU 11 21.695 5.335 6.199
101 HD21 LEU 11 HD21 LEU 11 18.824 6.982 4.785
102 HD22 LEU 11 HD22 LEU 11 19.729 6.591 6.262
103 HD23 LEU 11 HD23 LEU 11 18.504 5.465 5.648
104 H LEU 12 HN LEU 12 23.392 7.181 6.630
105 HA LEU 12 HA LEU 12 25.888 6.191 5.477
106 HB2 LEU 12 HB2 LEU 12 25.163 6.139 8.424
107 HB3 LEU 12 HB1 LEU 12 26.760 6.358 7.670
108 HG LEU 12 HG LEU 12 24.433 8.331 7.610
109 HD11 LEU 12 HD11 LEU 12 25.723 8.174 9.750
110 HD12 LEU 12 HD12 LEU 12 25.933 9.743 8.938
111 HD13 LEU 12 HD13 LEU 12 27.217 8.514 8.846
112 HD21 LEU 12 HD21 LEU 12 26.232 9.816 6.512
113 HD22 LEU 12 HD22 LEU 12 25.552 8.527 5.492
114 HD23 LEU 12 HD23 LEU 12 27.156 8.319 6.237
115 H LYS 13 HN LYS 13 26.336 4.165 4.951
116 HA LYS 13 HA LYS 13 24.524 2.000 5.543
117 HB2 LYS 13 HB2 LYS 13 27.432 1.709 4.715
118 HB3 LYS 13 HB1 LYS 13 26.079 0.601 4.388
119 HG2 LYS 13 HG2 LYS 13 26.371 3.432 3.284
120 HG3 LYS 13 HG1 LYS 13 26.647 1.926 2.379
121 HD2 LYS 13 HD2 LYS 13 24.210 1.301 3.037
122 HD3 LYS 13 HD1 LYS 13 24.029 3.014 3.482
123 HE2 LYS 13 HE2 LYS 13 24.920 1.996 0.748
124 HE3 LYS 13 HE1 LYS 13 23.288 2.583 1.145
125 HZ1 LYS 13 HZ1 LYS 13 24.446 4.687 1.905
126 HZ2 LYS 13 HZ2 LYS 13 24.416 4.406 0.229
127 HZ3 LYS 13 HZ3 LYS 13 25.834 4.109 1.117
Start of MODEL 10
1 H1 PHE 1 HT1 PHE 1 32.750 4.999 -11.484
2 H2 PHE 1 HT2 PHE 1 33.297 4.235 -10.068
3 H3 PHE 1 HT3 PHE 1 34.208 5.486 -10.771
4 HA PHE 1 HA PHE 1 32.955 7.104 -9.947
5 HB2 PHE 1 HB2 PHE 1 30.613 5.158 -10.030
6 HB3 PHE 1 HB1 PHE 1 30.520 6.875 -9.570
7 HD1 PHE 1 HD1 PHE 1 30.976 4.488 -12.352
8 HD2 PHE 1 HD2 PHE 1 30.868 8.657 -11.241
9 HE1 PHE 1 HE1 PHE 1 30.784 5.122 -14.754
10 HE2 PHE 1 HE2 PHE 1 30.676 9.292 -13.645
11 HZ PHE 1 HZ PHE 1 30.552 7.519 -15.392
12 H LEU 2 HN LEU 2 31.731 7.534 -7.814
13 HA LEU 2 HA LEU 2 31.792 5.490 -5.779
14 HB2 LEU 2 HB2 LEU 2 34.252 5.816 -6.104
15 HB3 LEU 2 HB1 LEU 2 34.049 7.530 -5.689
16 HG LEU 2 HG LEU 2 33.096 6.827 -3.458
17 HD11 LEU 2 HD11 LEU 2 33.729 4.082 -4.599
18 HD12 LEU 2 HD12 LEU 2 32.296 4.617 -3.691
19 HD13 LEU 2 HD13 LEU 2 33.834 4.358 -2.845
20 HD21 LEU 2 HD21 LEU 2 35.495 7.448 -3.804
21 HD22 LEU 2 HD22 LEU 2 35.873 5.732 -4.088
22 HD23 LEU 2 HD23 LEU 2 35.279 6.261 -2.494
23 HA PRO 3 HA PRO 3 29.033 9.254 -5.261
24 HB2 PRO 3 HB2 PRO 3 27.762 7.054 -3.607
25 HB3 PRO 3 HB1 PRO 3 26.977 8.326 -4.601
26 HG2 PRO 3 HG2 PRO 3 27.191 5.844 -5.530
27 HG3 PRO 3 HG1 PRO 3 27.475 7.246 -6.610
28 HD2 PRO 3 HD2 PRO 3 29.481 5.358 -5.383
29 HD3 PRO 3 HD1 PRO 3 29.540 6.215 -6.960
30 H ILE 4 HN ILE 4 29.037 10.699 -3.575
31 HA ILE 4 HA ILE 4 31.008 10.349 -1.518
32 HB ILE 4 HB ILE 4 28.693 12.330 -1.426
33 HG12 ILE 4 HG12 ILE 4 31.350 12.530 -2.923
34 HG13 ILE 4 HG11 ILE 4 29.746 12.375 -3.674
35 HG21 ILE 4 HG21 ILE 4 31.587 12.650 -0.528
36 HG22 ILE 4 HG22 ILE 4 30.320 12.024 0.551
37 HG23 ILE 4 HG23 ILE 4 30.190 13.669 -0.112
38 HD11 ILE 4 HD1 ILE 4 30.182 14.706 -3.744
39 HD12 ILE 4 HD2 ILE 4 30.885 14.714 -2.111
40 HD13 ILE 4 HD3 ILE 4 29.127 14.519 -2.323
41 H VAL 5 HN VAL 5 27.440 10.051 -1.549
42 HA VAL 5 HA VAL 5 26.060 8.901 -0.102
43 HB VAL 5 HB VAL 5 28.361 8.030 1.684
44 HG11 VAL 5 HG11 VAL 5 26.061 7.465 2.340
45 HG12 VAL 5 HG12 VAL 5 26.949 5.995 1.890
46 HG13 VAL 5 HG13 VAL 5 25.775 6.706 0.757
47 HG21 VAL 5 HG21 VAL 5 29.379 7.332 -0.322
48 HG22 VAL 5 HG22 VAL 5 27.828 7.168 -1.178
49 HG23 VAL 5 HG23 VAL 5 28.339 5.932 -0.004
50 H GLY 6 HN GLY 6 25.261 9.062 2.165
51 HA2 GLY 6 HA1 GLY 6 24.611 10.530 3.843
52 HA3 GLY 6 HA2 GLY 6 26.353 10.728 4.137
53 H LEU 7 HN LEU 7 25.391 11.514 0.978
54 HA LEU 7 HA LEU 7 24.631 14.250 1.444
55 HB2 LEU 7 HB2 LEU 7 27.020 14.512 1.888
56 HB3 LEU 7 HB1 LEU 7 27.391 13.633 0.386
57 HG LEU 7 HG LEU 7 26.442 15.432 -0.968
58 HD11 LEU 7 HD11 LEU 7 25.762 17.599 0.339
59 HD12 LEU 7 HD12 LEU 7 25.555 16.513 1.734
60 HD13 LEU 7 HD13 LEU 7 24.589 16.267 0.259
61 HD21 LEU 7 HD21 LEU 7 28.168 16.664 1.221
62 HD22 LEU 7 HD22 LEU 7 28.059 17.172 -0.481
63 HD23 LEU 7 HD23 LEU 7 28.802 15.609 -0.065
64 H LEU 8 HN LEU 8 25.613 11.688 -0.413
65 HA LEU 8 HA LEU 8 24.061 12.693 -2.801
66 HB2 LEU 8 HB2 LEU 8 26.755 12.089 -2.772
67 HB3 LEU 8 HB1 LEU 8 26.083 10.514 -3.238
68 HG LEU 8 HG LEU 8 25.476 13.172 -4.628
69 HD11 LEU 8 HD11 LEU 8 27.266 10.828 -5.402
70 HD12 LEU 8 HD12 LEU 8 27.792 12.483 -5.013
71 HD13 LEU 8 HD13 LEU 8 26.837 12.176 -6.482
72 HD21 LEU 8 HD21 LEU 8 24.709 10.277 -5.215
73 HD22 LEU 8 HD22 LEU 8 24.536 11.600 -6.391
74 HD23 LEU 8 HD23 LEU 8 23.611 11.636 -4.873
75 H LYS 9 HN LYS 9 23.512 10.995 -0.226
76 HA LYS 9 HA LYS 9 21.621 9.244 -1.522
77 HB2 LYS 9 HB2 LYS 9 23.862 8.003 -1.778
78 HB3 LYS 9 HB1 LYS 9 23.814 7.792 -0.013
79 HG2 LYS 9 HG2 LYS 9 21.680 6.603 -0.166
80 HG3 LYS 9 HG1 LYS 9 21.595 6.914 -1.917
81 HD2 LYS 9 HD2 LYS 9 23.700 5.622 -2.231
82 HD3 LYS 9 HD1 LYS 9 23.732 5.274 -0.486
83 HE2 LYS 9 HE2 LYS 9 22.725 3.361 -1.553
84 HE3 LYS 9 HE1 LYS 9 21.408 4.257 -0.759
85 HZ1 LYS 9 HZ1 LYS 9 21.910 3.812 -3.572
86 HZ2 LYS 9 HZ2 LYS 9 21.525 5.421 -3.188
87 HZ3 LYS 9 HZ3 LYS 9 20.458 4.167 -2.769
88 H SER 10 HN SER 10 22.929 10.891 1.025
89 HA SER 10 HA SER 10 22.370 11.107 3.289
90 HB2 SER 10 HB2 SER 10 20.025 11.546 3.639
91 HB3 SER 10 HB1 SER 10 20.444 12.113 2.007
92 HG SER 10 HG SER 10 19.675 10.028 1.264
93 H LEU 11 HN LEU 11 23.434 9.151 3.990
94 HA LEU 11 HA LEU 11 21.868 6.688 4.228
95 HB2 LEU 11 HB2 LEU 11 24.489 7.080 4.064
96 HB3 LEU 11 HB1 LEU 11 24.384 7.251 5.827
97 HG LEU 11 HG LEU 11 23.430 4.859 4.184
98 HD11 LEU 11 HD11 LEU 11 25.738 5.208 6.149
99 HD12 LEU 11 HD12 LEU 11 25.887 5.030 4.385
100 HD13 LEU 11 HD13 LEU 11 25.270 3.680 5.367
101 HD21 LEU 11 HD21 LEU 11 23.228 3.861 6.577
102 HD22 LEU 11 HD22 LEU 11 21.961 4.993 6.057
103 HD23 LEU 11 HD23 LEU 11 23.256 5.547 7.146
104 H LEU 12 HN LEU 12 23.306 8.960 6.621
105 HA LEU 12 HA LEU 12 22.090 7.933 8.928
106 HB2 LEU 12 HB2 LEU 12 22.397 10.910 8.410
107 HB3 LEU 12 HB1 LEU 12 22.513 10.044 9.958
108 HG LEU 12 HG LEU 12 24.463 9.905 7.616
109 HD11 LEU 12 HD11 LEU 12 24.841 10.740 10.524
110 HD12 LEU 12 HD12 LEU 12 24.586 11.875 9.177
111 HD13 LEU 12 HD13 LEU 12 26.041 10.851 9.215
112 HD21 LEU 12 HD21 LEU 12 24.213 8.215 10.140
113 HD22 LEU 12 HD22 LEU 12 25.765 8.408 9.290
114 HD23 LEU 12 HD23 LEU 12 24.382 7.665 8.456
115 H LYS 13 HN LYS 13 20.861 10.813 7.149
116 HA LYS 13 HA LYS 13 18.302 10.729 8.451
117 HB2 LYS 13 HB2 LYS 13 19.101 11.976 5.789
118 HB3 LYS 13 HB1 LYS 13 17.606 12.322 6.693
119 HG2 LYS 13 HG2 LYS 13 18.823 13.279 8.530
120 HG3 LYS 13 HG1 LYS 13 20.375 12.670 7.907
121 HD2 LYS 13 HD2 LYS 13 20.170 15.066 7.412
122 HD3 LYS 13 HD1 LYS 13 20.118 14.133 5.899
123 HE2 LYS 13 HE2 LYS 13 17.541 14.869 7.329
124 HE3 LYS 13 HE1 LYS 13 18.352 16.041 6.265
125 HZ1 LYS 13 HZ1 LYS 13 17.390 15.009 4.574
126 HZ2 LYS 13 HZ2 LYS 13 16.799 13.765 5.569
127 HZ3 LYS 13 HZ3 LYS 13 18.352 13.647 4.889
Start of MODEL 11
1 H1 PHE 1 HT1 PHE 1 34.788 3.337 -6.347
2 H2 PHE 1 HT2 PHE 1 33.543 4.408 -6.784
3 H3 PHE 1 HT3 PHE 1 33.175 2.928 -6.032
4 HA PHE 1 HA PHE 1 33.109 4.029 -4.157
5 HB2 PHE 1 HB2 PHE 1 36.094 4.166 -4.731
6 HB3 PHE 1 HB1 PHE 1 35.356 4.501 -3.146
7 HD1 PHE 1 HD1 PHE 1 34.416 2.711 -1.784
8 HD2 PHE 1 HD2 PHE 1 36.018 1.892 -5.707
9 HE1 PHE 1 HE1 PHE 1 34.369 0.268 -1.293
10 HE2 PHE 1 HE2 PHE 1 35.971 -0.551 -5.216
11 HZ PHE 1 HZ PHE 1 35.117 -1.364 -3.021
12 H LEU 2 HN LEU 2 33.180 5.681 -6.808
13 HA LEU 2 HA LEU 2 34.289 8.244 -5.973
14 HB2 LEU 2 HB2 LEU 2 32.228 7.896 -8.169
15 HB3 LEU 2 HB1 LEU 2 33.563 9.064 -8.058
16 HG LEU 2 HG LEU 2 33.817 6.054 -8.479
17 HD11 LEU 2 HD11 LEU 2 33.121 7.301 -10.484
18 HD12 LEU 2 HD12 LEU 2 34.813 6.772 -10.649
19 HD13 LEU 2 HD13 LEU 2 34.446 8.465 -10.240
20 HD21 LEU 2 HD21 LEU 2 35.684 6.720 -7.117
21 HD22 LEU 2 HD22 LEU 2 35.883 8.247 -8.013
22 HD23 LEU 2 HD23 LEU 2 36.291 6.698 -8.789
23 HA PRO 3 HA PRO 3 29.421 9.029 -5.352
