Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
565440 | 2maa RC | 19334 | 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 H PHE 1 1.807 0.001 0.856
2 HA PHE 1 HA PHE 1 2.430 1.009 -1.423
3 HB2 PHE 1 2HB PHE 1 4.174 -0.418 -1.532
4 HB3 PHE 1 3HB PHE 1 3.490 -1.124 -0.071
5 HD1 PHE 1 HD1 PHE 1 1.894 -3.080 -0.325
6 HD2 PHE 1 HD2 PHE 1 4.371 -1.670 -3.487
7 HE1 PHE 1 HE1 PHE 1 1.628 -5.232 -1.488
8 HE2 PHE 1 HE2 PHE 1 4.108 -3.819 -4.655
9 HZ PHE 1 HZ PHE 1 2.735 -5.603 -3.657
10 H LEU 2 H LEU 2 2.696 -0.025 -3.701
11 HA LEU 2 HA LEU 2 0.029 -0.940 -4.548
12 HB2 LEU 2 2HB LEU 2 1.977 0.967 -5.659
13 HB3 LEU 2 3HB LEU 2 1.197 -0.088 -6.836
14 HG LEU 2 HG LEU 2 0.029 2.030 -6.678
15 HD11 LEU 2 1HD1 LEU 2 -1.115 -0.450 -6.597
16 HD12 LEU 2 2HD1 LEU 2 -1.968 1.058 -6.921
17 HD13 LEU 2 3HD1 LEU 2 -1.947 0.391 -5.289
18 HD21 LEU 2 3HD2 LEU 2 -0.972 1.548 -3.951
19 HD22 LEU 2 1HD2 LEU 2 -0.564 3.059 -4.764
20 HD23 LEU 2 2HD2 LEU 2 0.713 2.060 -4.069
21 HA PRO 3 HA PRO 3 2.206 -4.737 -5.497
22 HB2 PRO 3 2HB PRO 3 -0.016 -6.112 -6.232
23 HB3 PRO 3 3HB PRO 3 0.424 -5.831 -4.544
24 HG2 PRO 3 2HG PRO 3 -1.554 -4.373 -6.253
25 HG3 PRO 3 3HG PRO 3 -1.707 -4.901 -4.567
26 HD2 PRO 3 2HD PRO 3 -1.115 -2.348 -5.246
27 HD3 PRO 3 3HD PRO 3 -0.500 -3.108 -3.765
28 H LEU 4 H LEU 4 0.840 -2.486 -7.510
29 HA LEU 4 HA LEU 4 1.013 -4.099 -9.935
30 HB2 LEU 4 2HB LEU 4 0.292 -1.191 -9.607
31 HB3 LEU 4 3HB LEU 4 0.125 -2.151 -11.076
32 HG LEU 4 HG LEU 4 -1.455 -2.447 -8.524
33 HD11 LEU 4 1HD1 LEU 4 -3.348 -1.945 -10.099
34 HD12 LEU 4 2HD1 LEU 4 -2.135 -1.495 -11.296
35 HD13 LEU 4 3HD1 LEU 4 -2.251 -0.601 -9.781
36 HD21 LEU 4 3HD2 LEU 4 -2.689 -4.202 -9.710
37 HD22 LEU 4 1HD2 LEU 4 -0.997 -4.639 -9.473
38 HD23 LEU 4 2HD2 LEU 4 -1.552 -4.089 -11.054
39 H ILE 5 H ILE 5 2.813 -1.746 -8.150
40 HA ILE 5 HA ILE 5 4.479 -0.830 -10.258
41 HB ILE 5 HB ILE 5 5.705 0.309 -8.663
42 HG12 ILE 5 2HG1 ILE 5 4.974 -1.899 -6.734
43 HG13 ILE 5 3HG1 ILE 5 6.565 -1.547 -7.399
44 HG21 ILE 5 1HG2 ILE 5 4.126 1.462 -7.520
45 HG22 ILE 5 2HG2 ILE 5 3.042 0.488 -8.512
46 HG23 ILE 5 3HG2 ILE 5 3.389 0.006 -6.851
47 HD11 ILE 5 3HD1 ILE 5 5.009 0.084 -5.413
48 HD12 ILE 5 1HD1 ILE 5 6.524 -0.782 -5.154
49 HD13 ILE 5 2HD1 ILE 5 6.487 0.640 -6.199
50 H GLY 6 H GLY 6 4.690 -3.496 -7.962
51 HA2 GLY 6 2HA GLY 6 7.361 -4.223 -8.793
52 HA3 GLY 6 3HA GLY 6 6.335 -5.111 -7.675
53 H ARG 7 H ARG 7 4.242 -4.777 -9.998
54 HA ARG 7 HA ARG 7 5.033 -7.277 -11.308
55 HB2 ARG 7 2HB ARG 7 2.919 -7.662 -10.503
56 HB3 ARG 7 3HB ARG 7 2.433 -5.980 -10.667
57 HG2 ARG 7 2HG ARG 7 2.942 -7.490 -13.162
58 HG3 ARG 7 3HG ARG 7 1.497 -7.904 -12.238
59 HD2 ARG 7 2HD ARG 7 1.437 -5.165 -12.238
60 HD3 ARG 7 3HD ARG 7 2.097 -5.528 -13.831
61 HE ARG 7 HE ARG 7 -0.242 -7.062 -13.154
62 HH11 ARG 7 1HH1 ARG 7 0.951 -4.095 -14.530
63 HH12 ARG 7 2HH1 ARG 7 -0.475 -3.804 -15.469
64 HH21 ARG 7 1HH2 ARG 7 -2.125 -6.691 -14.387
65 HH22 ARG 7 2HH2 ARG 7 -2.225 -5.281 -15.386
66 H VAL 8 H VAL 8 4.177 -3.944 -11.958
67 HA VAL 8 HA VAL 8 3.681 -3.915 -14.643
68 HB VAL 8 HB VAL 8 3.720 -1.909 -13.161
69 HG11 VAL 8 1HG1 VAL 8 5.604 -1.005 -12.314
70 HG12 VAL 8 2HG1 VAL 8 6.241 -2.636 -12.530
71 HG13 VAL 8 3HG1 VAL 8 6.561 -1.395 -13.742
72 HG21 VAL 8 3HG2 VAL 8 5.292 -1.655 -15.725
73 HG22 VAL 8 1HG2 VAL 8 3.534 -1.693 -15.589
74 HG23 VAL 8 2HG2 VAL 8 4.443 -0.349 -14.898
75 H LEU 9 H LEU 9 6.735 -4.481 -13.047
76 HA LEU 9 HA LEU 9 8.540 -4.028 -15.089
77 HB2 LEU 9 2HB LEU 9 8.556 -6.203 -13.004
78 HB3 LEU 9 3HB LEU 9 9.937 -5.775 -14.011
79 HG LEU 9 HG LEU 9 9.245 -3.376 -12.842
80 HD11 LEU 9 1HD1 LEU 9 7.685 -4.505 -11.341
81 HD12 LEU 9 2HD1 LEU 9 9.056 -3.836 -10.456
82 HD13 LEU 9 3HD1 LEU 9 8.980 -5.567 -10.787
83 HD21 LEU 9 3HD2 LEU 9 11.231 -4.064 -11.280
84 HD22 LEU 9 1HD2 LEU 9 11.490 -3.829 -13.009
85 HD23 LEU 9 2HD2 LEU 9 11.323 -5.459 -12.356
86 H SER 10 H SER 10 6.578 -6.910 -14.468
87 HA SER 10 HA SER 10 7.502 -8.055 -17.008
88 HB2 SER 10 2HB SER 10 7.752 -9.699 -15.366
89 HB3 SER 10 3HB SER 10 6.265 -9.236 -14.538
90 HG SER 10 HG SER 10 6.447 -11.214 -16.095
91 H GLY 11 H GLY 11 4.693 -6.831 -15.343
92 HA2 GLY 11 2HA GLY 11 2.714 -7.840 -17.097
93 HA3 GLY 11 3HA GLY 11 2.533 -6.456 -16.029
94 H ILE 12 H ILE 12 4.908 -5.164 -17.345
95 HA ILE 12 HA ILE 12 3.407 -3.821 -19.411
96 HB ILE 12 HB ILE 12 4.963 -2.666 -17.774
97 HG12 ILE 12 2HG1 ILE 12 6.069 -1.397 -19.923
98 HG13 ILE 12 3HG1 ILE 12 4.734 -2.255 -20.684
99 HG21 ILE 12 1HG2 ILE 12 7.209 -3.281 -19.620
100 HG22 ILE 12 2HG2 ILE 12 7.234 -2.841 -17.913
101 HG23 ILE 12 3HG2 ILE 12 6.783 -4.476 -18.395
102 HD11 ILE 12 3HD1 ILE 12 3.193 -1.224 -19.065
103 HD12 ILE 12 1HD1 ILE 12 4.546 -0.312 -18.396
104 HD13 ILE 12 2HD1 ILE 12 4.037 -0.041 -20.063
105 H LEU 13 H LEU 13 5.961 -6.180 -19.215
106 HA LEU 13 HA LEU 13 7.158 -7.315 -20.786
107 HB2 LEU 13 2HB LEU 13 4.581 -7.675 -21.325
108 HB3 LEU 13 3HB LEU 13 5.038 -6.849 -22.813
109 HG LEU 13 HG LEU 13 6.965 -8.820 -22.524
110 HD11 LEU 13 1HD1 LEU 13 4.497 -10.387 -22.305
111 HD12 LEU 13 2HD1 LEU 13 5.015 -9.609 -20.810
112 HD13 LEU 13 3HD1 LEU 13 6.108 -10.702 -21.659
113 HD21 LEU 13 3HD2 LEU 13 6.264 -8.484 -24.665
114 HD22 LEU 13 1HD2 LEU 13 4.564 -8.364 -24.209
115 HD23 LEU 13 2HD2 LEU 13 5.344 -9.943 -24.296
Start of MODEL 2
1 H1 PHE 1 H PHE 1 1.136 -0.852 0.751
2 HA PHE 1 HA PHE 1 2.154 0.886 -1.277
3 HB2 PHE 1 2HB PHE 1 3.879 -0.564 -1.368
4 HB3 PHE 1 3HB PHE 1 3.150 -1.285 0.062
5 HD1 PHE 1 HD1 PHE 1 1.534 -3.213 -0.266
6 HD2 PHE 1 HD2 PHE 1 4.107 -1.784 -3.340
7 HE1 PHE 1 HE1 PHE 1 1.267 -5.340 -1.473
8 HE2 PHE 1 HE2 PHE 1 3.844 -3.908 -4.553
9 HZ PHE 1 HZ PHE 1 2.421 -5.689 -3.620
10 H LEU 2 H LEU 2 2.461 -0.111 -3.567
11 HA LEU 2 HA LEU 2 -0.196 -0.973 -4.494
12 HB2 LEU 2 2HB LEU 2 1.804 0.926 -5.524
13 HB3 LEU 2 3HB LEU 2 1.040 -0.098 -6.738
14 HG LEU 2 HG LEU 2 -1.116 0.818 -5.323
15 HD11 LEU 2 1HD1 LEU 2 0.765 2.372 -4.274
16 HD12 LEU 2 2HD1 LEU 2 -0.867 2.955 -4.598
17 HD13 LEU 2 3HD1 LEU 2 0.436 3.310 -5.732
18 HD21 LEU 2 3HD2 LEU 2 -1.268 2.485 -7.270
19 HD22 LEU 2 1HD2 LEU 2 -1.203 0.765 -7.653
20 HD23 LEU 2 2HD2 LEU 2 0.242 1.761 -7.826
21 HA PRO 3 HA PRO 3 1.950 -4.783 -5.457
22 HB2 PRO 3 2HB PRO 3 -0.272 -6.114 -6.271
23 HB3 PRO 3 3HB PRO 3 0.131 -5.869 -4.568
24 HG2 PRO 3 2HG PRO 3 -1.784 -4.353 -6.299
25 HG3 PRO 3 3HG PRO 3 -1.986 -4.908 -4.626
26 HD2 PRO 3 2HD PRO 3 -1.342 -2.352 -5.246
27 HD3 PRO 3 3HD PRO 3 -0.775 -3.147 -3.763
28 H LEU 4 H LEU 4 0.667 -2.478 -7.462
29 HA LEU 4 HA LEU 4 0.877 -4.051 -9.911
30 HB2 LEU 4 2HB LEU 4 0.192 -1.137 -9.555
31 HB3 LEU 4 3HB LEU 4 0.040 -2.076 -11.039
32 HG LEU 4 HG LEU 4 -1.597 -2.376 -8.524
33 HD11 LEU 4 1HD1 LEU 4 -2.293 -1.484 -11.317
34 HD12 LEU 4 2HD1 LEU 4 -2.246 -0.477 -9.870
35 HD13 LEU 4 3HD1 LEU 4 -3.453 -1.755 -10.016
36 HD21 LEU 4 3HD2 LEU 4 -1.185 -4.568 -9.454
37 HD22 LEU 4 1HD2 LEU 4 -1.626 -4.000 -11.065
38 HD23 LEU 4 2HD2 LEU 4 -2.847 -4.083 -9.795
39 H ILE 5 H ILE 5 2.664 -1.756 -8.041
40 HA ILE 5 HA ILE 5 4.395 -0.826 -10.091
41 HB ILE 5 HB ILE 5 5.596 0.267 -8.446
42 HG12 ILE 5 2HG1 ILE 5 4.787 -1.964 -6.575
43 HG13 ILE 5 3HG1 ILE 5 6.399 -1.623 -7.195
44 HG21 ILE 5 1HG2 ILE 5 4.006 1.422 -7.322
45 HG22 ILE 5 2HG2 ILE 5 2.933 0.481 -8.357
46 HG23 ILE 5 3HG2 ILE 5 3.232 -0.034 -6.697
47 HD11 ILE 5 3HD1 ILE 5 6.642 -0.684 -5.166
48 HD12 ILE 5 1HD1 ILE 5 5.902 0.700 -5.970
49 HD13 ILE 5 2HD1 ILE 5 4.915 -0.375 -4.979