24 HB2 PRO 3 HB2 PRO 3 29.017 6.504 -3.735
25 HB3 PRO 3 HB1 PRO 3 27.862 7.374 -4.796
26 HG2 PRO 3 HG2 PRO 3 29.012 5.130 -5.631
27 HG3 PRO 3 HG1 PRO 3 28.818 6.517 -6.750
28 HD2 PRO 3 HD2 PRO 3 31.303 5.584 -5.297
29 HD3 PRO 3 HD1 PRO 3 31.134 6.211 -6.970
30 H ILE 4 HN ILE 4 29.078 10.419 -3.685
31 HA ILE 4 HA ILE 4 31.032 10.454 -1.519
32 HB ILE 4 HB ILE 4 28.499 12.137 -1.670
33 HG12 ILE 4 HG12 ILE 4 31.180 12.572 -3.068
34 HG13 ILE 4 HG11 ILE 4 29.630 12.220 -3.868
35 HG21 ILE 4 HG21 ILE 4 30.050 12.115 0.389
36 HG22 ILE 4 HG22 ILE 4 29.739 13.702 -0.352
37 HG23 ILE 4 HG23 ILE 4 31.279 12.861 -0.661
38 HD11 ILE 4 HD1 ILE 4 29.842 14.581 -4.023
39 HD12 ILE 4 HD2 ILE 4 30.450 14.724 -2.358
40 HD13 ILE 4 HD3 ILE 4 28.736 14.337 -2.652
41 H VAL 5 HN VAL 5 27.438 10.090 -1.632
42 HA VAL 5 HA VAL 5 26.049 8.884 -0.243
43 HB VAL 5 HB VAL 5 28.350 7.884 1.479
44 HG11 VAL 5 HG11 VAL 5 25.692 6.696 0.569
45 HG12 VAL 5 HG12 VAL 5 26.070 7.338 2.184
46 HG13 VAL 5 HG13 VAL 5 26.876 5.868 1.606
47 HG21 VAL 5 HG21 VAL 5 28.245 5.859 -0.288
48 HG22 VAL 5 HG22 VAL 5 29.306 7.246 -0.580
49 HG23 VAL 5 HG23 VAL 5 27.731 7.146 -1.401
50 H GLY 6 HN GLY 6 25.273 8.941 2.045
51 HA2 GLY 6 HA1 GLY 6 24.699 10.285 3.840
52 HA3 GLY 6 HA2 GLY 6 26.444 10.580 4.031
53 H LEU 7 HN LEU 7 25.362 11.362 0.947
54 HA LEU 7 HA LEU 7 24.403 14.027 1.473
55 HB2 LEU 7 HB2 LEU 7 26.930 14.209 1.806
56 HB3 LEU 7 HB1 LEU 7 27.069 13.780 0.086
57 HG LEU 7 HG LEU 7 25.378 15.784 -0.293
58 HD11 LEU 7 HD11 LEU 7 25.751 17.618 1.399
59 HD12 LEU 7 HD12 LEU 7 26.535 16.427 2.460
60 HD13 LEU 7 HD13 LEU 7 24.816 16.249 2.038
61 HD21 LEU 7 HD21 LEU 7 27.708 15.793 -1.083
62 HD22 LEU 7 HD22 LEU 7 28.278 16.235 0.544
63 HD23 LEU 7 HD23 LEU 7 27.293 17.381 -0.396
64 H LEU 8 HN LEU 8 25.505 11.556 -0.439
65 HA LEU 8 HA LEU 8 24.136 12.573 -2.904
66 HB2 LEU 8 HB2 LEU 8 26.549 11.547 -2.849
67 HB3 LEU 8 HB1 LEU 8 25.716 9.988 -2.691
68 HG LEU 8 HG LEU 8 24.308 10.865 -4.790
69 HD11 LEU 8 HD11 LEU 8 25.257 13.132 -4.871
70 HD12 LEU 8 HD12 LEU 8 25.744 12.227 -6.321
71 HD13 LEU 8 HD13 LEU 8 26.902 12.464 -4.992
72 HD21 LEU 8 HD21 LEU 8 25.971 9.818 -6.304
73 HD22 LEU 8 HD22 LEU 8 25.788 8.881 -4.802
74 HD23 LEU 8 HD23 LEU 8 27.205 9.935 -5.027
75 H LYS 9 HN LYS 9 23.438 10.898 -0.147
76 HA LYS 9 HA LYS 9 20.981 9.842 -1.267
77 HB2 LYS 9 HB2 LYS 9 22.867 8.098 -1.808
78 HB3 LYS 9 HB1 LYS 9 22.789 7.721 -0.074
79 HG2 LYS 9 HG2 LYS 9 21.218 6.193 -0.911
80 HG3 LYS 9 HG1 LYS 9 20.155 7.568 -0.540
81 HD2 LYS 9 HD2 LYS 9 20.281 8.312 -2.901
82 HD3 LYS 9 HD1 LYS 9 21.381 6.964 -3.272
83 HE2 LYS 9 HE2 LYS 9 18.596 6.569 -2.108
84 HE3 LYS 9 HE1 LYS 9 18.935 6.553 -3.855
85 HZ1 LYS 9 HZ1 LYS 9 20.309 4.805 -1.877
86 HZ2 LYS 9 HZ2 LYS 9 20.410 4.721 -3.571
87 HZ3 LYS 9 HZ3 LYS 9 18.958 4.326 -2.784
88 H SER 10 HN SER 10 22.905 10.989 1.160
89 HA SER 10 HA SER 10 22.598 11.300 3.446
90 HB2 SER 10 HB2 SER 10 20.650 12.540 2.604
91 HB3 SER 10 HB1 SER 10 19.683 11.049 2.606
92 HG SER 10 HG SER 10 19.598 12.540 4.522
93 H LEU 11 HN LEU 11 22.723 8.469 2.319
94 HA LEU 11 HA LEU 11 22.467 6.300 3.102
95 HB2 LEU 11 HB2 LEU 11 23.828 7.559 4.943
96 HB3 LEU 11 HB1 LEU 11 22.327 7.495 5.891
97 HG LEU 11 HG LEU 11 22.376 4.899 5.240
98 HD11 LEU 11 HD11 LEU 11 25.308 5.724 4.999
99 HD12 LEU 11 HD12 LEU 11 24.305 5.003 3.718
100 HD13 LEU 11 HD13 LEU 11 24.730 4.050 5.157
101 HD21 LEU 11 HD21 LEU 11 24.257 6.139 7.300
102 HD22 LEU 11 HD22 LEU 11 23.710 4.446 7.296
103 HD23 LEU 11 HD23 LEU 11 22.536 5.760 7.543
104 H LEU 12 HN LEU 12 21.091 6.077 5.955
105 HA LEU 12 HA LEU 12 18.570 5.163 4.947
106 HB2 LEU 12 HB2 LEU 12 19.874 4.639 7.189
107 HB3 LEU 12 HB1 LEU 12 18.954 6.014 7.836
108 HG LEU 12 HG LEU 12 17.782 3.519 6.519
109 HD11 LEU 12 HD11 LEU 12 17.008 2.946 8.740
110 HD12 LEU 12 HD12 LEU 12 17.564 4.505 9.394
111 HD13 LEU 12 HD13 LEU 12 18.750 3.293 8.856
112 HD21 LEU 12 HD21 LEU 12 16.542 6.103 7.548
113 HD22 LEU 12 HD22 LEU 12 15.607 4.589 7.490
114 HD23 LEU 12 HD23 LEU 12 16.270 5.280 5.994
115 H LYS 13 HN LYS 13 19.236 7.950 7.131
116 HA LYS 13 HA LYS 13 17.601 9.763 5.600
117 HB2 LYS 13 HB2 LYS 13 15.838 8.215 6.620
118 HB3 LYS 13 HB1 LYS 13 16.341 8.837 8.208
119 HG2 LYS 13 HG2 LYS 13 14.583 10.307 7.710
120 HG3 LYS 13 HG1 LYS 13 15.961 11.222 7.063
121 HD2 LYS 13 HD2 LYS 13 15.489 10.346 4.794
122 HD3 LYS 13 HD1 LYS 13 14.138 9.385 5.440
123 HE2 LYS 13 HE2 LYS 13 13.320 11.494 4.439
124 HE3 LYS 13 HE1 LYS 13 13.023 11.469 6.194
125 HZ1 LYS 13 HZ1 LYS 13 14.876 12.870 6.565
126 HZ2 LYS 13 HZ2 LYS 13 14.003 13.576 5.291
127 HZ3 LYS 13 HZ3 LYS 13 15.429 12.712 4.970
Start of MODEL 12
1 H1 PHE 1 HT1 PHE 1 30.835 12.948 -11.544
2 H2 PHE 1 HT2 PHE 1 29.537 11.850 -11.555
3 H3 PHE 1 HT3 PHE 1 31.113 11.306 -11.226
4 HA PHE 1 HA PHE 1 30.889 13.133 -9.352
5 HB2 PHE 1 HB2 PHE 1 28.105 12.016 -9.867
6 HB3 PHE 1 HB1 PHE 1 28.598 12.839 -8.366
7 HD1 PHE 1 HD1 PHE 1 28.809 15.237 -8.272
8 HD2 PHE 1 HD2 PHE 1 28.209 13.258 -12.062
9 HE1 PHE 1 HE1 PHE 1 28.412 17.443 -9.361
10 HE2 PHE 1 HE2 PHE 1 27.811 15.465 -13.150
11 HZ PHE 1 HZ PHE 1 27.860 17.551 -11.788
12 H LEU 2 HN LEU 2 32.067 12.040 -7.947
13 HA LEU 2 HA LEU 2 32.087 9.158 -7.838
14 HB2 LEU 2 HB2 LEU 2 33.262 11.384 -6.145
15 HB3 LEU 2 HB1 LEU 2 33.425 9.689 -5.640
16 HG LEU 2 HG LEU 2 34.560 9.120 -7.723
17 HD11 LEU 2 HD11 LEU 2 33.848 11.981 -8.486
18 HD12 LEU 2 HD12 LEU 2 33.462 10.478 -9.358
19 HD13 LEU 2 HD13 LEU 2 35.137 11.073 -9.313
20 HD21 LEU 2 HD21 LEU 2 35.693 11.743 -6.653
21 HD22 LEU 2 HD22 LEU 2 36.600 10.420 -7.427
22 HD23 LEU 2 HD23 LEU 2 35.857 10.175 -5.827
23 HA PRO 3 HA PRO 3 28.759 8.454 -4.977
24 HB2 PRO 3 HB2 PRO 3 29.518 6.126 -3.747
25 HB3 PRO 3 HB1 PRO 3 29.025 6.183 -5.471
26 HG2 PRO 3 HG2 PRO 3 31.796 6.169 -4.285
27 HG3 PRO 3 HG1 PRO 3 31.147 5.227 -5.665
28 HD2 PRO 3 HD2 PRO 3 32.623 7.512 -6.022
29 HD3 PRO 3 HD1 PRO 3 31.314 7.030 -7.151
30 H ILE 4 HN ILE 4 29.060 10.312 -3.651
31 HA ILE 4 HA ILE 4 31.007 10.305 -1.490
32 HB ILE 4 HB ILE 4 28.514 12.048 -1.644
33 HG12 ILE 4 HG12 ILE 4 31.199 12.407 -3.059
34 HG13 ILE 4 HG11 ILE 4 29.639 12.079 -3.848
35 HG21 ILE 4 HG21 ILE 4 30.081 12.006 0.407
36 HG22 ILE 4 HG22 ILE 4 29.793 13.593 -0.344
37 HG23 ILE 4 HG23 ILE 4 31.315 12.723 -0.659
38 HD11 ILE 4 HD1 ILE 4 30.511 14.580 -2.363
39 HD12 ILE 4 HD2 ILE 4 28.792 14.224 -2.661
40 HD13 ILE 4 HD3 ILE 4 29.909 14.433 -4.029
41 H VAL 5 HN VAL 5 27.411 10.000 -1.592
42 HA VAL 5 HA VAL 5 26.006 8.832 -0.181
43 HB VAL 5 HB VAL 5 28.286 7.847 1.576
44 HG11 VAL 5 HG11 VAL 5 26.801 5.849 1.733
45 HG12 VAL 5 HG12 VAL 5 25.639 6.648 0.649
46 HG13 VAL 5 HG13 VAL 5 25.984 7.338 2.251
47 HG21 VAL 5 HG21 VAL 5 27.708 7.071 -1.301
48 HG22 VAL 5 HG22 VAL 5 28.175 5.789 -0.163
49 HG23 VAL 5 HG23 VAL 5 29.268 7.154 -0.449
50 H GLY 6 HN GLY 6 25.218 8.952 2.097
51 HA2 GLY 6 HA1 GLY 6 24.640 10.357 3.849
52 HA3 GLY 6 HA2 GLY 6 26.390 10.590 4.072
53 H LEU 7 HN LEU 7 25.372 11.378 0.958
54 HA LEU 7 HA LEU 7 24.528 14.088 1.454
55 HB2 LEU 7 HB2 LEU 7 27.062 14.145 1.798
56 HB3 LEU 7 HB1 LEU 7 27.184 13.714 0.078
57 HG LEU 7 HG LEU 7 25.640 15.782 -0.349
58 HD11 LEU 7 HD11 LEU 7 26.058 17.598 1.425
59 HD12 LEU 7 HD12 LEU 7 26.554 16.289 2.519
60 HD13 LEU 7 HD13 LEU 7 24.897 16.332 1.874
61 HD21 LEU 7 HD21 LEU 7 28.483 16.171 0.698
62 HD22 LEU 7 HD22 LEU 7 27.603 17.303 -0.357
63 HD23 LEU 7 HD23 LEU 7 28.040 15.686 -0.956
64 H LEU 8 HN LEU 8 25.527 11.552 -0.431
65 HA LEU 8 HA LEU 8 24.081 12.580 -2.862
66 HB2 LEU 8 HB2 LEU 8 26.565 11.753 -2.937
67 HB3 LEU 8 HB1 LEU 8 25.869 10.127 -2.786
68 HG LEU 8 HG LEU 8 24.311 10.912 -4.802
69 HD11 LEU 8 HD11 LEU 8 24.998 13.258 -4.891
70 HD12 LEU 8 HD12 LEU 8 25.574 12.437 -6.357
71 HD13 LEU 8 HD13 LEU 8 26.707 12.791 -5.034
72 HD21 LEU 8 HD21 LEU 8 27.273 10.292 -5.192
73 HD22 LEU 8 HD22 LEU 8 25.995 10.069 -6.410
74 HD23 LEU 8 HD23 LEU 8 25.988 9.092 -4.922
75 H LYS 9 HN LYS 9 23.677 10.742 -0.149
76 HA LYS 9 HA LYS 9 21.310 9.402 -1.301
77 HB2 LYS 9 HB2 LYS 9 23.643 7.881 -0.086
78 HB3 LYS 9 HB1 LYS 9 21.999 7.208 -0.160
79 HG2 LYS 9 HG2 LYS 9 22.017 7.597 -2.656
80 HG3 LYS 9 HG1 LYS 9 23.712 8.106 -2.518
81 HD2 LYS 9 HD2 LYS 9 23.924 5.828 -3.084
82 HD3 LYS 9 HD1 LYS 9 24.076 5.796 -1.315
83 HE2 LYS 9 HE2 LYS 9 21.774 5.069 -1.061
84 HE3 LYS 9 HE1 LYS 9 21.437 5.344 -2.786
85 HZ1 LYS 9 HZ1 LYS 9 21.840 3.096 -2.701
86 HZ2 LYS 9 HZ2 LYS 9 23.049 3.226 -1.515
87 HZ3 LYS 9 HZ3 LYS 9 23.373 3.690 -3.118
88 H SER 10 HN SER 10 22.956 10.993 1.082
89 HA SER 10 HA SER 10 22.550 11.397 3.358
90 HB2 SER 10 HB2 SER 10 20.810 12.689 2.036
91 HB3 SER 10 HB1 SER 10 19.664 11.386 2.418
92 HG SER 10 HG SER 10 19.420 12.757 4.077
93 H LEU 11 HN LEU 11 22.829 8.611 2.920
94 HA LEU 11 HA LEU 11 22.329 6.576 3.921
95 HB2 LEU 11 HB2 LEU 11 21.131 8.176 6.205
96 HB3 LEU 11 HB1 LEU 11 22.005 6.627 6.270
97 HG LEU 11 HG LEU 11 23.183 9.348 5.549
98 HD11 LEU 11 HD11 LEU 11 24.397 9.137 7.634
99 HD12 LEU 11 HD12 LEU 11 23.801 7.478 7.874
100 HD13 LEU 11 HD13 LEU 11 22.676 8.853 7.987
101 HD21 LEU 11 HD21 LEU 11 24.353 7.744 4.211
102 HD22 LEU 11 HD22 LEU 11 24.336 6.526 5.511
103 HD23 LEU 11 HD23 LEU 11 25.371 7.968 5.652
104 H LEU 12 HN LEU 12 20.053 6.449 5.998
105 HA LEU 12 HA LEU 12 18.087 5.322 4.261
106 HB2 LEU 12 HB2 LEU 12 17.540 6.409 7.045
107 HB3 LEU 12 HB1 LEU 12 16.737 5.056 6.216
108 HG LEU 12 HG LEU 12 19.630 5.145 7.179
109 HD11 LEU 12 HD11 LEU 12 18.884 3.313 8.663
110 HD12 LEU 12 HD12 LEU 12 17.238 3.438 7.997
111 HD13 LEU 12 HD13 LEU 12 17.920 4.784 8.941
112 HD21 LEU 12 HD21 LEU 12 18.098 3.142 5.470
113 HD22 LEU 12 HD22 LEU 12 19.505 2.651 6.444
114 HD23 LEU 12 HD23 LEU 12 19.694 3.869 5.164
115 H LYS 13 HN LYS 13 15.821 5.997 4.031
116 HA LYS 13 HA LYS 13 14.325 7.539 3.152
117 HB2 LYS 13 HB2 LYS 13 15.504 9.189 5.421
118 HB3 LYS 13 HB1 LYS 13 14.043 9.635 4.504
119 HG2 LYS 13 HG2 LYS 13 13.002 7.459 5.157
120 HG3 LYS 13 HG1 LYS 13 14.442 7.089 6.137
121 HD2 LYS 13 HD2 LYS 13 14.051 9.139 7.482
122 HD3 LYS 13 HD1 LYS 13 12.599 9.490 6.513
123 HE2 LYS 13 HE2 LYS 13 11.698 7.221 7.201
124 HE3 LYS 13 HE1 LYS 13 13.074 7.084 8.321
125 HZ1 LYS 13 HZ1 LYS 13 12.109 8.474 9.746
126 HZ2 LYS 13 HZ2 LYS 13 10.680 8.294 8.845
127 HZ3 LYS 13 HZ3 LYS 13 11.721 9.603 8.541
Start of MODEL 13
1 H1 PHE 1 HT1 PHE 1 32.358 9.025 -12.025
2 H2 PHE 1 HT2 PHE 1 31.026 9.991 -11.604
3 H3 PHE 1 HT3 PHE 1 31.001 8.320 -11.295
4 HA PHE 1 HA PHE 1 33.206 9.019 -10.005
5 HB2 PHE 1 HB2 PHE 1 32.639 11.069 -8.724
6 HB3 PHE 1 HB1 PHE 1 32.844 11.405 -10.460
7 HD1 PHE 1 HD1 PHE 1 30.400 11.068 -7.689
8 HD2 PHE 1 HD2 PHE 1 30.934 11.984 -11.872
9 HE1 PHE 1 HE1 PHE 1 28.088 11.992 -7.783
10 HE2 PHE 1 HE2 PHE 1 28.622 12.908 -11.966
11 HZ PHE 1 HZ PHE 1 27.219 12.962 -9.907
12 H LEU 2 HN LEU 2 33.081 7.848 -8.203
13 HA LEU 2 HA LEU 2 30.701 6.500 -7.474
14 HB2 LEU 2 HB2 LEU 2 31.932 5.646 -5.603
15 HB3 LEU 2 HB1 LEU 2 33.095 5.849 -6.924
16 HG LEU 2 HG LEU 2 32.688 7.779 -4.584
17 HD11 LEU 2 HD11 LEU 2 34.983 5.911 -5.314
18 HD12 LEU 2 HD12 LEU 2 33.807 5.643 -4.003
19 HD13 LEU 2 HD13 LEU 2 34.934 7.019 -3.922
20 HD21 LEU 2 HD21 LEU 2 34.875 8.751 -5.580
21 HD22 LEU 2 HD22 LEU 2 33.376 9.113 -6.460
22 HD23 LEU 2 HD23 LEU 2 34.473 7.844 -7.056
23 HA PRO 3 HA PRO 3 28.544 9.569 -5.094
24 HB2 PRO 3 HB2 PRO 3 26.956 8.035 -3.467
25 HB3 PRO 3 HB1 PRO 3 26.684 8.160 -5.236
26 HG2 PRO 3 HG2 PRO 3 28.092 5.999 -3.677
27 HG3 PRO 3 HG1 PRO 3 26.897 5.848 -5.004
28 HD2 PRO 3 HD2 PRO 3 29.597 5.610 -5.433
29 HD3 PRO 3 HD1 PRO 3 28.486 6.284 -6.669
30 H ILE 4 HN ILE 4 28.809 10.748 -3.236
31 HA ILE 4 HA ILE 4 30.965 9.929 -1.454
32 HB ILE 4 HB ILE 4 29.052 12.300 -1.310
33 HG12 ILE 4 HG12 ILE 4 31.984 12.250 -2.168
34 HG13 ILE 4 HG11 ILE 4 30.667 12.015 -3.337
35 HG21 ILE 4 HG21 ILE 4 29.961 11.919 0.896
36 HG22 ILE 4 HG22 ILE 4 30.921 13.229 0.179
37 HG23 ILE 4 HG23 ILE 4 31.578 11.578 0.237
38 HD11 ILE 4 HD1 ILE 4 29.705 14.259 -2.332
39 HD12 ILE 4 HD2 ILE 4 31.069 14.334 -3.469
40 HD13 ILE 4 HD3 ILE 4 31.361 14.492 -1.725
41 H VAL 5 HN VAL 5 27.419 9.961 -1.339
42 HA VAL 5 HA VAL 5 26.022 8.848 0.115
43 HB VAL 5 HB VAL 5 28.269 8.028 1.983
44 HG11 VAL 5 HG11 VAL 5 25.956 7.538 2.639
45 HG12 VAL 5 HG12 VAL 5 26.814 6.030 2.267
46 HG13 VAL 5 HG13 VAL 5 25.670 6.713 1.091
47 HG21 VAL 5 HG21 VAL 5 28.182 5.836 0.371
48 HG22 VAL 5 HG22 VAL 5 29.323 7.157 0.071
49 HG23 VAL 5 HG23 VAL 5 27.806 7.069 -0.854
50 H GLY 6 HN GLY 6 25.170 9.121 2.321
51 HA2 GLY 6 HA1 GLY 6 24.444 10.710 3.858
52 HA3 GLY 6 HA2 GLY 6 26.165 10.800 4.299
53 H LEU 7 HN LEU 7 25.412 11.574 1.049
54 HA LEU 7 HA LEU 7 24.930 14.385 1.457
55 HB2 LEU 7 HB2 LEU 7 27.367 14.283 1.889
56 HB3 LEU 7 HB1 LEU 7 27.569 13.502 0.304
57 HG LEU 7 HG LEU 7 26.674 15.529 -0.818
58 HD11 LEU 7 HD11 LEU 7 25.172 16.566 0.683
59 HD12 LEU 7 HD12 LEU 7 26.583 17.641 0.774
60 HD13 LEU 7 HD13 LEU 7 26.297 16.439 2.056
61 HD21 LEU 7 HD21 LEU 7 29.133 15.239 -0.247
62 HD22 LEU 7 HD22 LEU 7 28.856 16.272 1.176
63 HD23 LEU 7 HD23 LEU 7 28.616 16.929 -0.461
64 H LEU 8 HN LEU 8 25.589 11.711 -0.386
65 HA LEU 8 HA LEU 8 23.945 12.816 -2.660
66 HB2 LEU 8 HB2 LEU 8 26.538 11.247 -2.908
67 HB3 LEU 8 HB1 LEU 8 25.455 11.646 -4.259
68 HG LEU 8 HG LEU 8 26.760 13.709 -2.422
69 HD11 LEU 8 HD11 LEU 8 28.308 14.136 -4.267
70 HD12 LEU 8 HD12 LEU 8 27.495 12.915 -5.274
71 HD13 LEU 8 HD13 LEU 8 28.391 12.417 -3.821
72 HD21 LEU 8 HD21 LEU 8 24.890 14.815 -3.346
73 HD22 LEU 8 HD22 LEU 8 24.931 13.862 -4.848
74 HD23 LEU 8 HD23 LEU 8 26.125 15.152 -4.576
75 H LYS 9 HN LYS 9 23.587 10.791 -0.290
76 HA LYS 9 HA LYS 9 21.892 9.043 -1.821
77 HB2 LYS 9 HB2 LYS 9 24.295 8.108 -2.239
78 HB3 LYS 9 HB1 LYS 9 24.200 7.538 -0.562
79 HG2 LYS 9 HG2 LYS 9 22.247 6.185 -1.053
80 HG3 LYS 9 HG1 LYS 9 22.101 6.891 -2.679
81 HD2 LYS 9 HD2 LYS 9 23.154 4.684 -2.836
82 HD3 LYS 9 HD1 LYS 9 24.334 5.942 -3.268
83 HE2 LYS 9 HE2 LYS 9 25.517 5.707 -1.232
84 HE3 LYS 9 HE1 LYS 9 24.145 4.920 -0.412
85 HZ1 LYS 9 HZ1 LYS 9 25.498 3.689 -2.746
86 HZ2 LYS 9 HZ2 LYS 9 24.488 2.951 -1.597
87 HZ3 LYS 9 HZ3 LYS 9 26.054 3.449 -1.162
88 H SER 10 HN SER 10 22.823 10.506 0.990
89 HA SER 10 HA SER 10 20.657 9.184 2.458
90 HB2 SER 10 HB2 SER 10 22.184 7.510 3.080
91 HB3 SER 10 HB1 SER 10 23.551 8.643 3.141
92 HG SER 10 HG SER 10 21.298 8.819 4.865
93 H LEU 11 HN LEU 11 22.963 11.677 1.949
94 HA LEU 11 HA LEU 11 23.271 13.739 2.985
95 HB2 LEU 11 HB2 LEU 11 20.372 13.507 3.847
96 HB3 LEU 11 HB1 LEU 11 21.281 14.969 3.395
97 HG LEU 11 HG LEU 11 20.478 12.680 1.543
98 HD11 LEU 11 HD11 LEU 11 19.660 15.620 1.662
99 HD12 LEU 11 HD12 LEU 11 18.649 14.239 2.155
100 HD13 LEU 11 HD13 LEU 11 19.115 14.437 0.448
101 HD21 LEU 11 HD21 LEU 11 21.413 14.335 -0.223
102 HD22 LEU 11 HD22 LEU 11 22.603 13.440 0.749
103 HD23 LEU 11 HD23 LEU 11 22.235 15.138 1.138
104 H LEU 12 HN LEU 12 22.066 14.940 5.210
105 HA LEU 12 HA LEU 12 23.634 13.732 7.327
106 HB2 LEU 12 HB2 LEU 12 21.626 16.008 7.199
107 HB3 LEU 12 HB1 LEU 12 22.349 15.493 8.740
108 HG LEU 12 HG LEU 12 24.605 15.907 7.860
109 HD11 LEU 12 HD11 LEU 12 24.467 15.399 5.541
110 HD12 LEU 12 HD12 LEU 12 24.705 17.160 5.579
111 HD13 LEU 12 HD13 LEU 12 23.081 16.488 5.291
112 HD21 LEU 12 HD21 LEU 12 24.438 18.374 7.611
113 HD22 LEU 12 HD22 LEU 12 23.376 17.780 8.910
114 HD23 LEU 12 HD23 LEU 12 22.687 18.224 7.330
115 H LYS 13 HN LYS 13 20.963 12.546 5.960
116 HA LYS 13 HA LYS 13 20.254 10.988 8.324
117 HB2 LYS 13 HB2 LYS 13 17.781 11.697 8.169
118 HB3 LYS 13 HB1 LYS 13 18.901 12.840 8.951
119 HG2 LYS 13 HG2 LYS 13 19.023 14.218 6.986
120 HG3 LYS 13 HG1 LYS 13 18.209 12.987 5.990
121 HD2 LYS 13 HD2 LYS 13 16.624 14.775 6.574
122 HD3 LYS 13 HD1 LYS 13 16.150 13.257 7.371
123 HE2 LYS 13 HE2 LYS 13 16.911 13.995 9.493
124 HE3 LYS 13 HE1 LYS 13 17.910 15.291 8.790
125 HZ1 LYS 13 HZ1 LYS 13 16.120 16.630 8.494