50 H GLY 6 H GLY 6 4.512 -3.535 -7.837
51 HA2 GLY 6 2HA GLY 6 7.192 -4.285 -8.616
52 HA3 GLY 6 3HA GLY 6 6.128 -5.177 -7.539
53 H ARG 7 H ARG 7 4.097 -4.774 -9.906
54 HA ARG 7 HA ARG 7 4.884 -7.263 -11.238
55 HB2 ARG 7 2HB ARG 7 2.746 -7.633 -10.494
56 HB3 ARG 7 3HB ARG 7 2.289 -5.941 -10.635
57 HG2 ARG 7 2HG ARG 7 2.834 -7.409 -13.147
58 HG3 ARG 7 3HG ARG 7 1.361 -7.816 -12.266
59 HD2 ARG 7 2HD ARG 7 1.219 -5.134 -12.186
60 HD3 ARG 7 3HD ARG 7 2.100 -5.342 -13.699
61 HE ARG 7 HE ARG 7 0.151 -6.024 -14.653
62 HH11 ARG 7 1HH1 ARG 7 -0.074 -6.531 -11.217
63 HH12 ARG 7 2HH1 ARG 7 -1.722 -7.064 -11.272
64 HH21 ARG 7 1HH2 ARG 7 -2.018 -6.723 -14.739
65 HH22 ARG 7 2HH2 ARG 7 -2.826 -7.174 -13.276
66 H VAL 8 H VAL 8 4.091 -3.907 -11.851
67 HA VAL 8 HA VAL 8 3.661 -3.826 -14.547
68 HB VAL 8 HB VAL 8 3.693 -1.846 -13.030
69 HG11 VAL 8 1HG1 VAL 8 5.568 -0.983 -12.123
70 HG12 VAL 8 2HG1 VAL 8 6.187 -2.620 -12.351
71 HG13 VAL 8 3HG1 VAL 8 6.554 -1.363 -13.534
72 HG21 VAL 8 3HG2 VAL 8 3.594 -1.623 -15.482
73 HG22 VAL 8 1HG2 VAL 8 4.429 -0.270 -14.719
74 HG23 VAL 8 2HG2 VAL 8 5.355 -1.534 -15.530
75 H LEU 9 H LEU 9 6.667 -4.463 -12.887
76 HA LEU 9 HA LEU 9 8.527 -4.001 -14.878
77 HB2 LEU 9 2HB LEU 9 8.689 -4.936 -12.396
78 HB3 LEU 9 3HB LEU 9 8.820 -6.470 -13.254
79 HG LEU 9 HG LEU 9 11.024 -5.704 -12.760
80 HD11 LEU 9 1HD1 LEU 9 11.977 -5.927 -14.839
81 HD12 LEU 9 2HD1 LEU 9 10.762 -4.920 -15.626
82 HD13 LEU 9 3HD1 LEU 9 10.359 -6.565 -15.132
83 HD21 LEU 9 3HD2 LEU 9 11.765 -3.574 -12.896
84 HD22 LEU 9 1HD2 LEU 9 10.044 -3.205 -12.778
85 HD23 LEU 9 2HD2 LEU 9 10.835 -3.226 -14.355
86 H SER 10 H SER 10 6.511 -6.864 -14.353
87 HA SER 10 HA SER 10 7.481 -7.981 -16.889
88 HB2 SER 10 2HB SER 10 7.381 -9.299 -14.626
89 HB3 SER 10 3HB SER 10 5.670 -9.467 -15.016
90 HG SER 10 HG SER 10 6.331 -10.382 -17.031
91 H GLY 11 H GLY 11 4.649 -6.743 -15.273
92 HA2 GLY 11 2HA GLY 11 2.700 -7.694 -17.092
93 HA3 GLY 11 3HA GLY 11 2.513 -6.325 -16.005
94 H ILE 12 H ILE 12 4.937 -5.046 -17.241
95 HA ILE 12 HA ILE 12 3.507 -3.648 -19.320
96 HB ILE 12 HB ILE 12 5.036 -2.543 -17.625
97 HG12 ILE 12 2HG1 ILE 12 5.804 -1.933 -20.477
98 HG13 ILE 12 3HG1 ILE 12 4.203 -1.569 -19.843
99 HG21 ILE 12 1HG2 ILE 12 7.320 -3.158 -19.425
100 HG22 ILE 12 2HG2 ILE 12 7.308 -2.746 -17.711
101 HG23 ILE 12 3HG2 ILE 12 6.848 -4.367 -18.230
102 HD11 ILE 12 3HD1 ILE 12 5.071 -0.015 -18.294
103 HD12 ILE 12 1HD1 ILE 12 6.727 -0.546 -18.582
104 HD13 ILE 12 2HD1 ILE 12 5.848 0.325 -19.839
105 H LEU 13 H LEU 13 6.024 -6.045 -19.100
106 HA LEU 13 HA LEU 13 7.244 -7.171 -20.659
107 HB2 LEU 13 2HB LEU 13 4.680 -7.490 -21.268
108 HB3 LEU 13 3HB LEU 13 5.180 -6.639 -22.727
109 HG LEU 13 HG LEU 13 7.081 -8.575 -22.572
110 HD11 LEU 13 1HD1 LEU 13 5.766 -10.685 -22.164
111 HD12 LEU 13 2HD1 LEU 13 4.545 -9.676 -21.389
112 HD13 LEU 13 3HD1 LEU 13 6.179 -9.748 -20.728
113 HD21 LEU 13 3HD2 LEU 13 4.397 -8.958 -23.882
114 HD22 LEU 13 1HD2 LEU 13 5.956 -9.598 -24.402
115 HD23 LEU 13 2HD2 LEU 13 5.638 -7.866 -24.497
Start of MODEL 3
1 H1 PHE 1 H PHE 1 1.275 -1.088 0.407
2 HA PHE 1 HA PHE 1 2.848 0.719 -1.306
3 HB2 PHE 1 2HB PHE 1 4.523 -0.774 -1.533
4 HB3 PHE 1 3HB PHE 1 3.876 -1.495 -0.063
5 HD1 PHE 1 HD1 PHE 1 2.190 -3.375 -0.298
6 HD2 PHE 1 HD2 PHE 1 4.580 -1.975 -3.529
7 HE1 PHE 1 HE1 PHE 1 1.782 -5.479 -1.507
8 HE2 PHE 1 HE2 PHE 1 4.176 -4.076 -4.744
9 HZ PHE 1 HZ PHE 1 2.775 -5.831 -3.733
10 H LEU 2 H LEU 2 2.968 -0.257 -3.622
11 HA LEU 2 HA LEU 2 0.231 -1.037 -4.371
12 HB2 LEU 2 2HB LEU 2 2.205 0.822 -5.516
13 HB3 LEU 2 3HB LEU 2 1.331 -0.167 -6.685
14 HG LEU 2 HG LEU 2 -0.538 0.963 -4.841
15 HD11 LEU 2 1HD1 LEU 2 1.255 2.979 -6.184
16 HD12 LEU 2 2HD1 LEU 2 1.187 2.666 -4.450
17 HD13 LEU 2 3HD1 LEU 2 -0.221 3.323 -5.283
18 HD21 LEU 2 3HD2 LEU 2 -1.661 1.567 -6.776
19 HD22 LEU 2 1HD2 LEU 2 -0.708 0.180 -7.303
20 HD23 LEU 2 2HD2 LEU 2 -0.171 1.816 -7.687
21 HA PRO 3 HA PRO 3 2.201 -4.890 -5.522
22 HB2 PRO 3 2HB PRO 3 -0.107 -6.151 -6.194
23 HB3 PRO 3 3HB PRO 3 0.420 -5.939 -4.520
24 HG2 PRO 3 2HG PRO 3 -1.570 -4.351 -6.096
25 HG3 PRO 3 3HG PRO 3 -1.669 -4.922 -4.420
26 HD2 PRO 3 2HD PRO 3 -1.002 -2.376 -5.055
27 HD3 PRO 3 3HD PRO 3 -0.354 -3.205 -3.625
28 H LEU 4 H LEU 4 0.843 -2.527 -7.408
29 HA LEU 4 HA LEU 4 0.840 -4.073 -9.882
30 HB2 LEU 4 2HB LEU 4 0.258 -1.148 -9.444
31 HB3 LEU 4 3HB LEU 4 -0.017 -2.060 -10.927
32 HG LEU 4 HG LEU 4 -1.489 -2.357 -8.312
33 HD11 LEU 4 1HD1 LEU 4 -3.429 -1.719 -9.749
34 HD12 LEU 4 2HD1 LEU 4 -2.282 -1.339 -11.033
35 HD13 LEU 4 3HD1 LEU 4 -2.237 -0.440 -9.516
36 HD21 LEU 4 3HD2 LEU 4 -1.165 -4.542 -9.335
37 HD22 LEU 4 1HD2 LEU 4 -1.777 -3.928 -10.871
38 HD23 LEU 4 2HD2 LEU 4 -2.848 -4.031 -9.474
39 H ILE 5 H ILE 5 2.815 -1.850 -8.117
40 HA ILE 5 HA ILE 5 4.423 -0.940 -10.273
41 HB ILE 5 HB ILE 5 5.765 0.101 -8.705
42 HG12 ILE 5 2HG1 ILE 5 5.029 -2.132 -6.806
43 HG13 ILE 5 3HG1 ILE 5 6.602 -1.825 -7.533
44 HG21 ILE 5 1HG2 ILE 5 4.288 1.283 -7.459
45 HG22 ILE 5 2HG2 ILE 5 3.121 0.383 -8.427
46 HG23 ILE 5 3HG2 ILE 5 3.521 -0.161 -6.798
47 HD11 ILE 5 3HD1 ILE 5 7.070 -0.840 -5.591
48 HD12 ILE 5 1HD1 ILE 5 6.134 0.513 -6.226
49 HD13 ILE 5 2HD1 ILE 5 5.369 -0.664 -5.158
50 H GLY 6 H GLY 6 4.623 -3.680 -8.063
51 HA2 GLY 6 2HA GLY 6 7.221 -4.490 -9.034
52 HA3 GLY 6 3HA GLY 6 6.210 -5.367 -7.896
53 H ARG 7 H ARG 7 4.031 -4.881 -10.111
54 HA ARG 7 HA ARG 7 4.658 -7.371 -11.524
55 HB2 ARG 7 2HB ARG 7 2.568 -7.693 -10.634
56 HB3 ARG 7 3HB ARG 7 2.146 -5.989 -10.730
57 HG2 ARG 7 2HG ARG 7 2.480 -7.444 -13.286
58 HG3 ARG 7 3HG ARG 7 1.061 -7.826 -12.309
59 HD2 ARG 7 2HD ARG 7 1.153 -5.073 -12.244
60 HD3 ARG 7 3HD ARG 7 1.665 -5.454 -13.888
61 HE ARG 7 HE ARG 7 -0.701 -6.857 -13.028
62 HH11 ARG 7 1HH1 ARG 7 0.562 -3.973 -14.515
63 HH12 ARG 7 2HH1 ARG 7 -0.911 -3.600 -15.347
64 HH21 ARG 7 1HH2 ARG 7 -2.646 -6.377 -14.118
65 HH22 ARG 7 2HH2 ARG 7 -2.735 -4.968 -15.120
66 H VAL 8 H VAL 8 3.914 -3.988 -12.042
67 HA VAL 8 HA VAL 8 3.301 -3.860 -14.700
68 HB VAL 8 HB VAL 8 3.491 -1.902 -13.165
69 HG11 VAL 8 1HG1 VAL 8 5.448 -1.097 -12.385
70 HG12 VAL 8 2HG1 VAL 8 6.004 -2.747 -12.672
71 HG13 VAL 8 3HG1 VAL 8 6.322 -1.488 -13.866
72 HG21 VAL 8 3HG2 VAL 8 3.388 -1.827 -15.734
73 HG22 VAL 8 1HG2 VAL 8 3.870 -0.363 -14.877
74 HG23 VAL 8 2HG2 VAL 8 5.091 -1.376 -15.647
75 H LEU 9 H LEU 9 6.396 -4.597 -13.261
76 HA LEU 9 HA LEU 9 8.126 -4.156 -15.370
77 HB2 LEU 9 2HB LEU 9 8.109 -6.309 -13.269
78 HB3 LEU 9 3HB LEU 9 9.436 -6.094 -14.408
79 HG LEU 9 HG LEU 9 9.172 -3.586 -13.324
80 HD11 LEU 9 1HD1 LEU 9 8.462 -3.613 -11.205
81 HD12 LEU 9 2HD1 LEU 9 9.255 -5.149 -10.858
82 HD13 LEU 9 3HD1 LEU 9 7.674 -5.131 -11.639
83 HD21 LEU 9 3HD2 LEU 9 11.250 -4.798 -13.762
84 HD22 LEU 9 1HD2 LEU 9 10.936 -5.842 -12.376
85 HD23 LEU 9 2HD2 LEU 9 11.231 -4.121 -12.133
86 H SER 10 H SER 10 6.075 -6.974 -14.740
87 HA SER 10 HA SER 10 6.837 -8.080 -17.351
88 HB2 SER 10 2HB SER 10 5.115 -9.557 -15.394
89 HB3 SER 10 3HB SER 10 6.269 -10.190 -16.567
90 HG SER 10 HG SER 10 6.914 -10.222 -14.274
91 H GLY 11 H GLY 11 4.159 -6.792 -15.526
92 HA2 GLY 11 2HA GLY 11 2.060 -7.669 -17.209
93 HA3 GLY 11 3HA GLY 11 1.989 -6.306 -16.103
94 H ILE 12 H ILE 12 4.378 -5.118 -17.527
95 HA ILE 12 HA ILE 12 2.832 -3.673 -19.502
96 HB ILE 12 HB ILE 12 4.457 -2.584 -17.887
97 HG12 ILE 12 2HG1 ILE 12 5.531 -1.287 -20.027
98 HG13 ILE 12 3HG1 ILE 12 4.177 -2.115 -20.788
99 HG21 ILE 12 1HG2 ILE 12 6.600 -3.334 -19.834