126 HZ2 LYS 13 HZ2 LYS 13 15.542 15.753 9.828
127 HZ3 LYS 13 HZ3 LYS 13 15.030 15.352 8.259
Start of MODEL 14
1 H1 PHE 1 HT1 PHE 1 29.955 10.257 -9.371
2 H2 PHE 1 HT2 PHE 1 29.870 8.694 -10.033
3 H3 PHE 1 HT3 PHE 1 30.134 10.037 -11.042
4 HA PHE 1 HA PHE 1 32.061 8.478 -10.266
5 HB2 PHE 1 HB2 PHE 1 33.585 10.403 -10.625
6 HB3 PHE 1 HB1 PHE 1 32.273 10.361 -11.829
7 HD1 PHE 1 HD1 PHE 1 30.261 11.864 -11.536
8 HD2 PHE 1 HD2 PHE 1 33.798 12.244 -9.091
9 HE1 PHE 1 HE1 PHE 1 29.543 14.150 -10.853
10 HE2 PHE 1 HE2 PHE 1 33.081 14.531 -8.409
11 HZ PHE 1 HZ PHE 1 30.992 15.511 -9.350
12 H LEU 2 HN LEU 2 33.100 7.836 -8.498
13 HA LEU 2 HA LEU 2 33.700 7.723 -6.256
14 HB2 LEU 2 HB2 LEU 2 34.056 10.666 -6.908
15 HB3 LEU 2 HB1 LEU 2 34.419 10.040 -5.284
16 HG LEU 2 HG LEU 2 36.046 8.465 -6.196
17 HD11 LEU 2 HD11 LEU 2 35.013 9.489 -8.870
18 HD12 LEU 2 HD12 LEU 2 35.100 7.808 -8.290
19 HD13 LEU 2 HD13 LEU 2 36.590 8.679 -8.712
20 HD21 LEU 2 HD21 LEU 2 36.479 11.171 -7.532
21 HD22 LEU 2 HD22 LEU 2 37.722 10.043 -6.941
22 HD23 LEU 2 HD23 LEU 2 36.674 10.899 -5.784
23 HA PRO 3 HA PRO 3 29.205 8.739 -5.185
24 HB2 PRO 3 HB2 PRO 3 29.911 6.219 -3.654
25 HB3 PRO 3 HB1 PRO 3 28.358 6.682 -4.424
26 HG2 PRO 3 HG2 PRO 3 29.997 4.957 -5.623
27 HG3 PRO 3 HG1 PRO 3 29.135 6.206 -6.573
28 HD2 PRO 3 HD2 PRO 3 32.042 6.093 -5.788
29 HD3 PRO 3 HD1 PRO 3 31.284 6.809 -7.248
30 H ILE 4 HN ILE 4 29.035 10.331 -3.727
31 HA ILE 4 HA ILE 4 30.963 10.639 -1.570
32 HB ILE 4 HB ILE 4 28.279 12.063 -1.807
33 HG12 ILE 4 HG12 ILE 4 30.926 12.704 -3.190
34 HG13 ILE 4 HG11 ILE 4 29.438 12.152 -3.994
35 HG21 ILE 4 HG21 ILE 4 30.964 13.092 -0.803
36 HG22 ILE 4 HG22 ILE 4 29.792 12.288 0.268
37 HG23 ILE 4 HG23 ILE 4 29.351 13.801 -0.554
38 HD11 ILE 4 HD1 ILE 4 29.396 14.510 -4.262
39 HD12 ILE 4 HD2 ILE 4 29.968 14.798 -2.603
40 HD13 ILE 4 HD3 ILE 4 28.306 14.220 -2.886
41 H VAL 5 HN VAL 5 27.427 9.983 -1.647
42 HA VAL 5 HA VAL 5 26.116 8.749 -0.209
43 HB VAL 5 HB VAL 5 28.494 7.917 1.499
44 HG11 VAL 5 HG11 VAL 5 25.900 6.555 0.642
45 HG12 VAL 5 HG12 VAL 5 26.258 7.247 2.241
46 HG13 VAL 5 HG13 VAL 5 27.145 5.817 1.678
47 HG21 VAL 5 HG21 VAL 5 27.875 7.074 -1.355
48 HG22 VAL 5 HG22 VAL 5 28.508 5.860 -0.221
49 HG23 VAL 5 HG23 VAL 5 29.454 7.316 -0.573
50 H GLY 6 HN GLY 6 25.363 8.797 2.076
51 HA2 GLY 6 HA1 GLY 6 24.689 10.164 3.822
52 HA3 GLY 6 HA2 GLY 6 26.423 10.485 4.061
53 H LEU 7 HN LEU 7 25.326 11.239 0.953
54 HA LEU 7 HA LEU 7 24.360 13.898 1.464
55 HB2 LEU 7 HB2 LEU 7 26.882 14.100 1.816
56 HB3 LEU 7 HB1 LEU 7 27.038 13.669 0.099
57 HG LEU 7 HG LEU 7 25.346 15.657 -0.311
58 HD11 LEU 7 HD11 LEU 7 26.426 16.297 2.476
59 HD12 LEU 7 HD12 LEU 7 24.720 16.136 1.995
60 HD13 LEU 7 HD13 LEU 7 25.687 17.499 1.395
61 HD21 LEU 7 HD21 LEU 7 28.216 16.165 0.600
62 HD22 LEU 7 HD22 LEU 7 27.240 17.264 -0.403
63 HD23 LEU 7 HD23 LEU 7 27.710 15.666 -1.032
64 H LEU 8 HN LEU 8 25.492 11.435 -0.441
65 HA LEU 8 HA LEU 8 24.263 12.457 -2.941
66 HB2 LEU 8 HB2 LEU 8 26.441 11.335 -3.129
67 HB3 LEU 8 HB1 LEU 8 25.783 9.897 -2.322
68 HG LEU 8 HG LEU 8 24.288 9.451 -4.190
69 HD11 LEU 8 HD11 LEU 8 25.234 12.179 -5.148
70 HD12 LEU 8 HD12 LEU 8 23.570 11.568 -4.993
71 HD13 LEU 8 HD13 LEU 8 24.613 10.974 -6.302
72 HD21 LEU 8 HD21 LEU 8 26.673 8.705 -4.327
73 HD22 LEU 8 HD22 LEU 8 27.055 10.188 -5.235
74 HD23 LEU 8 HD23 LEU 8 25.946 8.983 -5.928
75 H LYS 9 HN LYS 9 23.495 10.755 -0.212
76 HA LYS 9 HA LYS 9 20.845 10.069 -1.243
77 HB2 LYS 9 HB2 LYS 9 22.289 8.099 -1.916
78 HB3 LYS 9 HB1 LYS 9 22.590 7.813 -0.187
79 HG2 LYS 9 HG2 LYS 9 20.279 7.346 0.245
80 HG3 LYS 9 HG1 LYS 9 19.775 7.986 -1.337
81 HD2 LYS 9 HD2 LYS 9 20.829 6.145 -2.499
82 HD3 LYS 9 HD1 LYS 9 21.603 5.574 -1.001
83 HE2 LYS 9 HE2 LYS 9 19.572 4.238 -1.586
84 HE3 LYS 9 HE1 LYS 9 19.409 5.068 -0.020
85 HZ1 LYS 9 HZ1 LYS 9 17.672 5.233 -2.125
86 HZ2 LYS 9 HZ2 LYS 9 18.542 6.690 -2.218
87 HZ3 LYS 9 HZ3 LYS 9 17.723 6.276 -0.789
88 H SER 10 HN SER 10 22.982 10.965 1.111
89 HA SER 10 HA SER 10 22.746 11.437 3.372
90 HB2 SER 10 HB2 SER 10 19.760 11.171 2.886
91 HB3 SER 10 HB1 SER 10 20.577 12.122 4.146
92 HG SER 10 HG SER 10 20.087 12.713 1.514
93 H LEU 11 HN LEU 11 22.920 8.621 2.432
94 HA LEU 11 HA LEU 11 21.210 6.946 3.982
95 HB2 LEU 11 HB2 LEU 11 22.672 6.171 2.116
96 HB3 LEU 11 HB1 LEU 11 24.095 6.454 3.140
97 HG LEU 11 HG LEU 11 23.190 4.812 4.806
98 HD11 LEU 11 HD11 LEU 11 20.847 4.722 4.535
99 HD12 LEU 11 HD12 LEU 11 21.354 3.233 3.710
100 HD13 LEU 11 HD13 LEU 11 20.948 4.681 2.758
101 HD21 LEU 11 HD21 LEU 11 23.710 2.820 3.459
102 HD22 LEU 11 HD22 LEU 11 24.797 4.158 3.014
103 HD23 LEU 11 HD23 LEU 11 23.426 3.737 1.960
104 H LEU 12 HN LEU 12 24.542 8.117 4.646
105 HA LEU 12 HA LEU 12 24.527 7.048 7.343
106 HB2 LEU 12 HB2 LEU 12 26.522 7.690 5.724
107 HB3 LEU 12 HB1 LEU 12 26.339 9.302 6.434
108 HG LEU 12 HG LEU 12 28.011 8.182 7.729
109 HD11 LEU 12 HD11 LEU 12 27.089 8.224 9.946
110 HD12 LEU 12 HD12 LEU 12 25.453 7.859 9.353
111 HD13 LEU 12 HD13 LEU 12 26.203 9.432 8.989
112 HD21 LEU 12 HD21 LEU 12 26.177 5.851 8.412
113 HD22 LEU 12 HD22 LEU 12 27.944 5.962 8.517
114 HD23 LEU 12 HD23 LEU 12 27.159 5.816 6.931
115 H LYS 13 HN LYS 13 23.131 7.784 8.819
116 HA LYS 13 HA LYS 13 22.011 10.441 8.750
117 HB2 LYS 13 HB2 LYS 13 21.228 9.844 11.086
118 HB3 LYS 13 HB1 LYS 13 20.772 8.677 9.823
119 HG2 LYS 13 HG2 LYS 13 22.574 7.182 10.456
120 HG3 LYS 13 HG1 LYS 13 23.247 8.389 11.578
121 HD2 LYS 13 HD2 LYS 13 21.286 8.241 13.009
122 HD3 LYS 13 HD1 LYS 13 20.458 7.188 11.837
123 HE2 LYS 13 HE2 LYS 13 23.073 6.490 13.241
124 HE3 LYS 13 HE1 LYS 13 21.468 5.914 13.749
125 HZ1 LYS 13 HZ1 LYS 13 21.802 4.253 12.324
126 HZ2 LYS 13 HZ2 LYS 13 23.138 5.011 11.598
127 HZ3 LYS 13 HZ3 LYS 13 21.563 5.374 11.074
Start of MODEL 15
1 H1 PHE 1 HT1 PHE 1 36.299 12.353 -6.736
2 H2 PHE 1 HT2 PHE 1 35.622 10.795 -6.796
3 H3 PHE 1 HT3 PHE 1 37.064 11.068 -5.939
4 HA PHE 1 HA PHE 1 35.421 10.901 -4.334
5 HB2 PHE 1 HB2 PHE 1 35.803 13.869 -4.884
6 HB3 PHE 1 HB1 PHE 1 35.472 13.099 -3.315
7 HD1 PHE 1 HD1 PHE 1 37.208 11.872 -2.112
8 HD2 PHE 1 HD2 PHE 1 38.003 13.619 -5.980
9 HE1 PHE 1 HE1 PHE 1 39.653 11.530 -1.766
10 HE2 PHE 1 HE2 PHE 1 40.446 13.278 -5.632
11 HZ PHE 1 HZ PHE 1 41.271 12.239 -3.522
12 H LEU 2 HN LEU 2 34.031 10.724 -6.905
13 HA LEU 2 HA LEU 2 31.795 12.609 -6.779
14 HB2 LEU 2 HB2 LEU 2 32.419 10.144 -8.438
15 HB3 LEU 2 HB1 LEU 2 30.826 10.928 -8.516
16 HG LEU 2 HG LEU 2 31.838 13.038 -9.200
17 HD11 LEU 2 HD11 LEU 2 34.443 11.565 -8.642
18 HD12 LEU 2 HD12 LEU 2 33.893 13.130 -7.995
19 HD13 LEU 2 HD13 LEU 2 34.383 12.997 -9.698
20 HD21 LEU 2 HD21 LEU 2 33.066 10.713 -10.753
21 HD22 LEU 2 HD22 LEU 2 32.756 12.352 -11.378
22 HD23 LEU 2 HD23 LEU 2 31.394 11.295 -10.936
23 HA PRO 3 HA PRO 3 29.537 8.933 -4.815
24 HB2 PRO 3 HB2 PRO 3 30.818 6.750 -3.907
25 HB3 PRO 3 HB1 PRO 3 30.571 7.000 -5.667
26 HG2 PRO 3 HG2 PRO 3 33.048 7.388 -4.014
27 HG3 PRO 3 HG1 PRO 3 32.877 6.776 -5.688
28 HD2 PRO 3 HD2 PRO 3 33.531 9.456 -4.933
29 HD3 PRO 3 HD1 PRO 3 33.052 8.908 -6.571
30 H ILE 4 HN ILE 4 28.711 9.110 -2.784
31 HA ILE 4 HA ILE 4 30.560 9.343 -0.457
32 HB ILE 4 HB ILE 4 28.390 11.438 -0.893
33 HG12 ILE 4 HG12 ILE 4 31.368 11.571 -1.555
34 HG13 ILE 4 HG11 ILE 4 30.016 11.723 -2.700
35 HG21 ILE 4 HG21 ILE 4 30.871 11.516 0.870
36 HG22 ILE 4 HG22 ILE 4 29.323 10.840 1.433
37 HG23 ILE 4 HG23 ILE 4 29.425 12.551 0.956
38 HD11 ILE 4 HD1 ILE 4 30.668 13.966 -2.275
39 HD12 ILE 4 HD2 ILE 4 30.883 13.666 -0.535
40 HD13 ILE 4 HD3 ILE 4 29.245 13.728 -1.232
41 H VAL 5 HN VAL 5 27.145 9.609 -1.548
42 HA VAL 5 HA VAL 5 25.279 8.472 -0.839
43 HB VAL 5 HB VAL 5 26.909 6.842 1.143
44 HG11 VAL 5 HG11 VAL 5 25.133 5.155 0.662
45 HG12 VAL 5 HG12 VAL 5 24.352 6.316 -0.436
46 HG13 VAL 5 HG13 VAL 5 24.458 6.667 1.304
47 HG21 VAL 5 HG21 VAL 5 26.936 5.131 -0.852
48 HG22 VAL 5 HG22 VAL 5 28.126 6.445 -0.869
49 HG23 VAL 5 HG23 VAL 5 26.668 6.557 -1.881
50 H GLY 6 HN GLY 6 27.411 10.103 1.089
51 HA2 GLY 6 HA1 GLY 6 25.544 10.367 3.397
52 HA3 GLY 6 HA2 GLY 6 27.208 10.989 3.301
53 H LEU 7 HN LEU 7 25.985 11.616 0.379
54 HA LEU 7 HA LEU 7 24.564 14.109 1.087
55 HB2 LEU 7 HB2 LEU 7 27.053 14.585 0.842
56 HB3 LEU 7 HB1 LEU 7 26.886 14.033 -0.840
57 HG LEU 7 HG LEU 7 24.969 15.820 -1.014
58 HD11 LEU 7 HD11 LEU 7 24.693 16.415 1.319
59 HD12 LEU 7 HD12 LEU 7 25.432 17.810 0.506
60 HD13 LEU 7 HD13 LEU 7 26.433 16.732 1.506
61 HD21 LEU 7 HD21 LEU 7 27.167 15.998 -2.148
62 HD22 LEU 7 HD22 LEU 7 27.873 16.696 -0.671
63 HD23 LEU 7 HD23 LEU 7 26.615 17.585 -1.564
64 H LEU 8 HN LEU 8 25.482 11.648 -0.931
65 HA LEU 8 HA LEU 8 23.649 12.423 -3.153
66 HB2 LEU 8 HB2 LEU 8 25.734 10.259 -2.743
67 HB3 LEU 8 HB1 LEU 8 24.534 10.105 -4.047
68 HG LEU 8 HG LEU 8 25.238 12.227 -5.022
69 HD11 LEU 8 HD11 LEU 8 27.003 12.392 -2.549
70 HD12 LEU 8 HD12 LEU 8 25.761 13.549 -3.080
71 HD13 LEU 8 HD13 LEU 8 27.278 13.388 -3.996
72 HD21 LEU 8 HD21 LEU 8 27.682 10.568 -4.261
73 HD22 LEU 8 HD22 LEU 8 27.521 11.626 -5.683
74 HD23 LEU 8 HD23 LEU 8 26.536 10.148 -5.555
75 H LYS 9 HN LYS 9 23.343 11.034 -0.175
76 HA LYS 9 HA LYS 9 20.715 10.037 -0.758
77 HB2 LYS 9 HB2 LYS 9 22.341 8.179 -1.635
78 HB3 LYS 9 HB1 LYS 9 22.592 7.813 0.085
79 HG2 LYS 9 HG2 LYS 9 20.045 7.664 0.304
80 HG3 LYS 9 HG1 LYS 9 19.964 7.753 -1.467
81 HD2 LYS 9 HD2 LYS 9 21.681 5.673 -0.046
82 HD3 LYS 9 HD1 LYS 9 19.960 5.394 -0.382
83 HE2 LYS 9 HE2 LYS 9 22.125 5.999 -2.446
84 HE3 LYS 9 HE1 LYS 9 21.313 4.440 -2.188
85 HZ1 LYS 9 HZ1 LYS 9 20.282 6.902 -3.407
86 HZ2 LYS 9 HZ2 LYS 9 19.192 5.924 -2.547
87 HZ3 LYS 9 HZ3 LYS 9 20.053 5.286 -3.866
88 H SER 10 HN SER 10 23.167 11.050 1.211
89 HA SER 10 HA SER 10 23.385 11.325 3.521
90 HB2 SER 10 HB2 SER 10 21.619 12.899 3.240
91 HB3 SER 10 HB1 SER 10 20.400 11.618 3.062
92 HG SER 10 HG SER 10 20.220 12.206 5.145
93 H LEU 11 HN LEU 11 24.154 9.109 3.790
94 HA LEU 11 HA LEU 11 24.086 7.016 4.795
95 HB2 LEU 11 HB2 LEU 11 22.160 8.634 6.497
96 HB3 LEU 11 HB1 LEU 11 22.515 6.933 6.875
97 HG LEU 11 HG LEU 11 24.953 7.483 6.952
98 HD11 LEU 11 HD11 LEU 11 25.451 10.024 7.164
99 HD12 LEU 11 HD12 LEU 11 23.882 10.270 6.357
100 HD13 LEU 11 HD13 LEU 11 25.183 9.380 5.528
101 HD21 LEU 11 HD21 LEU 11 24.878 8.584 9.112
102 HD22 LEU 11 HD22 LEU 11 23.430 7.560 8.979
103 HD23 LEU 11 HD23 LEU 11 23.301 9.319 8.741
104 H LEU 12 HN LEU 12 20.857 7.110 5.949
105 HA LEU 12 HA LEU 12 20.111 4.912 4.161
106 HB2 LEU 12 HB2 LEU 12 18.247 6.415 6.028
107 HB3 LEU 12 HB1 LEU 12 18.164 4.716 5.503
108 HG LEU 12 HG LEU 12 20.276 5.959 7.320
109 HD11 LEU 12 HD11 LEU 12 18.014 5.494 8.320
110 HD12 LEU 12 HD12 LEU 12 19.312 4.504 9.029
111 HD13 LEU 12 HD13 LEU 12 18.195 3.789 7.840
112 HD21 LEU 12 HD21 LEU 12 20.020 3.199 6.053
113 HD22 LEU 12 HD22 LEU 12 20.971 3.474 7.533
114 HD23 LEU 12 HD23 LEU 12 21.418 4.299 6.023
115 H LYS 13 HN LYS 13 17.635 5.107 3.391
116 HA LYS 13 HA LYS 13 17.737 7.032 1.223
117 HB2 LYS 13 HB2 LYS 13 15.384 6.173 0.786
118 HB3 LYS 13 HB1 LYS 13 16.656 4.929 0.822
119 HG2 LYS 13 HG2 LYS 13 16.047 4.232 3.041
120 HG3 LYS 13 HG1 LYS 13 15.004 5.653 3.276
121 HD2 LYS 13 HD2 LYS 13 13.692 3.585 2.776
122 HD3 LYS 13 HD1 LYS 13 13.456 4.854 1.551
123 HE2 LYS 13 HE2 LYS 13 13.889 2.422 0.719
124 HE3 LYS 13 HE1 LYS 13 14.812 3.737 -0.043
125 HZ1 LYS 13 HZ1 LYS 13 16.307 1.983 0.518
126 HZ2 LYS 13 HZ2 LYS 13 15.733 1.905 2.115
127 HZ3 LYS 13 HZ3 LYS 13 16.606 3.265 1.587
Start of MODEL 16
1 H1 PHE 1 HT1 PHE 1 30.408 13.213 5.125
2 H2 PHE 1 HT2 PHE 1 32.027 13.562 4.741
3 H3 PHE 1 HT3 PHE 1 31.357 12.055 4.331
4 HA PHE 1 HA PHE 1 29.679 13.833 3.179
5 HB2 PHE 1 HB2 PHE 1 32.578 14.718 2.887
6 HB3 PHE 1 HB1 PHE 1 31.239 15.273 1.854
7 HD1 PHE 1 HD1 PHE 1 29.644 16.904 2.641
8 HD2 PHE 1 HD2 PHE 1 32.554 15.222 5.349
9 HE1 PHE 1 HE1 PHE 1 29.042 18.615 4.350
10 HE2 PHE 1 HE2 PHE 1 31.953 16.934 7.057
11 HZ PHE 1 HZ PHE 1 30.252 18.676 6.527
12 H LEU 2 HN LEU 2 32.167 13.922 1.027
13 HA LEU 2 HA LEU 2 32.731 12.619 -0.793
14 HB2 LEU 2 HB2 LEU 2 32.108 10.185 0.922
15 HB3 LEU 2 HB1 LEU 2 33.255 10.305 -0.426
16 HG LEU 2 HG LEU 2 33.506 11.801 2.223
17 HD11 LEU 2 HD11 LEU 2 35.037 9.405 1.118
18 HD12 LEU 2 HD12 LEU 2 33.842 9.351 2.438
19 HD13 LEU 2 HD13 LEU 2 35.370 10.238 2.654
20 HD21 LEU 2 HD21 LEU 2 34.601 13.104 0.541
21 HD22 LEU 2 HD22 LEU 2 35.206 11.658 -0.303
22 HD23 LEU 2 HD23 LEU 2 35.898 12.129 1.270
23 HA PRO 3 HA PRO 3 28.820 11.750 -2.736
24 HB2 PRO 3 HB2 PRO 3 29.611 10.399 -5.003
25 HB3 PRO 3 HB1 PRO 3 29.852 12.162 -4.784
26 HG2 PRO 3 HG2 PRO 3 31.807 9.908 -4.369
27 HG3 PRO 3 HG1 PRO 3 32.048 11.487 -5.182
28 HD2 PRO 3 HD2 PRO 3 32.868 11.047 -2.614
29 HD3 PRO 3 HD1 PRO 3 32.272 12.648 -3.156
30 H ILE 4 HN ILE 4 27.800 9.695 -4.044
31 HA ILE 4 HA ILE 4 26.955 7.550 -3.851
32 HB ILE 4 HB ILE 4 29.499 6.818 -2.355
33 HG12 ILE 4 HG12 ILE 4 29.004 6.793 -5.375
34 HG13 ILE 4 HG11 ILE 4 29.948 8.043 -4.538
35 HG21 ILE 4 HG21 ILE 4 27.453 5.262 -3.994
36 HG22 ILE 4 HG22 ILE 4 27.858 5.052 -2.275
37 HG23 ILE 4 HG23 ILE 4 29.030 4.595 -3.522
38 HD11 ILE 4 HD1 ILE 4 31.272 5.888 -3.583
39 HD12 ILE 4 HD2 ILE 4 31.681 6.613 -5.154
40 HD13 ILE 4 HD3 ILE 4 30.658 5.162 -5.089
41 H VAL 5 HN VAL 5 27.855 9.373 -1.060
42 HA VAL 5 HA VAL 5 25.675 8.266 0.491
43 HB VAL 5 HB VAL 5 27.167 7.569 2.470
44 HG11 VAL 5 HG11 VAL 5 27.661 5.675 0.152
45 HG12 VAL 5 HG12 VAL 5 26.003 5.958 0.746
46 HG13 VAL 5 HG13 VAL 5 27.243 5.310 1.839
47 HG21 VAL 5 HG21 VAL 5 29.247 8.592 1.657
48 HG22 VAL 5 HG22 VAL 5 29.255 7.505 0.247
49 HG23 VAL 5 HG23 VAL 5 29.476 6.842 1.883
50 H GLY 6 HN GLY 6 25.470 9.336 2.580
51 HA2 GLY 6 HA1 GLY 6 25.322 11.376 3.672
52 HA3 GLY 6 HA2 GLY 6 27.089 11.235 3.722
53 H LEU 7 HN LEU 7 25.733 11.416 0.583
54 HA LEU 7 HA LEU 7 25.599 14.255 0.385
55 HB2 LEU 7 HB2 LEU 7 28.087 13.948 0.556
56 HB3 LEU 7 HB1 LEU 7 27.987 12.964 -0.915
57 HG LEU 7 HG LEU 7 26.882 15.006 -2.045
58 HD11 LEU 7 HD11 LEU 7 27.654 17.212 -0.929
59 HD12 LEU 7 HD12 LEU 7 27.847 16.259 0.558
60 HD13 LEU 7 HD13 LEU 7 26.249 16.401 -0.209
61 HD21 LEU 7 HD21 LEU 7 29.752 15.256 -1.043
62 HD22 LEU 7 HD22 LEU 7 29.072 16.075 -2.468
63 HD23 LEU 7 HD23 LEU 7 29.225 14.303 -2.450
64 H LEU 8 HN LEU 8 25.863 11.198 -0.874
65 HA LEU 8 HA LEU 8 24.117 11.991 -3.223
66 HB2 LEU 8 HB2 LEU 8 26.655 10.953 -3.404
67 HB3 LEU 8 HB1 LEU 8 25.697 9.461 -3.448
68 HG LEU 8 HG LEU 8 25.281 11.883 -5.270
69 HD11 LEU 8 HD11 LEU 8 27.390 10.722 -5.763
70 HD12 LEU 8 HD12 LEU 8 26.193 10.374 -7.033
71 HD13 LEU 8 HD13 LEU 8 26.546 9.156 -5.784
72 HD21 LEU 8 HD21 LEU 8 23.193 10.696 -4.988
73 HD22 LEU 8 HD22 LEU 8 24.004 9.117 -5.138
74 HD23 LEU 8 HD23 LEU 8 23.871 10.189 -6.551
75 H LYS 9 HN LYS 9 23.763 10.845 -0.277
76 HA LYS 9 HA LYS 9 21.396 9.362 -0.985
77 HB2 LYS 9 HB2 LYS 9 23.373 7.678 -1.325
78 HB3 LYS 9 HB1 LYS 9 23.421 7.626 0.451
79 HG2 LYS 9 HG2 LYS 9 21.045 6.960 0.516
80 HG3 LYS 9 HG1 LYS 9 20.958 7.054 -1.259
81 HD2 LYS 9 HD2 LYS 9 22.846 5.342 -1.333
82 HD3 LYS 9 HD1 LYS 9 22.621 5.135 0.422
83 HE2 LYS 9 HE2 LYS 9 21.322 3.428 -0.754
84 HE3 LYS 9 HE1 LYS 9 20.207 4.590 0.003
85 HZ1 LYS 9 HZ1 LYS 9 20.717 5.669 -2.446
86 HZ2 LYS 9 HZ2 LYS 9 19.330 4.787 -2.021
87 HZ3 LYS 9 HZ3 LYS 9 20.635 4.009 -2.778
88 H SER 10 HN SER 10 23.300 11.107 1.076
89 HA SER 10 HA SER 10 23.046 11.796 3.287
90 HB2 SER 10 HB2 SER 10 21.017 12.784 2.485
91 HB3 SER 10 HB1 SER 10 20.178 11.216 2.480
92 HG SER 10 HG SER 10 20.176 12.935 4.404
93 H LEU 11 HN LEU 11 23.934 9.167 3.123
94 HA LEU 11 HA LEU 11 24.025 7.174 4.321
95 HB2 LEU 11 HB2 LEU 11 22.799 8.751 6.610
96 HB3 LEU 11 HB1 LEU 11 23.957 7.402 6.692
97 HG LEU 11 HG LEU 11 24.504 10.179 5.553
98 HD11 LEU 11 HD11 LEU 11 24.332 9.945 8.072
99 HD12 LEU 11 HD12 LEU 11 25.929 10.472 7.492
100 HD13 LEU 11 HD13 LEU 11 25.677 8.783 7.995
101 HD21 LEU 11 HD21 LEU 11 26.158 7.624 5.694
102 HD22 LEU 11 HD22 LEU 11 26.923 9.227 5.576