100 HG22 ILE 12 2HG2 ILE 12 6.749 -2.723 -18.187
101 HG23 ILE 12 3HG2 ILE 12 6.227 -4.384 -18.467
102 HD11 ILE 12 3HD1 ILE 12 3.617 -0.674 -18.272
103 HD12 ILE 12 1HD1 ILE 12 3.970 0.299 -19.700
104 HD13 ILE 12 2HD1 ILE 12 2.635 -0.853 -19.726
105 H LEU 13 H LEU 13 5.329 -6.096 -19.418
106 HA LEU 13 HA LEU 13 6.461 -5.880 -21.924
107 HB2 LEU 13 2HB LEU 13 6.827 -7.570 -19.945
108 HB3 LEU 13 3HB LEU 13 5.735 -8.581 -20.890
109 HG LEU 13 HG LEU 13 7.516 -7.922 -22.797
110 HD11 LEU 13 1HD1 LEU 13 9.039 -7.925 -20.198
111 HD12 LEU 13 2HD1 LEU 13 8.951 -6.623 -21.384
112 HD13 LEU 13 3HD1 LEU 13 9.775 -8.129 -21.788
113 HD21 LEU 13 3HD2 LEU 13 8.721 -10.113 -21.785
114 HD22 LEU 13 1HD2 LEU 13 7.211 -10.151 -22.695
115 HD23 LEU 13 2HD2 LEU 13 7.178 -10.176 -20.932
Start of MODEL 4
1 H1 PHE 1 H PHE 1 1.778 -0.757 0.894
2 HA PHE 1 HA PHE 1 2.605 0.769 -1.263
3 HB2 PHE 1 2HB PHE 1 4.249 -0.764 -1.445
4 HB3 PHE 1 3HB PHE 1 3.540 -1.473 0.002
5 HD1 PHE 1 HD1 PHE 1 1.816 -3.310 -0.291
6 HD2 PHE 1 HD2 PHE 1 4.336 -1.959 -3.443
7 HE1 PHE 1 HE1 PHE 1 1.392 -5.399 -1.520
8 HE2 PHE 1 HE2 PHE 1 3.916 -4.046 -4.678
9 HZ PHE 1 HZ PHE 1 2.442 -5.769 -3.717
10 H LEU 2 H LEU 2 2.771 -0.201 -3.578
11 HA LEU 2 HA LEU 2 0.038 -0.911 -4.411
12 HB2 LEU 2 2HB LEU 2 2.092 0.901 -5.491
13 HB3 LEU 2 3HB LEU 2 1.228 -0.061 -6.688
14 HG LEU 2 HG LEU 2 -0.870 0.885 -5.338
15 HD11 LEU 2 1HD1 LEU 2 1.225 2.279 -4.152
16 HD12 LEU 2 2HD1 LEU 2 -0.496 2.645 -4.039
17 HD13 LEU 2 3HD1 LEU 2 0.492 3.426 -5.274
18 HD21 LEU 2 3HD2 LEU 2 0.578 2.576 -7.364
19 HD22 LEU 2 1HD2 LEU 2 -1.161 2.461 -7.088
20 HD23 LEU 2 2HD2 LEU 2 -0.284 1.093 -7.776
21 HA PRO 3 HA PRO 3 1.947 -4.808 -5.519
22 HB2 PRO 3 2HB PRO 3 -0.371 -6.010 -6.264
23 HB3 PRO 3 3HB PRO 3 0.110 -5.815 -4.574
24 HG2 PRO 3 2HG PRO 3 -1.791 -4.174 -6.203
25 HG3 PRO 3 3HG PRO 3 -1.955 -4.748 -4.533
26 HD2 PRO 3 2HD PRO 3 -1.206 -2.217 -5.137
27 HD3 PRO 3 3HD PRO 3 -0.622 -3.066 -3.692
28 H LEU 4 H LEU 4 0.705 -2.406 -7.435
29 HA LEU 4 HA LEU 4 0.738 -3.943 -9.914
30 HB2 LEU 4 2HB LEU 4 0.218 -1.006 -9.484
31 HB3 LEU 4 3HB LEU 4 -0.039 -1.908 -10.976
32 HG LEU 4 HG LEU 4 -1.591 -2.173 -8.404
33 HD11 LEU 4 1HD1 LEU 4 -2.352 -1.197 -11.152
34 HD12 LEU 4 2HD1 LEU 4 -2.190 -0.217 -9.695
35 HD13 LEU 4 3HD1 LEU 4 -3.468 -1.427 -9.806
36 HD21 LEU 4 3HD2 LEU 4 -1.803 -3.744 -10.970
37 HD22 LEU 4 1HD2 LEU 4 -2.974 -3.791 -9.652
38 HD23 LEU 4 2HD2 LEU 4 -1.327 -4.365 -9.389
39 H ILE 5 H ILE 5 2.713 -1.776 -8.081
40 HA ILE 5 HA ILE 5 4.408 -0.899 -10.184
41 HB ILE 5 HB ILE 5 5.727 0.103 -8.573
42 HG12 ILE 5 2HG1 ILE 5 4.879 -2.117 -6.705
43 HG13 ILE 5 3HG1 ILE 5 6.480 -1.847 -7.384
44 HG21 ILE 5 1HG2 ILE 5 4.243 1.317 -7.367
45 HG22 ILE 5 2HG2 ILE 5 3.084 0.450 -8.373
46 HG23 ILE 5 3HG2 ILE 5 3.421 -0.109 -6.735
47 HD11 ILE 5 3HD1 ILE 5 5.064 -0.159 -5.340
48 HD12 ILE 5 1HD1 ILE 5 6.491 -1.166 -5.100
49 HD13 ILE 5 2HD1 ILE 5 6.590 0.279 -6.107
50 H GLY 6 H GLY 6 4.474 -3.650 -7.980
51 HA2 GLY 6 2HA GLY 6 7.079 -4.521 -8.877
52 HA3 GLY 6 3HA GLY 6 6.013 -5.376 -7.772
53 H ARG 7 H ARG 7 3.914 -4.829 -10.050
54 HA ARG 7 HA ARG 7 4.520 -7.330 -11.452
55 HB2 ARG 7 2HB ARG 7 2.397 -7.605 -10.629
56 HB3 ARG 7 3HB ARG 7 2.022 -5.889 -10.725
57 HG2 ARG 7 2HG ARG 7 2.393 -7.338 -13.280
58 HG3 ARG 7 3HG ARG 7 0.936 -7.687 -12.347
59 HD2 ARG 7 2HD ARG 7 0.948 -4.996 -12.222
60 HD3 ARG 7 3HD ARG 7 1.737 -5.235 -13.780
61 HE ARG 7 HE ARG 7 -0.294 -5.796 -14.638
62 HH11 ARG 7 1HH1 ARG 7 -0.369 -6.332 -11.199
63 HH12 ARG 7 2HH1 ARG 7 -2.045 -6.772 -11.172
64 HH21 ARG 7 1HH2 ARG 7 -2.501 -6.373 -14.616
65 HH22 ARG 7 2HH2 ARG 7 -3.256 -6.795 -13.116
66 H VAL 8 H VAL 8 3.877 -3.928 -11.980
67 HA VAL 8 HA VAL 8 3.347 -3.778 -14.655
68 HB VAL 8 HB VAL 8 3.540 -1.829 -13.108
69 HG11 VAL 8 1HG1 VAL 8 5.492 -1.076 -12.266
70 HG12 VAL 8 2HG1 VAL 8 6.015 -2.739 -12.543
71 HG13 VAL 8 3HG1 VAL 8 6.400 -1.484 -13.722
72 HG21 VAL 8 3HG2 VAL 8 5.092 -1.584 -15.684
73 HG22 VAL 8 1HG2 VAL 8 3.336 -1.530 -15.530
74 HG23 VAL 8 2HG2 VAL 8 4.324 -0.262 -14.804
75 H LEU 9 H LEU 9 6.379 -4.595 -13.126
76 HA LEU 9 HA LEU 9 8.181 -4.193 -15.182
77 HB2 LEU 9 2HB LEU 9 8.426 -5.144 -12.733
78 HB3 LEU 9 3HB LEU 9 8.376 -6.691 -13.575
79 HG LEU 9 HG LEU 9 10.668 -5.989 -13.141
80 HD11 LEU 9 1HD1 LEU 9 11.516 -6.564 -15.205
81 HD12 LEU 9 2HD1 LEU 9 10.301 -5.636 -16.083
82 HD13 LEU 9 3HD1 LEU 9 9.860 -7.162 -15.318
83 HD21 LEU 9 3HD2 LEU 9 10.557 -3.773 -15.086
84 HD22 LEU 9 1HD2 LEU 9 11.526 -3.957 -13.623
85 HD23 LEU 9 2HD2 LEU 9 9.837 -3.462 -13.506
86 H SER 10 H SER 10 6.043 -6.959 -14.622
87 HA SER 10 HA SER 10 6.855 -8.078 -17.212
88 HB2 SER 10 2HB SER 10 6.466 -9.303 -14.758
89 HB3 SER 10 3HB SER 10 4.987 -9.683 -15.640
90 HG SER 10 HG SER 10 6.563 -10.255 -17.408
91 H GLY 11 H GLY 11 4.156 -6.727 -15.466
92 HA2 GLY 11 2HA GLY 11 2.088 -7.547 -17.215
93 HA3 GLY 11 3HA GLY 11 2.018 -6.185 -16.107
94 H ILE 12 H ILE 12 4.478 -5.054 -17.453
95 HA ILE 12 HA ILE 12 3.030 -3.564 -19.469
96 HB ILE 12 HB ILE 12 4.632 -2.521 -17.802
97 HG12 ILE 12 2HG1 ILE 12 5.789 -1.501 -20.209
98 HG13 ILE 12 3HG1 ILE 12 4.111 -1.924 -20.533
99 HG21 ILE 12 1HG2 ILE 12 6.755 -3.490 -19.700
100 HG22 ILE 12 2HG2 ILE 12 6.969 -2.623 -18.180
101 HG23 ILE 12 3HG2 ILE 12 6.390 -4.289 -18.171
102 HD11 ILE 12 3HD1 ILE 12 3.787 0.185 -19.810
103 HD12 ILE 12 1HD1 ILE 12 3.775 -0.614 -18.238
104 HD13 ILE 12 2HD1 ILE 12 5.239 0.186 -18.809
105 H LEU 13 H LEU 13 5.461 -6.050 -19.318
106 HA LEU 13 HA LEU 13 6.674 -5.856 -21.787
107 HB2 LEU 13 2HB LEU 13 6.462 -7.782 -19.738
108 HB3 LEU 13 3HB LEU 13 6.091 -8.606 -21.252
109 HG LEU 13 HG LEU 13 8.596 -6.992 -20.790
110 HD11 LEU 13 1HD1 LEU 13 9.759 -9.002 -20.345
111 HD12 LEU 13 2HD1 LEU 13 8.352 -9.989 -20.741
112 HD13 LEU 13 3HD1 LEU 13 8.350 -8.998 -19.283
113 HD21 LEU 13 3HD2 LEU 13 9.139 -8.786 -22.738
114 HD22 LEU 13 1HD2 LEU 13 8.586 -7.138 -23.036
115 HD23 LEU 13 2HD2 LEU 13 7.431 -8.472 -23.052
Start of MODEL 5
1 H1 PHE 1 H PHE 1 1.947 0.167 0.897
2 HA PHE 1 HA PHE 1 2.693 0.681 -1.285
3 HB2 PHE 1 2HB PHE 1 4.377 -0.806 -1.490
4 HB3 PHE 1 3HB PHE 1 3.705 -1.537 -0.035
5 HD1 PHE 1 HD2 PHE 1 2.029 -3.421 -0.312
6 HD2 PHE 1 HD1 PHE 1 4.473 -1.994 -3.491
7 HE1 PHE 1 HE2 PHE 1 1.651 -5.519 -1.540
8 HE2 PHE 1 HE1 PHE 1 4.097 -4.089 -4.725
9 HZ PHE 1 HZ PHE 1 2.685 -5.855 -3.749
10 H LEU 2 H LEU 2 2.857 -0.281 -3.604
11 HA LEU 2 HA LEU 2 0.137 -1.067 -4.405
12 HB2 LEU 2 2HB LEU 2 2.122 0.807 -5.504
13 HB3 LEU 2 3HB LEU 2 1.276 -0.179 -6.695
14 HG LEU 2 HG LEU 2 -0.857 0.677 -5.424
15 HD11 LEU 2 1HD1 LEU 2 1.301 2.567 -4.585
16 HD12 LEU 2 2HD1 LEU 2 -0.024 1.888 -3.641
17 HD13 LEU 2 3HD1 LEU 2 -0.346 3.148 -4.832
18 HD21 LEU 2 3HD2 LEU 2 0.812 2.037 -7.494
19 HD22 LEU 2 1HD2 LEU 2 -0.669 2.803 -6.920
20 HD23 LEU 2 2HD2 LEU 2 -0.735 1.205 -7.664
21 HA PRO 3 HA PRO 3 2.141 -4.906 -5.545
22 HB2 PRO 3 2HB PRO 3 -0.150 -6.171 -6.266
23 HB3 PRO 3 3HB PRO 3 0.345 -5.967 -4.582
24 HG2 PRO 3 2HG PRO 3 -1.621 -4.377 -6.185
25 HG3 PRO 3 3HG PRO 3 -1.749 -4.958 -4.514
26 HD2 PRO 3 2HD PRO 3 -1.079 -2.406 -5.121
27 HD3 PRO 3 3HD PRO 3 -0.455 -3.241 -3.684
28 H LEU 4 H LEU 4 0.810 -2.537 -7.441
29 HA LEU 4 HA LEU 4 0.858 -4.067 -9.923
30 HB2 LEU 4 2HB LEU 4 0.254 -1.149 -9.474
31 HB3 LEU 4 3HB LEU 4 0.018 -2.046 -10.972
32 HG LEU 4 HG LEU 4 -1.512 -2.376 -8.394
33 HD11 LEU 4 1HD1 LEU 4 -2.223 -0.447 -9.624
34 HD12 LEU 4 2HD1 LEU 4 -3.422 -1.721 -9.842
35 HD13 LEU 4 3HD1 LEU 4 -2.271 -1.365 -11.129
36 HD21 LEU 4 3HD2 LEU 4 -1.720 -3.932 -10.970
37 HD22 LEU 4 1HD2 LEU 4 -2.837 -4.045 -9.610
38 HD23 LEU 4 2HD2 LEU 4 -1.159 -4.552 -9.417
39 H ILE 5 H ILE 5 2.791 -1.848 -8.109
40 HA ILE 5 HA ILE 5 4.436 -0.919 -10.229
41 HB ILE 5 HB ILE 5 5.745 0.116 -8.630
42 HG12 ILE 5 2HG1 ILE 5 4.981 -2.130 -6.758
43 HG13 ILE 5 3HG1 ILE 5 6.566 -1.814 -7.454
44 HG21 ILE 5 1HG2 ILE 5 4.242 1.286 -7.405
45 HG22 ILE 5 2HG2 ILE 5 3.096 0.389 -8.400
46 HG23 ILE 5 3HG2 ILE 5 3.467 -0.164 -6.767
47 HD11 ILE 5 3HD1 ILE 5 6.710 -1.087 -5.242
48 HD12 ILE 5 1HD1 ILE 5 6.502 0.387 -6.186
49 HD13 ILE 5 2HD1 ILE 5 5.135 -0.296 -5.306
50 H GLY 6 H GLY 6 4.605 -3.672 -8.033
51 HA2 GLY 6 2HA GLY 6 7.223 -4.467 -8.964
52 HA3 GLY 6 3HA GLY 6 6.197 -5.353 -7.846
53 H ARG 7 H ARG 7 4.057 -4.858 -10.102
54 HA ARG 7 HA ARG 7 4.715 -7.342 -11.513
55 HB2 ARG 7 2HB ARG 7 2.611 -7.675 -10.660
56 HB3 ARG 7 3HB ARG 7 2.185 -5.972 -10.756
57 HG2 ARG 7 2HG ARG 7 2.568 -7.415 -13.311
58 HG3 ARG 7 3HG ARG 7 1.134 -7.806 -12.360
59 HD2 ARG 7 2HD ARG 7 1.191 -5.062 -12.275
60 HD3 ARG 7 3HD ARG 7 1.772 -5.411 -13.903
61 HE ARG 7 HE ARG 7 -0.601 -6.864 -13.173
62 HH11 ARG 7 1HH1 ARG 7 0.659 -3.907 -14.510
63 HH12 ARG 7 2HH1 ARG 7 -0.791 -3.529 -15.380
64 HH21 ARG 7 1HH2 ARG 7 -2.515 -6.378 -14.315
65 HH22 ARG 7 2HH2 ARG 7 -2.596 -4.936 -15.268
66 H VAL 8 H VAL 8 3.973 -3.958 -12.026
67 HA VAL 8 HA VAL 8 3.400 -3.814 -14.691
68 HB VAL 8 HB VAL 8 3.565 -1.862 -13.155
69 HG11 VAL 8 1HG1 VAL 8 5.502 -1.081 -12.308
70 HG12 VAL 8 2HG1 VAL 8 6.067 -2.725 -12.607
71 HG13 VAL 8 3HG1 VAL 8 6.413 -1.447 -13.773
72 HG21 VAL 8 3HG2 VAL 8 4.423 -0.284 -14.864
73 HG22 VAL 8 1HG2 VAL 8 5.041 -1.661 -15.777
74 HG23 VAL 8 2HG2 VAL 8 3.306 -1.480 -15.521
75 H LEU 9 H LEU 9 6.480 -4.551 -13.213
76 HA LEU 9 HA LEU 9 8.237 -4.107 -15.295
77 HB2 LEU 9 2HB LEU 9 8.327 -6.494 -13.462
78 HB3 LEU 9 3HB LEU 9 9.683 -5.725 -14.284
79 HG LEU 9 HG LEU 9 8.174 -3.992 -12.438
80 HD11 LEU 9 1HD1 LEU 9 8.608 -5.028 -10.484
81 HD12 LEU 9 2HD1 LEU 9 10.093 -5.769 -11.078
82 HD13 LEU 9 3HD1 LEU 9 8.531 -6.479 -11.484
83 HD21 LEU 9 3HD2 LEU 9 10.160 -2.923 -12.256
84 HD22 LEU 9 1HD2 LEU 9 10.480 -3.753 -13.779
85 HD23 LEU 9 2HD2 LEU 9 11.094 -4.419 -12.265
86 H SER 10 H SER 10 6.180 -6.931 -14.708
87 HA SER 10 HA SER 10 6.973 -8.019 -17.317
88 HB2 SER 10 2HB SER 10 6.339 -9.209 -14.773
89 HB3 SER 10 3HB SER 10 5.242 -9.826 -16.007
90 HG SER 10 HG SER 10 8.071 -9.758 -16.238
91 H GLY 11 H GLY 11 4.272 -6.740 -15.519
92 HA2 GLY 11 2HA GLY 11 2.195 -7.606 -17.235
93 HA3 GLY 11 3HA GLY 11 2.110 -6.249 -16.121
94 H ILE 12 H ILE 12 4.517 -5.054 -17.506
95 HA ILE 12 HA ILE 12 2.998 -3.596 -19.492
96 HB ILE 12 HB ILE 12 4.601 -2.517 -17.849
97 HG12 ILE 12 2HG1 ILE 12 5.659 -1.100 -19.830
98 HG13 ILE 12 3HG1 ILE 12 4.533 -2.046 -20.797
99 HG21 ILE 12 1HG2 ILE 12 6.761 -3.283 -19.775
100 HG22 ILE 12 2HG2 ILE 12 6.903 -2.637 -18.141
101 HG23 ILE 12 3HG2 ILE 12 6.381 -4.303 -18.388
102 HD11 ILE 12 3HD1 ILE 12 3.193 -1.014 -18.491
103 HD12 ILE 12 1HD1 ILE 12 4.016 0.290 -19.347
104 HD13 ILE 12 2HD1 ILE 12 2.860 -0.734 -20.200
105 H LEU 13 H LEU 13 5.494 -6.019 -19.390
106 HA LEU 13 HA LEU 13 6.659 -5.788 -21.879
107 HB2 LEU 13 2HB LEU 13 7.388 -7.383 -20.187
108 HB3 LEU 13 3HB LEU 13 5.909 -8.314 -20.413
109 HG LEU 13 HG LEU 13 7.507 -7.950 -22.850
110 HD11 LEU 13 1HD1 LEU 13 8.966 -9.944 -21.939
111 HD12 LEU 13 2HD1 LEU 13 8.662 -9.157 -20.390
112 HD13 LEU 13 3HD1 LEU 13 9.449 -8.266 -21.692
113 HD21 LEU 13 3HD2 LEU 13 7.113 -10.561 -22.647
114 HD22 LEU 13 1HD2 LEU 13 5.834 -9.463 -23.166
115 HD23 LEU 13 2HD2 LEU 13 5.881 -10.036 -21.498
Start of MODEL 6
1 H1 PHE 1 H PHE 1 1.898 -0.235 0.758
2 HA PHE 1 HA PHE 1 2.758 1.312 -1.460
3 HB2 PHE 1 2HB PHE 1 4.435 -0.191 -1.587
4 HB3 PHE 1 3HB PHE 1 3.790 -0.810 -0.070
5 HD1 PHE 1 HD2 PHE 1 2.107 -2.705 -0.175
6 HD2 PHE 1 HD1 PHE 1 4.492 -1.523 -3.497
7 HE1 PHE 1 HE2 PHE 1 1.701 -4.886 -1.239
8 HE2 PHE 1 HE1 PHE 1 4.089 -3.702 -4.566
9 HZ PHE 1 HZ PHE 1 2.694 -5.388 -3.436
10 H LEU 2 H LEU 2 2.877 0.182 -3.704
11 HA LEU 2 HA LEU 2 0.141 -0.652 -4.395
12 HB2 LEU 2 2HB LEU 2 2.108 1.131 -5.664
13 HB3 LEU 2 3HB LEU 2 1.242 0.061 -6.765
14 HG LEU 2 HG LEU 2 0.168 2.238 -6.635
15 HD11 LEU 2 1HD1 LEU 2 -1.893 1.363 -6.749
16 HD12 LEU 2 2HD1 LEU 2 -1.797 0.661 -5.134
17 HD13 LEU 2 3HD1 LEU 2 -1.065 -0.175 -6.504
18 HD21 LEU 2 3HD2 LEU 2 0.959 2.450 -4.132
19 HD22 LEU 2 1HD2 LEU 2 -0.637 1.774 -3.808
20 HD23 LEU 2 2HD2 LEU 2 -0.485 3.284 -4.707
21 HA PRO 3 HA PRO 3 2.117 -4.571 -5.286
22 HB2 PRO 3 2HB PRO 3 -0.190 -5.879 -5.869
23 HB3 PRO 3 3HB PRO 3 0.338 -5.552 -4.213
24 HG2 PRO 3 2HG PRO 3 -1.656 -4.079 -5.892
25 HG3 PRO 3 3HG PRO 3 -1.753 -4.535 -4.181
26 HD2 PRO 3 2HD PRO 3 -1.090 -2.036 -4.987
27 HD3 PRO 3 3HD PRO 3 -0.440 -2.765 -3.505
28 H LEU 4 H LEU 4 0.753 -2.343 -7.326
29 HA LEU 4 HA LEU 4 0.752 -4.053 -9.689
30 HB2 LEU 4 2HB LEU 4 0.167 -1.106 -9.452
31 HB3 LEU 4 3HB LEU 4 -0.111 -2.118 -10.868
32 HG LEU 4 HG LEU 4 -1.578 -2.234 -8.236
33 HD11 LEU 4 1HD1 LEU 4 -2.403 -1.441 -11.022
34 HD12 LEU 4 2HD1 LEU 4 -2.307 -0.402 -9.600
35 HD13 LEU 4 3HD1 LEU 4 -3.520 -1.680 -9.678
36 HD21 LEU 4 3HD2 LEU 4 -2.935 -3.989 -9.272
37 HD22 LEU 4 1HD2 LEU 4 -1.250 -4.485 -9.103
38 HD23 LEU 4 2HD2 LEU 4 -1.868 -3.983 -10.677
39 H ILE 5 H ILE 5 2.723 -1.712 -8.080
40 HA ILE 5 HA ILE 5 4.329 -0.948 -10.294
41 HB ILE 5 HB ILE 5 5.670 0.199 -8.801
42 HG12 ILE 5 2HG1 ILE 5 4.938 -1.900 -6.754
43 HG13 ILE 5 3HG1 ILE 5 6.510 -1.642 -7.501
44 HG21 ILE 5 1HG2 ILE 5 4.192 1.461 -7.638
45 HG22 ILE 5 2HG2 ILE 5 3.027 0.495 -8.541
46 HG23 ILE 5 3HG2 ILE 5 3.428 0.064 -6.879
47 HD11 ILE 5 3HD1 ILE 5 6.034 0.780 -6.355
48 HD12 ILE 5 1HD1 ILE 5 5.277 -0.325 -5.209
49 HD13 ILE 5 2HD1 ILE 5 6.978 -0.523 -5.632
50 H GLY 6 H GLY 6 4.535 -3.531 -7.904
51 HA2 GLY 6 2HA GLY 6 7.134 -4.401 -8.820
52 HA3 GLY 6 3HA GLY 6 6.125 -5.200 -7.624
53 H ARG 7 H ARG 7 3.944 -4.869 -9.865
54 HA ARG 7 HA ARG 7 4.573 -7.449 -11.105
55 HB2 ARG 7 2HB ARG 7 2.484 -7.714 -10.195
56 HB3 ARG 7 3HB ARG 7 2.061 -6.020 -10.403
57 HG2 ARG 7 2HG ARG 7 2.393 -7.642 -12.857
58 HG3 ARG 7 3HG ARG 7 0.976 -7.959 -11.854
59 HD2 ARG 7 2HD ARG 7 1.086 -5.201 -11.983
60 HD3 ARG 7 3HD ARG 7 1.561 -5.712 -13.602
61 HE ARG 7 HE ARG 7 -0.794 -7.026 -12.592
62 HH11 ARG 7 1HH1 ARG 7 0.453 -4.267 -14.311
63 HH12 ARG 7 2HH1 ARG 7 -1.036 -3.945 -15.137
64 HH21 ARG 7 1HH2 ARG 7 -2.759 -6.612 -13.674
65 HH22 ARG 7 2HH2 ARG 7 -2.862 -5.279 -14.774
66 H VAL 8 H VAL 8 3.823 -4.111 -11.851
67 HA VAL 8 HA VAL 8 3.208 -4.164 -14.512
68 HB VAL 8 HB VAL 8 3.396 -2.106 -13.115
69 HG11 VAL 8 1HG1 VAL 8 5.353 -1.248 -12.391
70 HG12 VAL 8 2HG1 VAL 8 5.911 -2.913 -12.566
71 HG13 VAL 8 3HG1 VAL 8 6.227 -1.738 -13.842
72 HG21 VAL 8 3HG2 VAL 8 3.165 -2.066 -15.594
73 HG22 VAL 8 1HG2 VAL 8 3.982 -0.651 -14.931
74 HG23 VAL 8 2HG2 VAL 8 4.919 -1.925 -15.712
75 H LEU 9 H LEU 9 6.306 -4.796 -13.029
76 HA LEU 9 HA LEU 9 8.033 -4.499 -15.166
77 HB2 LEU 9 2HB LEU 9 8.393 -5.252 -12.672
78 HB3 LEU 9 3HB LEU 9 8.330 -6.865 -13.378
79 HG LEU 9 HG LEU 9 10.628 -6.091 -13.089
80 HD11 LEU 9 1HD1 LEU 9 9.591 -7.339 -15.255
81 HD12 LEU 9 2HD1 LEU 9 11.314 -7.082 -14.983
82 HD13 LEU 9 3HD1 LEU 9 10.409 -5.974 -16.015
83 HD21 LEU 9 3HD2 LEU 9 11.376 -4.071 -13.695
84 HD22 LEU 9 1HD2 LEU 9 9.672 -3.626 -13.788
85 HD23 LEU 9 2HD2 LEU 9 10.535 -4.120 -15.245