103 HD23 LEU 11 HD23 LEU 11 25.843 8.662 4.282
104 H LEU 12 HN LEU 12 22.288 6.497 6.618
105 HA LEU 12 HA LEU 12 20.164 5.213 5.073
106 HB2 LEU 12 HB2 LEU 12 20.366 5.314 8.101
107 HB3 LEU 12 HB1 LEU 12 19.658 4.043 7.075
108 HG LEU 12 HG LEU 12 22.614 4.777 7.266
109 HD11 LEU 12 HD11 LEU 12 22.870 2.618 8.329
110 HD12 LEU 12 HD12 LEU 12 21.169 2.200 8.012
111 HD13 LEU 12 HD13 LEU 12 21.569 3.481 9.182
112 HD21 LEU 12 HD21 LEU 12 22.234 4.097 5.001
113 HD22 LEU 12 HD22 LEU 12 21.074 2.837 5.490
114 HD23 LEU 12 HD23 LEU 12 22.809 2.632 5.830
115 H LYS 13 HN LYS 13 19.467 7.532 4.376
116 HA LYS 13 HA LYS 13 18.060 9.210 6.198
117 HB2 LYS 13 HB2 LYS 13 18.733 9.787 3.836
118 HB3 LYS 13 HB1 LYS 13 17.394 8.761 3.265
119 HG2 LYS 13 HG2 LYS 13 15.772 10.135 4.502
120 HG3 LYS 13 HG1 LYS 13 17.092 11.136 5.155
121 HD2 LYS 13 HD2 LYS 13 17.690 11.898 2.913
122 HD3 LYS 13 HD1 LYS 13 16.489 10.804 2.185
123 HE2 LYS 13 HE2 LYS 13 14.657 12.028 3.158
124 HE3 LYS 13 HE1 LYS 13 15.755 12.974 4.192
125 HZ1 LYS 13 HZ1 LYS 13 16.782 13.602 1.878
126 HZ2 LYS 13 HZ2 LYS 13 15.423 14.425 2.480
127 HZ3 LYS 13 HZ3 LYS 13 15.233 13.210 1.309
Start of MODEL 17
1 H1 PHE 1 HT1 PHE 1 31.529 11.933 -10.870
2 H2 PHE 1 HT2 PHE 1 30.556 11.075 -9.771
3 H3 PHE 1 HT3 PHE 1 31.695 10.252 -10.728
4 HA PHE 1 HA PHE 1 33.488 11.103 -9.585
5 HB2 PHE 1 HB2 PHE 1 31.537 12.965 -8.173
6 HB3 PHE 1 HB1 PHE 1 33.306 12.924 -7.980
7 HD1 PHE 1 HD1 PHE 1 30.507 14.004 -10.108
8 HD2 PHE 1 HD2 PHE 1 34.799 13.604 -9.862
9 HE1 PHE 1 HE1 PHE 1 30.764 15.543 -12.052
10 HE2 PHE 1 HE2 PHE 1 35.054 15.143 -11.803
11 HZ PHE 1 HZ PHE 1 33.037 16.132 -12.883
12 H LEU 2 HN LEU 2 31.350 9.050 -9.254
13 HA LEU 2 HA LEU 2 30.807 7.411 -7.724
14 HB2 LEU 2 HB2 LEU 2 33.010 8.515 -5.944
15 HB3 LEU 2 HB1 LEU 2 32.404 6.847 -6.029
16 HG LEU 2 HG LEU 2 33.864 8.312 -8.277
17 HD11 LEU 2 HD11 LEU 2 35.723 6.803 -7.758
18 HD12 LEU 2 HD12 LEU 2 34.767 6.024 -6.473
19 HD13 LEU 2 HD13 LEU 2 35.281 7.720 -6.299
20 HD21 LEU 2 HD21 LEU 2 32.404 6.719 -9.299
21 HD22 LEU 2 HD22 LEU 2 32.664 5.524 -8.004
22 HD23 LEU 2 HD23 LEU 2 33.963 5.875 -9.169
23 HA PRO 3 HA PRO 3 28.135 9.519 -4.845
24 HB2 PRO 3 HB2 PRO 3 27.136 7.454 -3.371
25 HB3 PRO 3 HB1 PRO 3 26.730 7.661 -5.106
26 HG2 PRO 3 HG2 PRO 3 28.785 5.856 -3.837
27 HG3 PRO 3 HG1 PRO 3 27.581 5.484 -5.113
28 HD2 PRO 3 HD2 PRO 3 30.207 6.069 -5.691
29 HD3 PRO 3 HD1 PRO 3 28.858 6.483 -6.799
30 H ILE 4 HN ILE 4 28.774 10.771 -3.192
31 HA ILE 4 HA ILE 4 30.954 9.957 -1.442
32 HB ILE 4 HB ILE 4 29.035 12.292 -1.055
33 HG12 ILE 4 HG12 ILE 4 30.221 12.145 -3.377
34 HG13 ILE 4 HG11 ILE 4 30.373 13.655 -2.461
35 HG21 ILE 4 HG21 ILE 4 31.103 13.277 0.059
36 HG22 ILE 4 HG22 ILE 4 31.832 11.656 -0.043
37 HG23 ILE 4 HG23 ILE 4 30.349 11.908 0.909
38 HD11 ILE 4 HD1 ILE 4 32.614 13.112 -1.762
39 HD12 ILE 4 HD2 ILE 4 32.530 12.785 -3.507
40 HD13 ILE 4 HD3 ILE 4 32.467 11.441 -2.350
41 H VAL 5 HN VAL 5 27.477 9.748 -1.365
42 HA VAL 5 HA VAL 5 26.091 8.694 0.137
43 HB VAL 5 HB VAL 5 28.367 8.055 2.046
44 HG11 VAL 5 HG11 VAL 5 25.827 6.596 1.196
45 HG12 VAL 5 HG12 VAL 5 26.079 7.479 2.719
46 HG13 VAL 5 HG13 VAL 5 27.001 5.998 2.393
47 HG21 VAL 5 HG21 VAL 5 29.438 7.229 0.110
48 HG22 VAL 5 HG22 VAL 5 27.902 6.903 -0.726
49 HG23 VAL 5 HG23 VAL 5 28.465 5.822 0.569
50 H GLY 6 HN GLY 6 25.221 9.015 2.347
51 HA2 GLY 6 HA1 GLY 6 24.442 10.611 3.846
52 HA3 GLY 6 HA2 GLY 6 26.160 10.817 4.247
53 H LEU 7 HN LEU 7 25.399 11.463 0.978
54 HA LEU 7 HA LEU 7 24.628 14.210 1.293
55 HB2 LEU 7 HB2 LEU 7 26.998 14.432 1.924
56 HB3 LEU 7 HB1 LEU 7 27.455 13.623 0.410
57 HG LEU 7 HG LEU 7 26.422 15.489 -0.888
58 HD11 LEU 7 HD11 LEU 7 25.971 17.629 0.577
59 HD12 LEU 7 HD12 LEU 7 25.751 16.472 1.911
60 HD13 LEU 7 HD13 LEU 7 24.705 16.388 0.473
61 HD21 LEU 7 HD21 LEU 7 28.401 16.410 1.244
62 HD22 LEU 7 HD22 LEU 7 28.139 17.171 -0.344
63 HD23 LEU 7 HD23 LEU 7 28.827 15.531 -0.243
64 H LEU 8 HN LEU 8 25.760 11.626 -0.449
65 HA LEU 8 HA LEU 8 24.392 12.582 -2.969
66 HB2 LEU 8 HB2 LEU 8 26.905 10.962 -2.513
67 HB3 LEU 8 HB1 LEU 8 25.953 10.656 -3.975
68 HG LEU 8 HG LEU 8 27.883 12.348 -4.161
69 HD11 LEU 8 HD11 LEU 8 25.944 12.124 -5.790
70 HD12 LEU 8 HD12 LEU 8 26.720 13.720 -5.745
71 HD13 LEU 8 HD13 LEU 8 25.159 13.474 -4.940
72 HD21 LEU 8 HD21 LEU 8 27.177 13.478 -1.932
73 HD22 LEU 8 HD22 LEU 8 25.942 14.317 -2.897
74 HD23 LEU 8 HD23 LEU 8 27.663 14.532 -3.276
75 H LYS 9 HN LYS 9 23.788 10.883 -0.334
76 HA LYS 9 HA LYS 9 21.843 9.190 -1.674
77 HB2 LYS 9 HB2 LYS 9 24.074 7.890 -1.797
78 HB3 LYS 9 HB1 LYS 9 23.929 7.716 -0.033
79 HG2 LYS 9 HG2 LYS 9 21.766 6.590 -0.284
80 HG3 LYS 9 HG1 LYS 9 21.797 6.857 -2.043
81 HD2 LYS 9 HD2 LYS 9 23.970 5.538 -2.107
82 HD3 LYS 9 HD1 LYS 9 23.685 5.120 -0.399
83 HE2 LYS 9 HE2 LYS 9 22.826 3.335 -1.865
84 HE3 LYS 9 HE1 LYS 9 21.480 4.141 -1.024
85 HZ1 LYS 9 HZ1 LYS 9 22.086 5.473 -3.458
86 HZ2 LYS 9 HZ2 LYS 9 20.628 4.760 -2.959
87 HZ3 LYS 9 HZ3 LYS 9 21.804 3.827 -3.754
88 H SER 10 HN SER 10 23.075 10.916 0.857
89 HA SER 10 HA SER 10 22.324 11.376 3.005
90 HB2 SER 10 HB2 SER 10 20.269 11.926 1.720
91 HB3 SER 10 HB1 SER 10 19.710 10.251 1.924
92 HG SER 10 HG SER 10 18.828 11.304 3.611
93 H LEU 11 HN LEU 11 22.905 8.359 2.008
94 HA LEU 11 HA LEU 11 22.937 6.267 3.019
95 HB2 LEU 11 HB2 LEU 11 24.352 7.916 4.524
96 HB3 LEU 11 HB1 LEU 11 23.045 7.679 5.703
97 HG LEU 11 HG LEU 11 24.753 5.494 4.421
98 HD11 LEU 11 HD11 LEU 11 24.557 6.523 7.288
99 HD12 LEU 11 HD12 LEU 11 25.899 6.841 6.162
100 HD13 LEU 11 HD13 LEU 11 25.587 5.183 6.731
101 HD21 LEU 11 HD21 LEU 11 22.615 4.498 4.761
102 HD22 LEU 11 HD22 LEU 11 22.330 5.408 6.265
103 HD23 LEU 11 HD23 LEU 11 23.517 4.083 6.234
104 H LEU 12 HN LEU 12 20.859 5.520 2.542
105 HA LEU 12 HA LEU 12 18.498 6.216 3.970
106 HB2 LEU 12 HB2 LEU 12 19.351 3.751 2.415
107 HB3 LEU 12 HB1 LEU 12 17.757 3.834 3.200
108 HG LEU 12 HG LEU 12 17.269 5.936 1.954
109 HD11 LEU 12 HD11 LEU 12 19.413 6.901 1.556
110 HD12 LEU 12 HD12 LEU 12 18.856 6.380 -0.051
111 HD13 LEU 12 HD13 LEU 12 20.049 5.401 0.839
112 HD21 LEU 12 HD21 LEU 12 16.868 4.873 -0.186
113 HD22 LEU 12 HD22 LEU 12 16.713 3.619 1.068
114 HD23 LEU 12 HD23 LEU 12 18.192 3.715 0.081
115 H LYS 13 HN LYS 13 18.281 6.141 6.114
116 HA LYS 13 HA LYS 13 19.793 4.446 7.838
117 HB2 LYS 13 HB2 LYS 13 18.493 6.570 8.439
118 HB3 LYS 13 HB1 LYS 13 17.030 5.561 8.436
119 HG2 LYS 13 HG2 LYS 13 17.624 5.410 10.696
120 HG3 LYS 13 HG1 LYS 13 18.485 3.994 10.054
121 HD2 LYS 13 HD2 LYS 13 20.557 5.382 9.842
122 HD3 LYS 13 HD1 LYS 13 19.679 6.766 10.533
123 HE2 LYS 13 HE2 LYS 13 20.217 4.090 11.892
124 HE3 LYS 13 HE1 LYS 13 20.952 5.658 12.303
125 HZ1 LYS 13 HZ1 LYS 13 19.244 5.992 13.656
126 HZ2 LYS 13 HZ2 LYS 13 18.458 4.584 13.123
127 HZ3 LYS 13 HZ3 LYS 13 18.212 6.056 12.310
Start of MODEL 18
1 H1 PHE 1 HT1 PHE 1 31.646 12.792 -8.520
2 H2 PHE 1 HT2 PHE 1 33.086 13.600 -8.921
3 H3 PHE 1 HT3 PHE 1 31.600 14.422 -8.985
4 HA PHE 1 HA PHE 1 33.223 14.693 -6.991
5 HB2 PHE 1 HB2 PHE 1 30.209 14.363 -6.705
6 HB3 PHE 1 HB1 PHE 1 31.274 15.280 -5.614
7 HD1 PHE 1 HD1 PHE 1 32.564 17.271 -6.517
8 HD2 PHE 1 HD2 PHE 1 29.436 15.325 -8.767
9 HE1 PHE 1 HE1 PHE 1 32.386 19.268 -7.997
10 HE2 PHE 1 HE2 PHE 1 29.259 17.322 -10.248
11 HZ PHE 1 HZ PHE 1 30.734 19.293 -9.863
12 H LEU 2 HN LEU 2 32.944 11.745 -7.794
13 HA LEU 2 HA LEU 2 33.150 9.695 -6.767
14 HB2 LEU 2 HB2 LEU 2 34.069 11.579 -4.575
15 HB3 LEU 2 HB1 LEU 2 33.992 9.832 -4.276
16 HG LEU 2 HG LEU 2 35.510 9.393 -6.137
17 HD11 LEU 2 HD11 LEU 2 35.217 12.386 -6.623
18 HD12 LEU 2 HD12 LEU 2 34.893 11.049 -7.755
19 HD13 LEU 2 HD13 LEU 2 36.567 11.439 -7.294
20 HD21 LEU 2 HD21 LEU 2 36.453 10.049 -3.901
21 HD22 LEU 2 HD22 LEU 2 36.555 11.731 -4.476
22 HD23 LEU 2 HD23 LEU 2 37.530 10.463 -5.257
23 HA PRO 3 HA PRO 3 29.246 8.896 -4.818
24 HB2 PRO 3 HB2 PRO 3 29.562 6.356 -3.862
25 HB3 PRO 3 HB1 PRO 3 29.513 6.712 -5.620
26 HG2 PRO 3 HG2 PRO 3 31.905 6.284 -3.835
27 HG3 PRO 3 HG1 PRO 3 31.562 5.599 -5.456
28 HD2 PRO 3 HD2 PRO 3 33.195 7.778 -5.105
29 HD3 PRO 3 HD1 PRO 3 32.177 7.565 -6.568
30 H ILE 4 HN ILE 4 29.117 10.385 -3.134
31 HA ILE 4 HA ILE 4 30.584 9.960 -0.632
32 HB ILE 4 HB ILE 4 28.203 11.811 -1.074
33 HG12 ILE 4 HG12 ILE 4 31.159 12.222 -1.728
34 HG13 ILE 4 HG11 ILE 4 29.807 12.204 -2.885
35 HG21 ILE 4 HG21 ILE 4 29.189 11.357 1.266
36 HG22 ILE 4 HG22 ILE 4 29.125 13.058 0.756
37 HG23 ILE 4 HG23 ILE 4 30.664 12.166 0.688
38 HD11 ILE 4 HD1 ILE 4 30.235 14.513 -2.516
39 HD12 ILE 4 HD2 ILE 4 30.452 14.283 -0.766
40 HD13 ILE 4 HD3 ILE 4 28.828 14.162 -1.486
41 H VAL 5 HN VAL 5 27.137 9.838 -1.629
42 HA VAL 5 HA VAL 5 25.401 8.568 -0.832
43 HB VAL 5 HB VAL 5 27.293 7.046 0.988
44 HG11 VAL 5 HG11 VAL 5 25.629 5.208 0.541
45 HG12 VAL 5 HG12 VAL 5 24.645 6.376 -0.370
46 HG13 VAL 5 HG13 VAL 5 24.920 6.610 1.370
47 HG21 VAL 5 HG21 VAL 5 27.380 5.401 -1.009
48 HG22 VAL 5 HG22 VAL 5 28.340 6.884 -1.173
49 HG23 VAL 5 HG23 VAL 5 26.772 6.748 -2.001
50 H GLY 6 HN GLY 6 27.447 10.342 1.065
51 HA2 GLY 6 HA1 GLY 6 25.604 10.367 3.421
52 HA3 GLY 6 HA2 GLY 6 27.248 11.044 3.369
53 H LEU 7 HN LEU 7 25.746 11.686 0.511
54 HA LEU 7 HA LEU 7 24.249 14.060 1.318
55 HB2 LEU 7 HB2 LEU 7 26.646 14.829 1.307
56 HB3 LEU 7 HB1 LEU 7 26.735 14.296 -0.386
57 HG LEU 7 HG LEU 7 24.833 15.887 -0.920
58 HD11 LEU 7 HD11 LEU 7 23.725 16.312 1.132
59 HD12 LEU 7 HD12 LEU 7 24.654 17.802 0.873
60 HD13 LEU 7 HD13 LEU 7 25.247 16.575 2.015
61 HD21 LEU 7 HD21 LEU 7 27.308 17.156 0.336
62 HD22 LEU 7 HD22 LEU 7 26.271 17.876 -0.920
63 HD23 LEU 7 HD23 LEU 7 27.245 16.433 -1.289
64 H LEU 8 HN LEU 8 25.534 11.836 -0.769
65 HA LEU 8 HA LEU 8 23.890 12.589 -3.110
66 HB2 LEU 8 HB2 LEU 8 26.348 11.372 -2.860
67 HB3 LEU 8 HB1 LEU 8 25.314 9.945 -3.071
68 HG LEU 8 HG LEU 8 25.404 12.365 -4.936
69 HD11 LEU 8 HD11 LEU 8 27.447 10.904 -4.963
70 HD12 LEU 8 HD12 LEU 8 26.538 10.856 -6.494
71 HD13 LEU 8 HD13 LEU 8 26.405 9.511 -5.336
72 HD21 LEU 8 HD21 LEU 8 23.821 9.761 -4.941
73 HD22 LEU 8 HD22 LEU 8 24.091 10.706 -6.425
74 HD23 LEU 8 HD23 LEU 8 23.205 11.427 -5.063
75 H LYS 9 HN LYS 9 23.453 11.029 -0.231
76 HA LYS 9 HA LYS 9 20.854 10.072 -0.945
77 HB2 LYS 9 HB2 LYS 9 22.440 8.277 -1.959
78 HB3 LYS 9 HB1 LYS 9 22.744 7.798 -0.275
79 HG2 LYS 9 HG2 LYS 9 20.344 7.388 0.074
80 HG3 LYS 9 HG1 LYS 9 19.985 7.962 -1.572
81 HD2 LYS 9 HD2 LYS 9 21.446 6.136 -2.480
82 HD3 LYS 9 HD1 LYS 9 21.660 5.528 -0.820
83 HE2 LYS 9 HE2 LYS 9 19.869 4.257 -1.861
84 HE3 LYS 9 HE1 LYS 9 19.148 5.335 -0.642
85 HZ1 LYS 9 HZ1 LYS 9 18.806 5.311 -3.495
86 HZ2 LYS 9 HZ2 LYS 9 19.203 6.852 -2.902
87 HZ3 LYS 9 HZ3 LYS 9 17.847 6.029 -2.294
88 H SER 10 HN SER 10 23.255 10.908 1.166
89 HA SER 10 HA SER 10 23.352 11.076 3.485
90 HB2 SER 10 HB2 SER 10 20.324 10.872 3.315
91 HB3 SER 10 HB1 SER 10 21.280 11.619 4.615
92 HG SER 10 HG SER 10 20.390 12.740 2.394
93 H LEU 11 HN LEU 11 24.377 9.169 4.025
94 HA LEU 11 HA LEU 11 22.827 6.686 4.311
95 HB2 LEU 11 HB2 LEU 11 25.392 7.115 3.682
96 HB3 LEU 11 HB1 LEU 11 25.618 7.041 5.439
97 HG LEU 11 HG LEU 11 24.311 4.901 3.693
98 HD11 LEU 11 HD11 LEU 11 26.292 3.571 4.265
99 HD12 LEU 11 HD12 LEU 11 26.921 4.895 5.276
100 HD13 LEU 11 HD13 LEU 11 26.801 5.101 3.511
101 HD21 LEU 11 HD21 LEU 11 23.226 4.851 5.840
102 HD22 LEU 11 HD22 LEU 11 24.761 5.122 6.699
103 HD23 LEU 11 HD23 LEU 11 24.458 3.570 5.882
104 H LEU 12 HN LEU 12 21.238 7.727 5.805
105 HA LEU 12 HA LEU 12 22.260 8.088 8.596
106 HB2 LEU 12 HB2 LEU 12 19.689 8.652 8.912
107 HB3 LEU 12 HB1 LEU 12 20.766 9.827 8.126
108 HG LEU 12 HG LEU 12 20.046 9.092 5.914
109 HD11 LEU 12 HD11 LEU 12 18.525 6.981 7.494
110 HD12 LEU 12 HD12 LEU 12 19.683 6.741 6.163
111 HD13 LEU 12 HD13 LEU 12 18.075 7.420 5.830
112 HD21 LEU 12 HD21 LEU 12 17.689 9.500 7.808
113 HD22 LEU 12 HD22 LEU 12 17.655 9.755 6.048
114 HD23 LEU 12 HD23 LEU 12 18.674 10.789 7.077
115 H LYS 13 HN LYS 13 21.969 5.473 7.001
116 HA LYS 13 HA LYS 13 21.276 3.301 7.433
117 HB2 LYS 13 HB2 LYS 13 21.279 4.427 10.260
118 HB3 LYS 13 HB1 LYS 13 21.085 2.699 9.876
119 HG2 LYS 13 HG2 LYS 13 23.260 2.764 8.640
120 HG3 LYS 13 HG1 LYS 13 23.463 4.460 9.141
121 HD2 LYS 13 HD2 LYS 13 23.294 3.721 11.537
122 HD3 LYS 13 HD1 LYS 13 23.251 2.033 10.973
123 HE2 LYS 13 HE2 LYS 13 25.545 2.538 11.552
124 HE3 LYS 13 HE1 LYS 13 25.448 2.475 9.776
125 HZ1 LYS 13 HZ1 LYS 13 26.211 4.540 9.726
126 HZ2 LYS 13 HZ2 LYS 13 26.231 4.624 11.423
127 HZ3 LYS 13 HZ3 LYS 13 24.840 5.081 10.564
Start of MODEL 19
1 H1 PHE 1 HT1 PHE 1 32.030 10.799 -11.653
2 H2 PHE 1 HT2 PHE 1 30.958 12.107 -11.495
3 H3 PHE 1 HT3 PHE 1 30.504 10.562 -10.954
4 HA PHE 1 HA PHE 1 32.916 11.738 -9.844
5 HB2 PHE 1 HB2 PHE 1 30.144 12.493 -8.855
6 HB3 PHE 1 HB1 PHE 1 31.714 13.094 -8.270
7 HD1 PHE 1 HD1 PHE 1 29.157 13.341 -10.909
8 HD2 PHE 1 HD2 PHE 1 33.091 14.615 -9.672
9 HE1 PHE 1 HE1 PHE 1 29.103 15.161 -12.612
10 HE2 PHE 1 HE2 PHE 1 33.037 16.434 -11.374
11 HZ PHE 1 HZ PHE 1 31.081 16.646 -12.904
12 H LEU 2 HN LEU 2 33.491 10.711 -7.965
13 HA LEU 2 HA LEU 2 32.512 8.065 -7.570
14 HB2 LEU 2 HB2 LEU 2 34.190 9.960 -5.891
15 HB3 LEU 2 HB1 LEU 2 33.774 8.337 -5.300
16 HG LEU 2 HG LEU 2 34.764 7.360 -7.387
17 HD11 LEU 2 HD11 LEU 2 36.337 9.000 -8.653
18 HD12 LEU 2 HD12 LEU 2 35.353 10.295 -7.932
19 HD13 LEU 2 HD13 LEU 2 34.597 9.094 -9.007
20 HD21 LEU 2 HD21 LEU 2 36.599 9.208 -5.793
21 HD22 LEU 2 HD22 LEU 2 37.126 7.805 -6.754
22 HD23 LEU 2 HD23 LEU 2 36.104 7.566 -5.317
23 HA PRO 3 HA PRO 3 28.899 8.759 -5.085
24 HB2 PRO 3 HB2 PRO 3 28.755 6.457 -3.594
25 HB3 PRO 3 HB1 PRO 3 28.439 6.485 -5.359
26 HG2 PRO 3 HG2 PRO 3 30.952 5.709 -3.890
27 HG3 PRO 3 HG1 PRO 3 30.138 4.889 -5.261
28 HD2 PRO 3 HD2 PRO 3 32.307 6.525 -5.622
29 HD3 PRO 3 HD1 PRO 3 31.002 6.384 -6.844
30 H ILE 4 HN ILE 4 28.952 10.334 -3.584
31 HA ILE 4 HA ILE 4 30.940 10.333 -1.441
32 HB ILE 4 HB ILE 4 28.466 12.103 -1.584
33 HG12 ILE 4 HG12 ILE 4 31.133 12.424 -3.038
34 HG13 ILE 4 HG11 ILE 4 29.555 12.123 -3.802
35 HG21 ILE 4 HG21 ILE 4 29.781 13.641 -0.309
36 HG22 ILE 4 HG22 ILE 4 31.286 12.746 -0.633
37 HG23 ILE 4 HG23 ILE 4 30.051 12.054 0.446
38 HD11 ILE 4 HD1 ILE 4 30.505 14.609 -2.340
39 HD12 ILE 4 HD2 ILE 4 28.771 14.287 -2.583
40 HD13 ILE 4 HD3 ILE 4 29.848 14.472 -3.988
41 H VAL 5 HN VAL 5 27.357 9.983 -1.597
42 HA VAL 5 HA VAL 5 25.926 8.872 -0.174
43 HB VAL 5 HB VAL 5 28.208 7.852 1.561
44 HG11 VAL 5 HG11 VAL 5 26.683 5.872 1.732
45 HG12 VAL 5 HG12 VAL 5 25.510 6.719 0.699
46 HG13 VAL 5 HG13 VAL 5 25.924 7.373 2.300
47 HG21 VAL 5 HG21 VAL 5 27.498 7.018 -1.276
48 HG22 VAL 5 HG22 VAL 5 28.096 5.800 -0.126
49 HG23 VAL 5 HG23 VAL 5 29.105 7.199 -0.534
50 H GLY 6 HN GLY 6 25.158 8.986 2.126
51 HA2 GLY 6 HA1 GLY 6 24.610 10.409 3.880
52 HA3 GLY 6 HA2 GLY 6 26.364 10.621 4.083
53 H LEU 7 HN LEU 7 25.302 11.408 0.972
54 HA LEU 7 HA LEU 7 24.510 14.126 1.467
55 HB2 LEU 7 HB2 LEU 7 27.174 13.864 1.677
56 HB3 LEU 7 HB1 LEU 7 27.063 13.978 -0.091
57 HG LEU 7 HG LEU 7 26.056 16.014 1.954
58 HD11 LEU 7 HD11 LEU 7 28.211 16.137 -0.204
59 HD12 LEU 7 HD12 LEU 7 28.499 16.014 1.548
60 HD13 LEU 7 HD13 LEU 7 27.741 17.475 0.869
61 HD21 LEU 7 HD21 LEU 7 25.652 15.779 -1.054
62 HD22 LEU 7 HD22 LEU 7 25.642 17.368 -0.249
63 HD23 LEU 7 HD23 LEU 7 24.449 16.133 0.211
64 H LEU 8 HN LEU 8 25.543 11.643 -0.471
65 HA LEU 8 HA LEU 8 24.070 12.692 -2.875
66 HB2 LEU 8 HB2 LEU 8 26.564 11.878 -2.948
67 HB3 LEU 8 HB1 LEU 8 25.868 10.249 -2.869
68 HG LEU 8 HG LEU 8 24.328 11.112 -4.866
69 HD11 LEU 8 HD11 LEU 8 26.722 13.005 -4.998
70 HD12 LEU 8 HD12 LEU 8 25.008 13.462 -4.856
71 HD13 LEU 8 HD13 LEU 8 25.606 12.702 -6.347
72 HD21 LEU 8 HD21 LEU 8 26.036 10.345 -6.493
73 HD22 LEU 8 HD22 LEU 8 26.003 9.300 -5.052
74 HD23 LEU 8 HD23 LEU 8 27.296 10.509 -5.247
75 H LYS 9 HN LYS 9 23.608 10.807 -0.205
76 HA LYS 9 HA LYS 9 21.265 9.514 -1.420
77 HB2 LYS 9 HB2 LYS 9 23.538 7.875 -0.241