86 H SER 10 H SER 10 5.987 -7.269 -14.342
87 HA SER 10 HA SER 10 6.747 -8.550 -16.872
88 HB2 SER 10 2HB SER 10 6.426 -9.594 -14.308
89 HB3 SER 10 3HB SER 10 4.975 -10.108 -15.169
90 HG SER 10 HG SER 10 7.643 -10.780 -15.604
91 H GLY 11 H GLY 11 4.069 -7.143 -15.137
92 HA2 GLY 11 2HA GLY 11 1.967 -8.136 -16.746
93 HA3 GLY 11 3HA GLY 11 1.901 -6.693 -15.746
94 H ILE 12 H ILE 12 4.312 -5.663 -17.292
95 HA ILE 12 HA ILE 12 2.749 -4.386 -19.383
96 HB ILE 12 HB ILE 12 4.305 -3.122 -17.827
97 HG12 ILE 12 2HG1 ILE 12 5.267 -2.484 -20.540
98 HG13 ILE 12 3HG1 ILE 12 3.519 -2.621 -20.389
99 HG21 ILE 12 1HG2 ILE 12 6.484 -4.064 -19.664
100 HG22 ILE 12 2HG2 ILE 12 6.627 -3.165 -18.155
101 HG23 ILE 12 3HG2 ILE 12 6.145 -4.861 -18.129
102 HD11 ILE 12 3HD1 ILE 12 5.272 -0.840 -18.714
103 HD12 ILE 12 1HD1 ILE 12 4.311 -0.325 -20.100
104 HD13 ILE 12 2HD1 ILE 12 3.513 -0.939 -18.652
105 H LEU 13 H LEU 13 5.312 -6.718 -19.045
106 HA LEU 13 HA LEU 13 5.058 -7.481 -21.801
107 HB2 LEU 13 2HB LEU 13 6.589 -5.772 -22.256
108 HB3 LEU 13 3HB LEU 13 7.521 -6.099 -20.796
109 HG LEU 13 HG LEU 13 7.535 -8.363 -22.608
110 HD11 LEU 13 1HD1 LEU 13 7.300 -6.311 -24.159
111 HD12 LEU 13 2HD1 LEU 13 8.581 -7.480 -24.477
112 HD13 LEU 13 3HD1 LEU 13 8.958 -5.957 -23.674
113 HD21 LEU 13 3HD2 LEU 13 9.806 -8.409 -22.078
114 HD22 LEU 13 1HD2 LEU 13 9.050 -7.750 -20.627
115 HD23 LEU 13 2HD2 LEU 13 9.866 -6.674 -21.763
Start of MODEL 7
1 H1 PHE 1 H PHE 1 2.223 -0.677 0.840
2 HA PHE 1 HA PHE 1 2.960 0.790 -1.365
3 HB2 PHE 1 2HB PHE 1 4.591 -0.752 -1.589
4 HB3 PHE 1 3HB PHE 1 3.922 -1.452 -0.119
5 HD1 PHE 1 HD2 PHE 1 2.183 -3.283 -0.353
6 HD2 PHE 1 HD1 PHE 1 4.612 -1.954 -3.585
7 HE1 PHE 1 HE2 PHE 1 1.714 -5.375 -1.561
8 HE2 PHE 1 HE1 PHE 1 4.147 -4.043 -4.799
9 HZ PHE 1 HZ PHE 1 2.697 -5.757 -3.786
10 H LEU 2 H LEU 2 3.050 -0.190 -3.679
11 HA LEU 2 HA LEU 2 0.291 -0.894 -4.426
12 HB2 LEU 2 2HB LEU 2 2.315 0.909 -5.573
13 HB3 LEU 2 3HB LEU 2 1.416 -0.056 -6.742
14 HG LEU 2 HG LEU 2 -0.100 1.480 -4.685
15 HD11 LEU 2 1HD1 LEU 2 -0.012 3.500 -5.909
16 HD12 LEU 2 2HD1 LEU 2 0.878 2.747 -7.231
17 HD13 LEU 2 3HD1 LEU 2 1.661 2.994 -5.671
18 HD21 LEU 2 3HD2 LEU 2 -1.633 1.715 -6.667
19 HD22 LEU 2 1HD2 LEU 2 -1.389 0.067 -6.088
20 HD23 LEU 2 2HD2 LEU 2 -0.551 0.625 -7.536
21 HA PRO 3 HA PRO 3 2.151 -4.801 -5.577
22 HB2 PRO 3 2HB PRO 3 -0.192 -5.997 -6.250
23 HB3 PRO 3 3HB PRO 3 0.340 -5.799 -4.576
24 HG2 PRO 3 2HG PRO 3 -1.603 -4.156 -6.153
25 HG3 PRO 3 3HG PRO 3 -1.719 -4.723 -4.477
26 HD2 PRO 3 2HD PRO 3 -0.979 -2.197 -5.112
27 HD3 PRO 3 3HD PRO 3 -0.356 -3.043 -3.681
28 H LEU 4 H LEU 4 0.863 -2.401 -7.464
29 HA LEU 4 HA LEU 4 0.817 -3.947 -9.938
30 HB2 LEU 4 2HB LEU 4 0.318 -1.007 -9.502
31 HB3 LEU 4 3HB LEU 4 0.016 -1.912 -10.984
32 HG LEU 4 HG LEU 4 -1.461 -2.168 -8.367
33 HD11 LEU 4 1HD1 LEU 4 -3.382 -1.456 -9.778
34 HD12 LEU 4 2HD1 LEU 4 -2.244 -1.136 -11.087
35 HD13 LEU 4 3HD1 LEU 4 -2.137 -0.221 -9.583
36 HD21 LEU 4 3HD2 LEU 4 -1.753 -3.739 -10.925
37 HD22 LEU 4 1HD2 LEU 4 -2.887 -3.780 -9.575
38 HD23 LEU 4 2HD2 LEU 4 -1.236 -4.361 -9.357
39 H ILE 5 H ILE 5 2.852 -1.779 -8.172
40 HA ILE 5 HA ILE 5 4.487 -0.915 -10.327
41 HB ILE 5 HB ILE 5 5.857 0.086 -8.758
42 HG12 ILE 5 2HG1 ILE 5 5.055 -2.124 -6.859
43 HG13 ILE 5 3HG1 ILE 5 6.637 -1.863 -7.585
44 HG21 ILE 5 1HG2 ILE 5 4.414 1.310 -7.514
45 HG22 ILE 5 2HG2 ILE 5 3.222 0.444 -8.482
46 HG23 ILE 5 3HG2 ILE 5 3.606 -0.110 -6.852
47 HD11 ILE 5 3HD1 ILE 5 6.147 0.497 -6.255
48 HD12 ILE 5 1HD1 ILE 5 5.485 -0.735 -5.181
49 HD13 ILE 5 2HD1 ILE 5 7.169 -0.828 -5.698
50 H GLY 6 H GLY 6 4.609 -3.660 -8.118
51 HA2 GLY 6 2HA GLY 6 7.183 -4.543 -9.089
52 HA3 GLY 6 3HA GLY 6 6.148 -5.391 -7.950
53 H ARG 7 H ARG 7 3.984 -4.843 -10.166
54 HA ARG 7 HA ARG 7 4.540 -7.351 -11.578
55 HB2 ARG 7 2HB ARG 7 2.441 -7.615 -10.692
56 HB3 ARG 7 3HB ARG 7 2.069 -5.898 -10.782
57 HG2 ARG 7 2HG ARG 7 2.359 -7.356 -13.342
58 HG3 ARG 7 3HG ARG 7 0.929 -7.697 -12.366
59 HD2 ARG 7 2HD ARG 7 0.963 -5.003 -12.251
60 HD3 ARG 7 3HD ARG 7 1.692 -5.257 -13.836
61 HE ARG 7 HE ARG 7 -0.373 -5.811 -14.613
62 HH11 ARG 7 1HH1 ARG 7 -0.325 -6.320 -11.170
63 HH12 ARG 7 2HH1 ARG 7 -2.001 -6.747 -11.078
64 HH21 ARG 7 1HH2 ARG 7 -2.582 -6.372 -14.505
65 HH22 ARG 7 2HH2 ARG 7 -3.284 -6.778 -12.976
66 H VAL 8 H VAL 8 3.893 -3.948 -12.097
67 HA VAL 8 HA VAL 8 3.285 -3.802 -14.756
68 HB VAL 8 HB VAL 8 3.530 -1.851 -13.222
69 HG11 VAL 8 1HG1 VAL 8 6.017 -2.769 -12.726
70 HG12 VAL 8 2HG1 VAL 8 6.373 -1.518 -13.918
71 HG13 VAL 8 3HG1 VAL 8 5.508 -1.106 -12.437
72 HG21 VAL 8 3HG2 VAL 8 3.837 -1.983 -15.960
73 HG22 VAL 8 1HG2 VAL 8 3.524 -0.525 -15.018
74 HG23 VAL 8 2HG2 VAL 8 5.179 -0.960 -15.447
75 H LEU 9 H LEU 9 6.358 -4.626 -13.315
76 HA LEU 9 HA LEU 9 8.099 -4.237 -15.425
77 HB2 LEU 9 2HB LEU 9 8.023 -6.394 -13.330
78 HB3 LEU 9 3HB LEU 9 9.359 -6.203 -14.463
79 HG LEU 9 HG LEU 9 9.224 -3.709 -13.406
80 HD11 LEU 9 1HD1 LEU 9 7.568 -5.187 -11.736
81 HD12 LEU 9 2HD1 LEU 9 8.280 -3.610 -11.398
82 HD13 LEU 9 3HD1 LEU 9 9.099 -5.079 -10.867
83 HD21 LEU 9 3HD2 LEU 9 11.268 -4.195 -12.476
84 HD22 LEU 9 1HD2 LEU 9 11.107 -5.512 -13.638
85 HD23 LEU 9 2HD2 LEU 9 10.763 -5.795 -11.931
86 H SER 10 H SER 10 5.969 -6.994 -14.794
87 HA SER 10 HA SER 10 6.698 -8.123 -17.404
88 HB2 SER 10 2HB SER 10 6.537 -9.395 -15.027
89 HB3 SER 10 3HB SER 10 4.886 -9.628 -15.602
90 HG SER 10 HG SER 10 6.208 -11.315 -16.318
91 H GLY 11 H GLY 11 4.058 -6.756 -15.581
92 HA2 GLY 11 2HA GLY 11 1.933 -7.574 -17.257
93 HA3 GLY 11 3HA GLY 11 1.907 -6.200 -16.161
94 H ILE 12 H ILE 12 4.360 -5.156 -17.641
95 HA ILE 12 HA ILE 12 2.840 -3.695 -19.645
96 HB ILE 12 HB ILE 12 4.413 -2.576 -17.998
97 HG12 ILE 12 2HG1 ILE 12 5.555 -1.479 -20.329
98 HG13 ILE 12 3HG1 ILE 12 3.974 -2.089 -20.806
99 HG21 ILE 12 1HG2 ILE 12 6.201 -4.420 -18.640
100 HG22 ILE 12 2HG2 ILE 12 6.653 -3.210 -19.839
101 HG23 ILE 12 3HG2 ILE 12 6.678 -2.803 -18.124
102 HD11 ILE 12 3HD1 ILE 12 3.064 -0.259 -19.975
103 HD12 ILE 12 1HD1 ILE 12 3.612 -0.739 -18.369
104 HD13 ILE 12 2HD1 ILE 12 4.632 0.286 -19.379
105 H LEU 13 H LEU 13 5.341 -6.107 -19.444
106 HA LEU 13 HA LEU 13 6.256 -5.860 -22.136
107 HB2 LEU 13 2HB LEU 13 7.494 -6.902 -20.189
108 HB3 LEU 13 3HB LEU 13 6.446 -8.304 -20.393
109 HG LEU 13 HG LEU 13 7.406 -8.098 -22.893
110 HD11 LEU 13 1HD1 LEU 13 9.921 -7.716 -22.525
111 HD12 LEU 13 2HD1 LEU 13 9.427 -6.820 -21.089
112 HD13 LEU 13 3HD1 LEU 13 8.873 -6.306 -22.682
113 HD21 LEU 13 3HD2 LEU 13 8.344 -9.547 -20.466
114 HD22 LEU 13 1HD2 LEU 13 9.279 -9.684 -21.956
115 HD23 LEU 13 2HD2 LEU 13 7.584 -10.170 -21.931
Start of MODEL 8
1 H1 PHE 1 H PHE 1 2.114 -0.347 1.035
2 HA PHE 1 HA PHE 1 2.740 0.614 -1.222
3 HB2 PHE 1 2HB PHE 1 4.395 -0.904 -1.426
4 HB3 PHE 1 3HB PHE 1 3.705 -1.626 0.024
5 HD1 PHE 1 HD2 PHE 1 1.995 -3.478 -0.264
6 HD2 PHE 1 HD1 PHE 1 4.473 -2.086 -3.432
7 HE1 PHE 1 HE2 PHE 1 1.579 -5.563 -1.501
8 HE2 PHE 1 HE1 PHE 1 4.061 -4.169 -4.674
9 HZ PHE 1 HZ PHE 1 2.613 -5.912 -3.709
10 H LEU 2 H LEU 2 2.890 -0.343 -3.543
11 HA LEU 2 HA LEU 2 0.157 -1.075 -4.352
12 HB2 LEU 2 2HB LEU 2 2.180 0.764 -5.442
13 HB3 LEU 2 3HB LEU 2 1.316 -0.200 -6.637
14 HG LEU 2 HG LEU 2 -0.761 0.735 -5.194
15 HD11 LEU 2 1HD1 LEU 2 0.428 3.313 -5.306
16 HD12 LEU 2 2HD1 LEU 2 1.446 2.273 -4.311
17 HD13 LEU 2 3HD1 LEU 2 -0.261 2.473 -3.917
18 HD21 LEU 2 3HD2 LEU 2 -0.639 2.685 -6.975
19 HD22 LEU 2 1HD2 LEU 2 -0.961 1.017 -7.448
20 HD23 LEU 2 2HD2 LEU 2 0.662 1.685 -7.624
21 HA PRO 3 HA PRO 3 2.091 -4.946 -5.501
22 HB2 PRO 3 2HB PRO 3 -0.222 -6.165 -6.233
23 HB3 PRO 3 3HB PRO 3 0.272 -5.976 -4.546
24 HG2 PRO 3 2HG PRO 3 -1.659 -4.344 -6.148
25 HG3 PRO 3 3HG PRO 3 -1.802 -4.928 -4.480
26 HD2 PRO 3 2HD PRO 3 -1.082 -2.387 -5.077
27 HD3 PRO 3 3HD PRO 3 -0.478 -3.239 -3.641
28 H LEU 4 H LEU 4 0.811 -2.545 -7.392
29 HA LEU 4 HA LEU 4 0.836 -4.068 -9.880
30 HB2 LEU 4 2HB LEU 4 0.290 -1.138 -9.429
31 HB3 LEU 4 3HB LEU 4 0.030 -2.035 -10.924
32 HG LEU 4 HG LEU 4 -1.496 -2.335 -8.339
33 HD11 LEU 4 1HD1 LEU 4 -2.101 -0.366 -9.633
34 HD12 LEU 4 2HD1 LEU 4 -3.389 -1.569 -9.684
35 HD13 LEU 4 3HD1 LEU 4 -2.320 -1.363 -11.072
36 HD21 LEU 4 3HD2 LEU 4 -1.203 -4.512 -9.375
37 HD22 LEU 4 1HD2 LEU 4 -1.749 -3.870 -10.924
38 HD23 LEU 4 2HD2 LEU 4 -2.869 -3.962 -9.564
39 H ILE 5 H ILE 5 2.805 -1.891 -8.053
40 HA ILE 5 HA ILE 5 4.472 -0.985 -10.165
41 HB ILE 5 HB ILE 5 5.797 0.019 -8.558
42 HG12 ILE 5 2HG1 ILE 5 4.985 -2.219 -6.697
43 HG13 ILE 5 3HG1 ILE 5 6.578 -1.931 -7.388
44 HG21 ILE 5 1HG2 ILE 5 4.313 1.212 -7.333
45 HG22 ILE 5 2HG2 ILE 5 3.153 0.340 -8.334
46 HG23 ILE 5 3HG2 ILE 5 3.510 -0.225 -6.702
47 HD11 ILE 5 3HD1 ILE 5 6.524 0.281 -6.114
48 HD12 ILE 5 1HD1 ILE 5 5.173 -0.420 -5.222
49 HD13 ILE 5 2HD1 ILE 5 6.754 -1.202 -5.188
50 H GLY 6 H GLY 6 4.587 -3.748 -7.978
51 HA2 GLY 6 2HA GLY 6 7.192 -4.588 -8.902
52 HA3 GLY 6 3HA GLY 6 6.142 -5.462 -7.797
53 H ARG 7 H ARG 7 4.021 -4.919 -10.053
54 HA ARG 7 HA ARG 7 4.642 -7.402 -11.481
55 HB2 ARG 7 2HB ARG 7 2.529 -7.704 -10.642
56 HB3 ARG 7 3HB ARG 7 2.134 -5.992 -10.726
57 HG2 ARG 7 2HG ARG 7 2.503 -7.423 -13.291
58 HG3 ARG 7 3HG ARG 7 1.057 -7.794 -12.350
59 HD2 ARG 7 2HD ARG 7 1.147 -5.060 -12.237
60 HD3 ARG 7 3HD ARG 7 1.758 -5.389 -13.858
61 HE ARG 7 HE ARG 7 -0.652 -6.818 -13.191
62 HH11 ARG 7 1HH1 ARG 7 0.690 -3.881 -14.494
63 HH12 ARG 7 2HH1 ARG 7 -0.732 -3.479 -15.398
64 HH21 ARG 7 1HH2 ARG 7 -2.530 -6.299 -14.378
65 HH22 ARG 7 2HH2 ARG 7 -2.563 -4.855 -15.331
66 H VAL 8 H VAL 8 3.961 -4.003 -11.975
67 HA VAL 8 HA VAL 8 3.411 -3.839 -14.647
68 HB VAL 8 HB VAL 8 3.588 -1.902 -13.081
69 HG11 VAL 8 1HG1 VAL 8 6.436 -1.508 -13.723
70 HG12 VAL 8 2HG1 VAL 8 5.538 -1.129 -12.252
71 HG13 VAL 8 3HG1 VAL 8 6.084 -2.780 -12.554
72 HG21 VAL 8 3HG2 VAL 8 4.146 -0.321 -14.764
73 HG22 VAL 8 1HG2 VAL 8 5.196 -1.472 -15.590
74 HG23 VAL 8 2HG2 VAL 8 3.449 -1.715 -15.591
75 H LEU 9 H LEU 9 6.451 -4.652 -13.143
76 HA LEU 9 HA LEU 9 8.240 -4.201 -15.206
77 HB2 LEU 9 2HB LEU 9 8.118 -6.260 -13.036
78 HB3 LEU 9 3HB LEU 9 9.420 -6.283 -14.224
79 HG LEU 9 HG LEU 9 10.179 -5.191 -12.219
80 HD11 LEU 9 1HD1 LEU 9 10.186 -4.020 -14.784
81 HD12 LEU 9 2HD1 LEU 9 11.360 -3.809 -13.485
82 HD13 LEU 9 3HD1 LEU 9 9.985 -2.713 -13.617
83 HD21 LEU 9 3HD2 LEU 9 8.193 -2.988 -12.528
84 HD22 LEU 9 1HD2 LEU 9 9.086 -3.511 -11.099
85 HD23 LEU 9 2HD2 LEU 9 7.720 -4.463 -11.682
86 H SER 10 H SER 10 6.141 -6.999 -14.652
87 HA SER 10 HA SER 10 6.953 -8.091 -17.253
88 HB2 SER 10 2HB SER 10 6.747 -9.385 -14.888
89 HB3 SER 10 3HB SER 10 5.120 -9.644 -15.518
90 HG SER 10 HG SER 10 6.881 -11.207 -16.094
91 H GLY 11 H GLY 11 4.247 -6.783 -15.484
92 HA2 GLY 11 2HA GLY 11 2.180 -7.618 -17.226
93 HA3 GLY 11 3HA GLY 11 2.100 -6.261 -16.112
94 H ILE 12 H ILE 12 4.539 -5.097 -17.467
95 HA ILE 12 HA ILE 12 3.063 -3.615 -19.467
96 HB ILE 12 HB ILE 12 4.663 -2.561 -17.806
97 HG12 ILE 12 2HG1 ILE 12 5.712 -1.084 -19.676
98 HG13 ILE 12 3HG1 ILE 12 4.767 -2.087 -20.771
99 HG21 ILE 12 1HG2 ILE 12 6.780 -3.517 -19.719
100 HG22 ILE 12 2HG2 ILE 12 7.002 -2.628 -18.213
101 HG23 ILE 12 3HG2 ILE 12 6.440 -4.299 -18.175
102 HD11 ILE 12 3HD1 ILE 12 3.348 -0.329 -20.420
103 HD12 ILE 12 1HD1 ILE 12 2.800 -1.457 -19.180
104 HD13 ILE 12 2HD1 ILE 12 3.854 -0.112 -18.744
105 H LEU 13 H LEU 13 5.522 -6.074 -19.343
106 HA LEU 13 HA LEU 13 6.717 -5.856 -21.819
107 HB2 LEU 13 2HB LEU 13 7.289 -7.483 -20.013
108 HB3 LEU 13 3HB LEU 13 5.896 -8.442 -20.508
109 HG LEU 13 HG LEU 13 7.866 -7.822 -22.621
110 HD11 LEU 13 1HD1 LEU 13 9.594 -8.375 -21.275
111 HD12 LEU 13 2HD1 LEU 13 9.048 -10.012 -21.635
112 HD13 LEU 13 3HD1 LEU 13 8.569 -9.235 -20.126
113 HD21 LEU 13 3HD2 LEU 13 7.199 -10.577 -22.297
114 HD22 LEU 13 1HD2 LEU 13 6.751 -9.471 -23.597
115 HD23 LEU 13 2HD2 LEU 13 5.730 -9.609 -22.165
Start of MODEL 9
1 H1 PHE 1 H PHE 1 1.825 -1.090 0.678
2 HA PHE 1 HA PHE 1 2.879 0.684 -1.345
3 HB2 PHE 1 2HB PHE 1 4.532 -0.835 -1.566
4 HB3 PHE 1 3HB PHE 1 3.873 -1.539 -0.093
5 HD1 PHE 1 HD2 PHE 1 2.159 -3.396 -0.322
6 HD2 PHE 1 HD1 PHE 1 4.572 -2.044 -3.556
7 HE1 PHE 1 HE2 PHE 1 1.721 -5.498 -1.523
8 HE2 PHE 1 HE1 PHE 1 4.138 -4.143 -4.763
9 HZ PHE 1 HZ PHE 1 2.712 -5.874 -3.746
10 H LEU 2 H LEU 2 2.987 -0.303 -3.657
11 HA LEU 2 HA LEU 2 0.239 -1.045 -4.406
12 HB2 LEU 2 2HB LEU 2 2.240 0.782 -5.554
13 HB3 LEU 2 3HB LEU 2 1.360 -0.201 -6.723
14 HG LEU 2 HG LEU 2 -0.735 0.709 -5.404
15 HD11 LEU 2 1HD1 LEU 2 -0.320 3.087 -4.757
16 HD12 LEU 2 2HD1 LEU 2 1.408 2.748 -4.844
17 HD13 LEU 2 3HD1 LEU 2 0.401 1.894 -3.676
18 HD21 LEU 2 3HD2 LEU 2 -1.109 2.063 -7.196
19 HD22 LEU 2 1HD2 LEU 2 0.247 1.130 -7.831
20 HD23 LEU 2 2HD2 LEU 2 0.520 2.741 -7.168
21 HA PRO 3 HA PRO 3 2.153 -4.932 -5.540
22 HB2 PRO 3 2HB PRO 3 -0.173 -6.162 -6.209
23 HB3 PRO 3 3HB PRO 3 0.355 -5.950 -4.535
24 HG2 PRO 3 2HG PRO 3 -1.609 -4.340 -6.120
25 HG3 PRO 3 3HG PRO 3 -1.719 -4.902 -4.442
26 HD2 PRO 3 2HD PRO 3 -1.012 -2.369 -5.087
27 HD3 PRO 3 3HD PRO 3 -0.379 -3.201 -3.652
28 H LEU 4 H LEU 4 0.833 -2.557 -7.437
29 HA LEU 4 HA LEU 4 0.809 -4.113 -9.904
30 HB2 LEU 4 2HB LEU 4 0.269 -1.179 -9.476
31 HB3 LEU 4 3HB LEU 4 -0.013 -2.088 -10.959
32 HG LEU 4 HG LEU 4 -1.500 -2.357 -8.349
33 HD11 LEU 4 1HD1 LEU 4 -2.127 -0.416 -9.681
34 HD12 LEU 4 2HD1 LEU 4 -3.413 -1.621 -9.676
35 HD13 LEU 4 3HD1 LEU 4 -2.372 -1.449 -11.089
36 HD21 LEU 4 3HD2 LEU 4 -2.875 -4.019 -9.512
37 HD22 LEU 4 1HD2 LEU 4 -1.201 -4.551 -9.356
38 HD23 LEU 4 2HD2 LEU 4 -1.791 -3.940 -10.902
39 H ILE 5 H ILE 5 2.815 -1.912 -8.146
40 HA ILE 5 HA ILE 5 4.440 -1.036 -10.304
41 HB ILE 5 HB ILE 5 5.795 -0.009 -8.738
42 HG12 ILE 5 2HG1 ILE 5 5.022 -2.221 -6.830
43 HG13 ILE 5 3HG1 ILE 5 6.600 -1.943 -7.557
44 HG21 ILE 5 1HG2 ILE 5 4.336 1.201 -7.501
45 HG22 ILE 5 2HG2 ILE 5 3.156 0.315 -8.466
46 HG23 ILE 5 3HG2 ILE 5 3.545 -0.227 -6.834
47 HD11 ILE 5 3HD1 ILE 5 6.921 -1.122 -5.448
48 HD12 ILE 5 1HD1 ILE 5 6.442 0.342 -6.307
49 HD13 ILE 5 2HD1 ILE 5 5.269 -0.521 -5.311
50 H GLY 6 H GLY 6 4.598 -3.767 -8.080
51 HA2 GLY 6 2HA GLY 6 7.184 -4.621 -9.044
52 HA3 GLY 6 3HA GLY 6 6.157 -5.479 -7.905
53 H ARG 7 H ARG 7 3.990 -4.969 -10.125
54 HA ARG 7 HA ARG 7 4.583 -7.473 -11.529
55 HB2 ARG 7 2HB ARG 7 2.487 -7.762 -10.641
56 HB3 ARG 7 3HB ARG 7 2.090 -6.052 -10.743
57 HG2 ARG 7 2HG ARG 7 2.408 -7.520 -13.294
58 HG3 ARG 7 3HG ARG 7 0.982 -7.879 -12.318
59 HD2 ARG 7 2HD ARG 7 1.118 -5.126 -12.264
60 HD3 ARG 7 3HD ARG 7 1.618 -5.525 -13.907
61 HE ARG 7 HE ARG 7 -0.766 -6.884 -13.033
62 HH11 ARG 7 1HH1 ARG 7 0.536 -4.026 -14.535
63 HH12 ARG 7 2HH1 ARG 7 -0.934 -3.633 -15.363
64 HH21 ARG 7 1HH2 ARG 7 -2.708 -6.377 -14.118
65 HH22 ARG 7 2HH2 ARG 7 -2.779 -4.971 -15.124
66 H VAL 8 H VAL 8 3.890 -4.082 -12.059
67 HA VAL 8 HA VAL 8 3.285 -3.957 -14.721
68 HB VAL 8 HB VAL 8 3.494 -1.997 -13.188
69 HG11 VAL 8 1HG1 VAL 8 6.000 -2.867 -12.698
70 HG12 VAL 8 2HG1 VAL 8 6.327 -1.609 -13.891