78 HB3 LYS 9 HB1 LYS 9 21.898 7.242 -0.518
79 HG2 LYS 9 HG2 LYS 9 22.187 7.998 -2.968
80 HG3 LYS 9 HG1 LYS 9 23.910 8.219 -2.584
81 HD2 LYS 9 HD2 LYS 9 24.027 5.847 -1.823
82 HD3 LYS 9 HD1 LYS 9 22.322 5.633 -2.288
83 HE2 LYS 9 HE2 LYS 9 22.848 6.147 -4.622
84 HE3 LYS 9 HE1 LYS 9 24.538 6.506 -4.192
85 HZ1 LYS 9 HZ1 LYS 9 25.043 4.348 -4.158
86 HZ2 LYS 9 HZ2 LYS 9 23.567 4.080 -4.956
87 HZ3 LYS 9 HZ3 LYS 9 23.661 3.929 -3.267
88 H SER 10 HN SER 10 22.977 10.885 1.052
89 HA SER 10 HA SER 10 22.314 11.573 3.167
90 HB2 SER 10 HB2 SER 10 19.991 11.611 1.948
91 HB3 SER 10 HB1 SER 10 19.657 10.151 2.904
92 HG SER 10 HG SER 10 19.916 12.790 3.679
93 H LEU 11 HN LEU 11 21.731 8.200 2.237
94 HA LEU 11 HA LEU 11 21.472 7.073 4.830
95 HB2 LEU 11 HB2 LEU 11 22.975 5.776 2.529
96 HB3 LEU 11 HB1 LEU 11 22.065 4.980 3.833
97 HG LEU 11 HG LEU 11 20.928 6.689 1.581
98 HD11 LEU 11 HD11 LEU 11 21.602 4.307 1.080
99 HD12 LEU 11 HD12 LEU 11 19.862 4.625 0.873
100 HD13 LEU 11 HD13 LEU 11 20.447 3.774 2.324
101 HD21 LEU 11 HD21 LEU 11 19.563 7.210 3.469
102 HD22 LEU 11 HD22 LEU 11 19.668 5.553 4.111
103 HD23 LEU 11 HD23 LEU 11 18.695 5.886 2.657
104 H LEU 12 HN LEU 12 23.573 5.163 4.924
105 HA LEU 12 HA LEU 12 26.143 6.485 5.066
106 HB2 LEU 12 HB2 LEU 12 24.886 7.535 7.024
107 HB3 LEU 12 HB1 LEU 12 24.817 5.910 7.739
108 HG LEU 12 HG LEU 12 27.444 5.907 7.344
109 HD11 LEU 12 HD11 LEU 12 27.632 7.971 6.056
110 HD12 LEU 12 HD12 LEU 12 28.394 8.225 7.641
111 HD13 LEU 12 HD13 LEU 12 26.776 8.887 7.319
112 HD21 LEU 12 HD21 LEU 12 27.770 6.984 9.570
113 HD22 LEU 12 HD22 LEU 12 26.386 5.864 9.566
114 HD23 LEU 12 HD23 LEU 12 26.109 7.620 9.487
115 H LYS 13 HN LYS 13 24.253 4.055 6.927
116 HA LYS 13 HA LYS 13 26.468 2.174 6.941
117 HB2 LYS 13 HB2 LYS 13 23.506 1.778 7.522
118 HB3 LYS 13 HB1 LYS 13 24.796 0.606 7.885
119 HG2 LYS 13 HG2 LYS 13 25.886 2.207 9.385
120 HG3 LYS 13 HG1 LYS 13 24.689 3.457 8.964
121 HD2 LYS 13 HD2 LYS 13 22.884 2.118 9.931
122 HD3 LYS 13 HD1 LYS 13 24.011 0.777 10.253
123 HE2 LYS 13 HE2 LYS 13 24.121 3.568 11.478
124 HE3 LYS 13 HE1 LYS 13 23.663 2.064 12.312
125 HZ1 LYS 13 HZ1 LYS 13 25.924 2.476 12.809
126 HZ2 LYS 13 HZ2 LYS 13 26.318 2.781 11.184
127 HZ3 LYS 13 HZ3 LYS 13 25.916 1.207 11.684
Start of MODEL 20
1 H1 PHE 1 HT1 PHE 1 33.515 5.115 -11.604
2 H2 PHE 1 HT2 PHE 1 34.583 5.338 -10.301
3 H3 PHE 1 HT3 PHE 1 34.334 6.588 -11.425
4 HA PHE 1 HA PHE 1 32.137 6.925 -10.729
5 HB2 PHE 1 HB2 PHE 1 32.545 4.646 -8.759
6 HB3 PHE 1 HB1 PHE 1 31.041 5.532 -9.113
7 HD1 PHE 1 HD1 PHE 1 29.838 5.189 -11.247
8 HD2 PHE 1 HD2 PHE 1 33.396 2.942 -10.285
9 HE1 PHE 1 HE1 PHE 1 29.316 3.577 -13.075
10 HE2 PHE 1 HE2 PHE 1 32.874 1.332 -12.112
11 HZ PHE 1 HZ PHE 1 30.881 1.701 -13.563
12 H LEU 2 HN LEU 2 31.421 7.622 -8.393
13 HA LEU 2 HA LEU 2 33.519 8.063 -6.456
14 HB2 LEU 2 HB2 LEU 2 34.188 9.634 -8.362
15 HB3 LEU 2 HB1 LEU 2 32.688 10.527 -8.029
16 HG LEU 2 HG LEU 2 33.573 10.554 -5.522
17 HD11 LEU 2 HD11 LEU 2 36.129 10.074 -7.128
18 HD12 LEU 2 HD12 LEU 2 35.503 9.079 -5.793
19 HD13 LEU 2 HD13 LEU 2 36.093 10.723 -5.474
20 HD21 LEU 2 HD21 LEU 2 34.820 12.242 -7.739
21 HD22 LEU 2 HD22 LEU 2 34.828 12.660 -6.010
22 HD23 LEU 2 HD23 LEU 2 33.288 12.571 -6.895
23 HA PRO 3 HA PRO 3 29.098 8.827 -5.192
24 HB2 PRO 3 HB2 PRO 3 28.660 6.637 -3.649
25 HB3 PRO 3 HB1 PRO 3 28.547 6.561 -5.438
26 HG2 PRO 3 HG2 PRO 3 30.804 5.711 -3.635
27 HG3 PRO 3 HG1 PRO 3 30.116 4.879 -5.065
28 HD2 PRO 3 HD2 PRO 3 32.426 6.443 -5.140
29 HD3 PRO 3 HD1 PRO 3 31.376 6.145 -6.564
30 H ILE 4 HN ILE 4 29.038 10.375 -3.666
31 HA ILE 4 HA ILE 4 31.004 10.446 -1.511
32 HB ILE 4 HB ILE 4 28.468 12.122 -1.689
33 HG12 ILE 4 HG12 ILE 4 31.149 12.494 -3.101
34 HG13 ILE 4 HG11 ILE 4 29.574 12.210 -3.878
35 HG21 ILE 4 HG21 ILE 4 30.000 12.133 0.380
36 HG22 ILE 4 HG22 ILE 4 29.702 13.708 -0.388
37 HG23 ILE 4 HG23 ILE 4 31.241 12.858 -0.670
38 HD11 ILE 4 HD1 ILE 4 28.795 14.364 -2.638
39 HD12 ILE 4 HD2 ILE 4 29.881 14.560 -4.034
40 HD13 ILE 4 HD3 ILE 4 30.528 14.674 -2.381
41 H VAL 5 HN VAL 5 27.422 10.023 -1.643
42 HA VAL 5 HA VAL 5 26.032 8.848 -0.233
43 HB VAL 5 HB VAL 5 28.346 7.865 1.480
44 HG11 VAL 5 HG11 VAL 5 25.674 6.677 0.613
45 HG12 VAL 5 HG12 VAL 5 26.085 7.316 2.221
46 HG13 VAL 5 HG13 VAL 5 26.874 5.843 1.627
47 HG21 VAL 5 HG21 VAL 5 27.667 7.069 -1.375
48 HG22 VAL 5 HG22 VAL 5 28.264 5.830 -0.247
49 HG23 VAL 5 HG23 VAL 5 29.264 7.246 -0.611
50 H GLY 6 HN GLY 6 25.267 8.907 2.061
51 HA2 GLY 6 HA1 GLY 6 24.672 10.284 3.833
52 HA3 GLY 6 HA2 GLY 6 26.420 10.544 4.048
53 H LEU 7 HN LEU 7 25.343 11.344 0.948
54 HA LEU 7 HA LEU 7 24.483 14.037 1.482
55 HB2 LEU 7 HB2 LEU 7 27.163 13.826 1.632
56 HB3 LEU 7 HB1 LEU 7 27.006 13.970 -0.129
57 HG LEU 7 HG LEU 7 25.981 15.940 1.971
58 HD11 LEU 7 HD11 LEU 7 27.651 17.444 1.040
59 HD12 LEU 7 HD12 LEU 7 28.064 16.270 -0.232
60 HD13 LEU 7 HD13 LEU 7 28.454 15.914 1.467
61 HD21 LEU 7 HD21 LEU 7 25.519 17.326 -0.199
62 HD22 LEU 7 HD22 LEU 7 24.365 16.046 0.231
63 HD23 LEU 7 HD23 LEU 7 25.576 15.759 -1.042
64 H LEU 8 HN LEU 8 25.547 11.588 -0.483
65 HA LEU 8 HA LEU 8 24.051 12.608 -2.881
66 HB2 LEU 8 HB2 LEU 8 26.518 11.703 -2.943
67 HB3 LEU 8 HB1 LEU 8 25.764 10.101 -2.822
68 HG LEU 8 HG LEU 8 24.239 10.990 -4.830
69 HD11 LEU 8 HD11 LEU 8 25.562 12.482 -6.355
70 HD12 LEU 8 HD12 LEU 8 26.733 12.742 -5.043
71 HD13 LEU 8 HD13 LEU 8 25.054 13.303 -4.863
72 HD21 LEU 8 HD21 LEU 8 25.824 9.091 -4.978
73 HD22 LEU 8 HD22 LEU 8 27.171 10.230 -5.218
74 HD23 LEU 8 HD23 LEU 8 25.890 10.093 -6.447
75 H LYS 9 HN LYS 9 23.495 10.877 -0.145
76 HA LYS 9 HA LYS 9 21.114 9.624 -1.283
77 HB2 LYS 9 HB2 LYS 9 22.867 7.918 -1.781
78 HB3 LYS 9 HB1 LYS 9 23.254 7.849 -0.049
79 HG2 LYS 9 HG2 LYS 9 21.123 6.944 0.514
80 HG3 LYS 9 HG1 LYS 9 20.427 7.361 -1.069
81 HD2 LYS 9 HD2 LYS 9 22.801 5.464 -0.925
82 HD3 LYS 9 HD1 LYS 9 21.173 4.857 -0.554
83 HE2 LYS 9 HE2 LYS 9 20.381 5.733 -2.772
84 HE3 LYS 9 HE1 LYS 9 22.055 6.204 -3.149
85 HZ1 LYS 9 HZ1 LYS 9 21.786 4.094 -4.080
86 HZ2 LYS 9 HZ2 LYS 9 20.952 3.485 -2.731
87 HZ3 LYS 9 HZ3 LYS 9 22.619 3.797 -2.633
88 H SER 10 HN SER 10 22.932 10.986 1.117
89 HA SER 10 HA SER 10 22.584 11.384 3.388
90 HB2 SER 10 HB2 SER 10 19.698 11.202 2.443
91 HB3 SER 10 HB1 SER 10 20.232 11.913 3.982
92 HG SER 10 HG SER 10 21.589 12.822 1.761
93 H LEU 11 HN LEU 11 23.423 8.957 3.390
94 HA LEU 11 HA LEU 11 21.535 6.929 4.184
95 HB2 LEU 11 HB2 LEU 11 24.058 6.805 3.344
96 HB3 LEU 11 HB1 LEU 11 24.432 6.884 5.079
97 HG LEU 11 HG LEU 11 22.656 4.827 3.685
98 HD11 LEU 11 HD11 LEU 11 24.400 3.249 4.250
99 HD12 LEU 11 HD12 LEU 11 25.265 4.466 5.219
100 HD13 LEU 11 HD13 LEU 11 25.181 4.633 3.448
101 HD21 LEU 11 HD21 LEU 11 23.261 5.365 6.621
102 HD22 LEU 11 HD22 LEU 11 22.734 3.764 6.048
103 HD23 LEU 11 HD23 LEU 11 21.675 5.177 5.837
104 H LEU 12 HN LEU 12 23.961 8.771 6.112
105 HA LEU 12 HA LEU 12 22.046 9.079 8.310
106 HB2 LEU 12 HB2 LEU 12 22.956 6.705 8.555
107 HB3 LEU 12 HB1 LEU 12 24.551 7.436 8.824
108 HG LEU 12 HG LEU 12 23.297 8.870 10.673
109 HD11 LEU 12 HD11 LEU 12 21.465 7.510 11.761
110 HD12 LEU 12 HD12 LEU 12 21.429 6.479 10.313
111 HD13 LEU 12 HD13 LEU 12 21.002 8.202 10.192
112 HD21 LEU 12 HD21 LEU 12 23.726 7.071 12.345
113 HD22 LEU 12 HD22 LEU 12 25.050 7.212 11.164
114 HD23 LEU 12 HD23 LEU 12 23.865 5.891 11.020
115 H LYS 13 HN LYS 13 22.374 11.217 8.499
116 HA LYS 13 HA LYS 13 23.502 13.221 8.833
117 HB2 LYS 13 HB2 LYS 13 23.943 11.952 10.991
118 HB3 LYS 13 HB1 LYS 13 25.530 11.509 10.318
119 HG2 LYS 13 HG2 LYS 13 26.078 13.914 10.034
120 HG3 LYS 13 HG1 LYS 13 24.496 14.351 10.724
121 HD2 LYS 13 HD2 LYS 13 25.104 13.144 12.823
122 HD3 LYS 13 HD1 LYS 13 26.710 12.796 12.134
123 HE2 LYS 13 HE2 LYS 13 26.773 14.794 13.608
124 HE3 LYS 13 HE1 LYS 13 27.156 15.218 11.922
125 HZ1 LYS 13 HZ1 LYS 13 25.326 16.486 13.393
126 HZ2 LYS 13 HZ2 LYS 13 24.341 15.322 12.644
127 HZ3 LYS 13 HZ3 LYS 13 25.266 16.389 11.701