71 HG13 VAL 8 3HG1 VAL 8 5.458 -1.214 -12.408
72 HG21 VAL 8 3HG2 VAL 8 5.130 -1.352 -15.589
73 HG22 VAL 8 1HG2 VAL 8 3.514 -2.019 -15.824
74 HG23 VAL 8 2HG2 VAL 8 3.727 -0.519 -14.921
75 H LEU 9 H LEU 9 6.356 -4.747 -13.268
76 HA LEU 9 HA LEU 9 8.102 -4.326 -15.374
77 HB2 LEU 9 2HB LEU 9 8.026 -6.353 -13.171
78 HB3 LEU 9 3HB LEU 9 9.302 -6.394 -14.386
79 HG LEU 9 HG LEU 9 10.103 -5.272 -12.413
80 HD11 LEU 9 1HD1 LEU 9 10.056 -4.139 -14.995
81 HD12 LEU 9 2HD1 LEU 9 11.257 -3.910 -13.724
82 HD13 LEU 9 3HD1 LEU 9 9.880 -2.815 -13.843
83 HD21 LEU 9 3HD2 LEU 9 7.655 -4.535 -11.837
84 HD22 LEU 9 1HD2 LEU 9 8.110 -3.074 -12.715
85 HD23 LEU 9 2HD2 LEU 9 9.033 -3.574 -11.297
86 H SER 10 H SER 10 6.016 -7.115 -14.735
87 HA SER 10 HA SER 10 6.775 -8.246 -17.337
88 HB2 SER 10 2HB SER 10 6.752 -9.568 -15.061
89 HB3 SER 10 3HB SER 10 5.022 -9.689 -15.382
90 HG SER 10 HG SER 10 5.564 -10.621 -17.414
91 H GLY 11 H GLY 11 4.105 -6.912 -15.532
92 HA2 GLY 11 2HA GLY 11 2.003 -7.772 -17.218
93 HA3 GLY 11 3HA GLY 11 1.945 -6.400 -16.122
94 H ILE 12 H ILE 12 4.355 -5.255 -17.544
95 HA ILE 12 HA ILE 12 2.838 -3.802 -19.535
96 HB ILE 12 HB ILE 12 4.471 -2.725 -17.922
97 HG12 ILE 12 2HG1 ILE 12 5.482 -1.848 -20.514
98 HG13 ILE 12 3HG1 ILE 12 3.736 -2.068 -20.515
99 HG21 ILE 12 1HG2 ILE 12 6.561 -3.669 -19.866
100 HG22 ILE 12 2HG2 ILE 12 6.794 -2.815 -18.341
101 HG23 ILE 12 3HG2 ILE 12 6.236 -4.487 -18.338
102 HD11 ILE 12 3HD1 ILE 12 4.389 -0.692 -18.148
103 HD12 ILE 12 1HD1 ILE 12 5.273 0.080 -19.464
104 HD13 ILE 12 2HD1 ILE 12 3.520 -0.092 -19.560
105 H LEU 13 H LEU 13 5.300 -6.259 -19.425
106 HA LEU 13 HA LEU 13 6.444 -6.076 -21.928
107 HB2 LEU 13 2HB LEU 13 5.797 -8.391 -20.150
108 HB3 LEU 13 3HB LEU 13 6.484 -8.671 -21.749
109 HG LEU 13 HG LEU 13 7.815 -6.905 -19.709
110 HD11 LEU 13 1HD1 LEU 13 9.068 -9.468 -20.011
111 HD12 LEU 13 2HD1 LEU 13 7.406 -9.663 -19.455
112 HD13 LEU 13 3HD1 LEU 13 8.527 -8.651 -18.545
113 HD21 LEU 13 3HD2 LEU 13 9.767 -7.230 -21.054
114 HD22 LEU 13 1HD2 LEU 13 8.452 -6.720 -22.112
115 HD23 LEU 13 2HD2 LEU 13 8.937 -8.415 -22.064
Start of MODEL 10
1 H1 PHE 1 H PHE 1 2.248 -0.768 0.983
2 HA PHE 1 HA PHE 1 2.974 0.629 -1.215
3 HB2 PHE 1 2HB PHE 1 4.577 -0.939 -1.462
4 HB3 PHE 1 3HB PHE 1 3.886 -1.653 -0.009
5 HD1 PHE 1 HD2 PHE 1 2.113 -3.447 -0.289
6 HD2 PHE 1 HD1 PHE 1 4.593 -2.105 -3.478
7 HE1 PHE 1 HE2 PHE 1 1.615 -5.507 -1.538
8 HE2 PHE 1 HE1 PHE 1 4.098 -4.163 -4.733
9 HZ PHE 1 HZ PHE 1 2.609 -5.868 -3.763
10 H LEU 2 H LEU 2 3.072 -0.310 -3.549
11 HA LEU 2 HA LEU 2 0.307 -0.938 -4.339
12 HB2 LEU 2 2HB LEU 2 2.384 0.838 -5.430
13 HB3 LEU 2 3HB LEU 2 1.477 -0.085 -6.627
14 HG LEU 2 HG LEU 2 -0.014 1.462 -4.556
15 HD11 LEU 2 1HD1 LEU 2 1.403 3.184 -5.228
16 HD12 LEU 2 2HD1 LEU 2 0.003 3.357 -6.287
17 HD13 LEU 2 3HD1 LEU 2 1.478 2.603 -6.892
18 HD21 LEU 2 3HD2 LEU 2 -1.228 1.770 -6.985
19 HD22 LEU 2 1HD2 LEU 2 -1.622 0.524 -5.800
20 HD23 LEU 2 2HD2 LEU 2 -0.518 0.161 -7.126
21 HA PRO 3 HA PRO 3 2.094 -4.866 -5.538
22 HB2 PRO 3 2HB PRO 3 -0.268 -6.000 -6.246
23 HB3 PRO 3 3HB PRO 3 0.256 -5.841 -4.566
24 HG2 PRO 3 2HG PRO 3 -1.641 -4.132 -6.129
25 HG3 PRO 3 3HG PRO 3 -1.781 -4.724 -4.463
26 HD2 PRO 3 2HD PRO 3 -0.984 -2.204 -5.051
27 HD3 PRO 3 3HD PRO 3 -0.389 -3.087 -3.630
28 H LEU 4 H LEU 4 0.867 -2.408 -7.393
29 HA LEU 4 HA LEU 4 0.805 -3.911 -9.893
30 HB2 LEU 4 2HB LEU 4 0.375 -0.967 -9.413
31 HB3 LEU 4 3HB LEU 4 0.058 -1.842 -10.910
32 HG LEU 4 HG LEU 4 -1.437 -2.111 -8.304
33 HD11 LEU 4 1HD1 LEU 4 -2.153 -0.967 -10.994
34 HD12 LEU 4 2HD1 LEU 4 -2.083 -0.127 -9.446
35 HD13 LEU 4 3HD1 LEU 4 -3.336 -1.333 -9.738
36 HD21 LEU 4 3HD2 LEU 4 -1.891 -3.565 -10.907
37 HD22 LEU 4 1HD2 LEU 4 -2.853 -3.709 -9.436
38 HD23 LEU 4 2HD2 LEU 4 -1.183 -4.277 -9.456
39 H ILE 5 H ILE 5 2.879 -1.823 -8.078
40 HA ILE 5 HA ILE 5 4.549 -0.965 -10.209
41 HB ILE 5 HB ILE 5 5.928 -0.015 -8.617
42 HG12 ILE 5 2HG1 ILE 5 5.066 -2.233 -6.755
43 HG13 ILE 5 3HG1 ILE 5 6.658 -1.996 -7.467
44 HG21 ILE 5 1HG2 ILE 5 4.505 1.222 -7.362
45 HG22 ILE 5 2HG2 ILE 5 3.302 0.400 -8.355
46 HG23 ILE 5 3HG2 ILE 5 3.657 -0.190 -6.732
47 HD11 ILE 5 3HD1 ILE 5 6.456 0.310 -6.163
48 HD12 ILE 5 1HD1 ILE 5 5.396 -0.670 -5.150
49 HD13 ILE 5 2HD1 ILE 5 7.069 -1.162 -5.409
50 H GLY 6 H GLY 6 4.598 -3.736 -8.029
51 HA2 GLY 6 2HA GLY 6 7.156 -4.666 -9.001
52 HA3 GLY 6 3HA GLY 6 6.098 -5.502 -7.873
53 H ARG 7 H ARG 7 3.953 -4.887 -10.088
54 HA ARG 7 HA ARG 7 4.458 -7.392 -11.524
55 HB2 ARG 7 2HB ARG 7 2.352 -7.625 -10.653
56 HB3 ARG 7 3HB ARG 7 2.019 -5.899 -10.711
57 HG2 ARG 7 2HG ARG 7 2.277 -7.318 -13.296
58 HG3 ARG 7 3HG ARG 7 0.838 -7.639 -12.327
59 HD2 ARG 7 2HD ARG 7 1.239 -4.852 -12.284
60 HD3 ARG 7 3HD ARG 7 1.458 -5.366 -13.956
61 HE ARG 7 HE ARG 7 -0.991 -5.214 -12.543
62 HH11 ARG 7 1HH1 ARG 7 0.712 -7.138 -14.892
63 HH12 ARG 7 2HH1 ARG 7 -0.731 -7.722 -15.653
64 HH21 ARG 7 1HH2 ARG 7 -2.898 -5.976 -13.536
65 HH22 ARG 7 2HH2 ARG 7 -2.784 -7.060 -14.881
66 H VAL 8 H VAL 8 3.888 -3.971 -12.010
67 HA VAL 8 HA VAL 8 3.291 -3.791 -14.671
68 HB VAL 8 HB VAL 8 3.564 -1.859 -13.115
69 HG11 VAL 8 1HG1 VAL 8 6.412 -1.567 -13.805
70 HG12 VAL 8 2HG1 VAL 8 5.553 -1.154 -12.320
71 HG13 VAL 8 3HG1 VAL 8 6.035 -2.823 -12.626
72 HG21 VAL 8 3HG2 VAL 8 5.170 -0.801 -15.214
73 HG22 VAL 8 1HG2 VAL 8 4.080 -2.008 -15.893
74 HG23 VAL 8 2HG2 VAL 8 3.430 -0.651 -14.974
75 H LEU 9 H LEU 9 6.332 -4.702 -13.224
76 HA LEU 9 HA LEU 9 8.094 -4.317 -15.323
77 HB2 LEU 9 2HB LEU 9 7.946 -6.366 -13.145
78 HB3 LEU 9 3HB LEU 9 9.222 -6.435 -14.359
79 HG LEU 9 HG LEU 9 10.057 -5.364 -12.372
80 HD11 LEU 9 1HD1 LEU 9 9.922 -2.886 -13.775
81 HD12 LEU 9 2HD1 LEU 9 10.053 -4.202 -14.941
82 HD13 LEU 9 3HD1 LEU 9 11.260 -4.030 -13.667
83 HD21 LEU 9 3HD2 LEU 9 7.636 -4.550 -11.790
84 HD22 LEU 9 1HD2 LEU 9 8.142 -3.096 -12.651
85 HD23 LEU 9 2HD2 LEU 9 9.045 -3.642 -11.238
86 H SER 10 H SER 10 5.911 -7.038 -14.721
87 HA SER 10 HA SER 10 6.637 -8.167 -17.333
88 HB2 SER 10 2HB SER 10 6.603 -9.541 -15.121
89 HB3 SER 10 3HB SER 10 4.853 -9.536 -15.338
90 HG SER 10 HG SER 10 6.486 -11.209 -16.405
91 H GLY 11 H GLY 11 4.010 -6.756 -15.523
92 HA2 GLY 11 2HA GLY 11 1.885 -7.521 -17.226
93 HA3 GLY 11 3HA GLY 11 1.873 -6.160 -16.115
94 H ILE 12 H ILE 12 4.328 -5.086 -17.514
95 HA ILE 12 HA ILE 12 2.871 -3.559 -19.495
96 HB ILE 12 HB ILE 12 4.530 -2.554 -17.863
97 HG12 ILE 12 2HG1 ILE 12 5.471 -1.812 -20.577
98 HG13 ILE 12 3HG1 ILE 12 3.734 -1.729 -20.301
99 HG21 ILE 12 1HG2 ILE 12 6.648 -3.423 -19.790
100 HG22 ILE 12 2HG2 ILE 12 6.820 -2.792 -18.153
101 HG23 ILE 12 3HG2 ILE 12 6.218 -4.430 -18.408
102 HD11 ILE 12 3HD1 ILE 12 5.156 -0.506 -18.127
103 HD12 ILE 12 1HD1 ILE 12 5.650 0.191 -19.670
104 HD13 ILE 12 2HD1 ILE 12 3.947 0.182 -19.210
105 H LEU 13 H LEU 13 5.248 -6.099 -19.400
106 HA LEU 13 HA LEU 13 6.411 -5.928 -21.895
107 HB2 LEU 13 2HB LEU 13 6.346 -7.778 -19.840
108 HB3 LEU 13 3HB LEU 13 5.686 -8.659 -21.216
109 HG LEU 13 HG LEU 13 7.821 -7.751 -22.435
110 HD11 LEU 13 1HD1 LEU 13 9.712 -7.845 -20.661
111 HD12 LEU 13 2HD1 LEU 13 8.438 -7.382 -19.535
112 HD13 LEU 13 3HD1 LEU 13 8.823 -6.341 -20.906
113 HD21 LEU 13 3HD2 LEU 13 7.411 -10.085 -22.167
114 HD22 LEU 13 1HD2 LEU 13 7.775 -10.010 -20.443
115 HD23 LEU 13 2HD2 LEU 13 9.060 -9.769 -21.626
Start of MODEL 11
1 H1 PHE 1 H PHE 1 1.070 -1.008 0.527
2 HA PHE 1 HA PHE 1 2.371 0.862 -1.328
3 HB2 PHE 1 2HB PHE 1 4.113 -0.566 -1.443
4 HB3 PHE 1 3HB PHE 1 3.430 -1.278 0.015
5 HD1 PHE 1 HD1 PHE 1 1.833 -3.232 -0.248
6 HD2 PHE 1 HD2 PHE 1 4.310 -1.809 -3.404
7 HE1 PHE 1 HE1 PHE 1 1.566 -5.378 -1.420
8 HE2 PHE 1 HE2 PHE 1 4.045 -3.953 -4.582
9 HZ PHE 1 HZ PHE 1 2.672 -5.740 -3.591
10 H LEU 2 H LEU 2 2.635 -0.162 -3.611
11 HA LEU 2 HA LEU 2 -0.032 -1.072 -4.460
12 HB2 LEU 2 2HB LEU 2 1.912 0.843 -5.560
13 HB3 LEU 2 3HB LEU 2 1.142 -0.211 -6.745
14 HG LEU 2 HG LEU 2 -1.067 0.576 -5.944
15 HD11 LEU 2 1HD1 LEU 2 0.472 1.604 -3.810
16 HD12 LEU 2 2HD1 LEU 2 -1.273 1.694 -4.044
17 HD13 LEU 2 3HD1 LEU 2 -0.233 2.978 -4.663
18 HD21 LEU 2 3HD2 LEU 2 -1.053 2.377 -7.332
19 HD22 LEU 2 1HD2 LEU 2 0.521 1.701 -7.754
20 HD23 LEU 2 2HD2 LEU 2 0.416 3.053 -6.625
21 HA PRO 3 HA PRO 3 2.142 -4.866 -5.427
22 HB2 PRO 3 2HB PRO 3 -0.080 -6.237 -6.168
23 HB3 PRO 3 3HB PRO 3 0.361 -5.964 -4.478
24 HG2 PRO 3 2HG PRO 3 -1.618 -4.498 -6.180
25 HG3 PRO 3 3HG PRO 3 -1.770 -5.033 -4.496
26 HD2 PRO 3 2HD PRO 3 -1.177 -2.477 -5.165
27 HD3 PRO 3 3HD PRO 3 -0.562 -3.244 -3.687
28 H LEU 4 H LEU 4 0.778 -2.606 -7.429
29 HA LEU 4 HA LEU 4 0.949 -4.208 -9.861
30 HB2 LEU 4 2HB LEU 4 0.230 -1.300 -9.523
31 HB3 LEU 4 3HB LEU 4 0.060 -2.257 -10.994
32 HG LEU 4 HG LEU 4 -1.516 -2.557 -8.440
33 HD11 LEU 4 1HD1 LEU 4 -3.410 -1.942 -9.849
34 HD12 LEU 4 2HD1 LEU 4 -2.328 -1.744 -11.227
35 HD13 LEU 4 3HD1 LEU 4 -2.186 -0.672 -9.834
36 HD21 LEU 4 3HD2 LEU 4 -1.609 -4.197 -10.970
37 HD22 LEU 4 1HD2 LEU 4 -2.758 -4.304 -9.637
38 HD23 LEU 4 2HD2 LEU 4 -1.070 -4.749 -9.384
39 H ILE 5 H ILE 5 2.750 -1.864 -8.067
40 HA ILE 5 HA ILE 5 4.416 -0.938 -10.171
41 HB ILE 5 HB ILE 5 5.643 0.193 -8.572
42 HG12 ILE 5 2HG1 ILE 5 4.911 -2.023 -6.652
43 HG13 ILE 5 3HG1 ILE 5 6.502 -1.669 -7.316
44 HG21 ILE 5 1HG2 ILE 5 4.065 1.341 -7.423
45 HG22 ILE 5 2HG2 ILE 5 2.980 0.372 -8.418
46 HG23 ILE 5 3HG2 ILE 5 3.327 -0.117 -6.760
47 HD11 ILE 5 3HD1 ILE 5 6.852 -0.605 -5.394
48 HD12 ILE 5 1HD1 ILE 5 5.860 0.678 -6.085
49 HD13 ILE 5 2HD1 ILE 5 5.131 -0.523 -5.018
50 H GLY 6 H GLY 6 4.628 -3.614 -7.886
51 HA2 GLY 6 2HA GLY 6 7.298 -4.339 -8.719
52 HA3 GLY 6 3HA GLY 6 6.271 -5.232 -7.608
53 H ARG 7 H ARG 7 4.180 -4.886 -9.929
54 HA ARG 7 HA ARG 7 4.972 -7.378 -11.254
55 HB2 ARG 7 2HB ARG 7 2.858 -7.769 -10.452
56 HB3 ARG 7 3HB ARG 7 2.372 -6.086 -10.607
57 HG2 ARG 7 2HG ARG 7 2.883 -7.581 -13.110
58 HG3 ARG 7 3HG ARG 7 1.438 -8.001 -12.189
59 HD2 ARG 7 2HD ARG 7 1.376 -5.262 -12.173
60 HD3 ARG 7 3HD ARG 7 2.039 -5.616 -13.768
61 HE ARG 7 HE ARG 7 -0.304 -7.150 -13.097
62 HH11 ARG 7 1HH1 ARG 7 0.903 -4.192 -14.479
63 HH12 ARG 7 2HH1 ARG 7 -0.519 -3.901 -15.426
64 HH21 ARG 7 1HH2 ARG 7 -2.181 -6.778 -14.338
65 HH22 ARG 7 2HH2 ARG 7 -2.273 -5.373 -15.344
66 H VAL 8 H VAL 8 4.117 -4.041 -11.884
67 HA VAL 8 HA VAL 8 3.625 -4.000 -14.572
68 HB VAL 8 HB VAL 8 3.654 -2.004 -13.072
69 HG11 VAL 8 1HG1 VAL 8 6.182 -2.720 -12.457
70 HG12 VAL 8 2HG1 VAL 8 6.489 -1.467 -13.660
71 HG13 VAL 8 3HG1 VAL 8 5.535 -1.097 -12.224
72 HG21 VAL 8 3HG2 VAL 8 3.805 -2.078 -15.710
73 HG22 VAL 8 1HG2 VAL 8 3.870 -0.553 -14.826
74 HG23 VAL 8 2HG2 VAL 8 5.359 -1.300 -15.407
75 H LEU 9 H LEU 9 6.666 -4.590 -12.970
76 HA LEU 9 HA LEU 9 8.479 -4.109 -15.006
77 HB2 LEU 9 2HB LEU 9 8.419 -6.098 -12.768
78 HB3 LEU 9 3HB LEU 9 9.750 -6.082 -13.923
79 HG LEU 9 HG LEU 9 10.395 -4.882 -11.942
80 HD11 LEU 9 1HD1 LEU 9 9.790 -2.888 -14.118
81 HD12 LEU 9 2HD1 LEU 9 11.125 -4.039 -14.162
82 HD13 LEU 9 3HD1 LEU 9 11.072 -2.797 -12.910
83 HD21 LEU 9 3HD2 LEU 9 7.883 -4.290 -11.484
84 HD22 LEU 9 1HD2 LEU 9 8.289 -2.814 -12.360
85 HD23 LEU 9 2HD2 LEU 9 9.175 -3.243 -10.897
86 H SER 10 H SER 10 6.525 -6.999 -14.400
87 HA SER 10 HA SER 10 7.462 -8.135 -16.941
88 HB2 SER 10 2HB SER 10 5.990 -9.406 -14.622
89 HB3 SER 10 3HB SER 10 6.398 -10.243 -16.120
90 HG SER 10 HG SER 10 7.902 -10.008 -14.006
91 H GLY 11 H GLY 11 4.644 -6.920 -15.284
92 HA2 GLY 11 2HA GLY 11 2.673 -7.929 -17.048
93 HA3 GLY 11 3HA GLY 11 2.486 -6.548 -15.978
94 H ILE 12 H ILE 12 4.864 -5.249 -17.283
95 HA ILE 12 HA ILE 12 3.369 -3.905 -19.352
96 HB ILE 12 HB ILE 12 4.916 -2.751 -17.707
97 HG12 ILE 12 2HG1 ILE 12 5.667 -2.144 -20.557
98 HG13 ILE 12 3HG1 ILE 12 4.031 -1.866 -19.971
99 HG21 ILE 12 1HG2 ILE 12 7.171 -3.360 -19.545
100 HG22 ILE 12 2HG2 ILE 12 7.189 -2.922 -17.837
101 HG23 ILE 12 3HG2 ILE 12 6.742 -4.558 -18.323
102 HD11 ILE 12 3HD1 ILE 12 5.483 0.138 -19.928
103 HD12 ILE 12 1HD1 ILE 12 4.814 -0.291 -18.354
104 HD13 ILE 12 2HD1 ILE 12 6.495 -0.670 -18.732
105 H LEU 13 H LEU 13 5.926 -6.260 -19.151
106 HA LEU 13 HA LEU 13 7.130 -7.392 -20.719
107 HB2 LEU 13 2HB LEU 13 4.556 -7.755 -21.268
108 HB3 LEU 13 3HB LEU 13 5.017 -6.924 -22.753
109 HG LEU 13 HG LEU 13 6.776 -9.153 -22.016
110 HD11 LEU 13 1HD1 LEU 13 5.120 -10.832 -22.869
111 HD12 LEU 13 2HD1 LEU 13 3.869 -9.610 -22.645
112 HD13 LEU 13 3HD1 LEU 13 4.783 -10.200 -21.257
113 HD21 LEU 13 3HD2 LEU 13 5.934 -9.616 -24.522
114 HD22 LEU 13 1HD2 LEU 13 7.234 -8.492 -24.127
115 HD23 LEU 13 2HD2 LEU 13 5.601 -7.887 -24.410
Start of MODEL 12
1 H1 PHE 1 H PHE 1 2.005 -1.005 0.813
2 HA PHE 1 HA PHE 1 2.943 0.691 -1.278
3 HB2 PHE 1 2HB PHE 1 4.583 -0.841 -1.504
4 HB3 PHE 1 3HB PHE 1 3.920 -1.544 -0.032
5 HD1 PHE 1 HD1 PHE 1 2.189 -3.384 -0.263
6 HD2 PHE 1 HD2 PHE 1 4.611 -2.046 -3.497
7 HE1 PHE 1 HE1 PHE 1 1.732 -5.480 -1.469
8 HE2 PHE 1 HE2 PHE 1 4.157 -4.138 -4.708
9 HZ PHE 1 HZ PHE 1 2.715 -5.859 -3.695
10 H LEU 2 H LEU 2 3.039 -0.291 -3.592
11 HA LEU 2 HA LEU 2 0.283 -1.008 -4.338
12 HB2 LEU 2 2HB LEU 2 2.299 0.802 -5.488
13 HB3 LEU 2 3HB LEU 2 1.401 -0.167 -6.655
14 HG LEU 2 HG LEU 2 -0.167 1.308 -4.612
15 HD11 LEU 2 1HD1 LEU 2 0.114 3.404 -5.481
16 HD12 LEU 2 2HD1 LEU 2 0.676 2.806 -7.041
17 HD13 LEU 2 3HD1 LEU 2 1.754 2.776 -5.645
18 HD21 LEU 2 3HD2 LEU 2 -1.603 0.247 -6.014
19 HD22 LEU 2 1HD2 LEU 2 -0.477 0.276 -7.371
20 HD23 LEU 2 2HD2 LEU 2 -1.382 1.729 -6.946
21 HA PRO 3 HA PRO 3 2.163 -4.908 -5.485
22 HB2 PRO 3 2HB PRO 3 -0.175 -6.116 -6.153
23 HB3 PRO 3 3HB PRO 3 0.358 -5.913 -4.480
24 HG2 PRO 3 2HG PRO 3 -1.595 -4.282 -6.058
25 HG3 PRO 3 3HG PRO 3 -1.707 -4.848 -4.381
26 HD2 PRO 3 2HD PRO 3 -0.981 -2.319 -5.020
27 HD3 PRO 3 3HD PRO 3 -0.352 -3.160 -3.589
28 H LEU 4 H LEU 4 0.860 -2.516 -7.373
29 HA LEU 4 HA LEU 4 0.819 -4.066 -9.845
30 HB2 LEU 4 2HB LEU 4 0.310 -1.126 -9.417
31 HB3 LEU 4 3HB LEU 4 0.004 -2.040 -10.893
32 HG LEU 4 HG LEU 4 -1.459 -2.297 -8.268
33 HD11 LEU 4 1HD1 LEU 4 -3.388 -1.574 -9.653
34 HD12 LEU 4 2HD1 LEU 4 -2.270 -1.268 -10.981
35 HD13 LEU 4 3HD1 LEU 4 -2.135 -0.344 -9.485
36 HD21 LEU 4 3HD2 LEU 4 -2.880 -3.918 -9.446
37 HD22 LEU 4 1HD2 LEU 4 -1.217 -4.485 -9.291
38 HD23 LEU 4 2HD2 LEU 4 -1.792 -3.850 -10.833
39 H ILE 5 H ILE 5 2.846 -1.886 -8.084
40 HA ILE 5 HA ILE 5 4.474 -1.016 -10.242
41 HB ILE 5 HB ILE 5 5.840 -0.006 -8.676
42 HG12 ILE 5 2HG1 ILE 5 5.052 -2.218 -6.773
43 HG13 ILE 5 3HG1 ILE 5 6.632 -1.950 -7.502
44 HG21 ILE 5 1HG2 ILE 5 4.393 1.213 -7.432
45 HG22 ILE 5 2HG2 ILE 5 3.204 0.338 -8.397
46 HG23 ILE 5 3HG2 ILE 5 3.593 -0.212 -6.767
47 HD11 ILE 5 3HD1 ILE 5 6.886 -1.188 -5.331
48 HD12 ILE 5 1HD1 ILE 5 6.596 0.289 -6.250
49 HD13 ILE 5 2HD1 ILE 5 5.293 -0.432 -5.305
50 H GLY 6 H GLY 6 4.613 -3.757 -8.028
51 HA2 GLY 6 2HA GLY 6 7.191 -4.628 -8.998
52 HA3 GLY 6 3HA GLY 6 6.158 -5.482 -7.861
53 H ARG 7 H ARG 7 3.993 -4.946 -10.077
54 HA ARG 7 HA ARG 7 4.563 -7.449 -11.490
55 HB2 ARG 7 2HB ARG 7 2.466 -7.724 -10.602
56 HB3 ARG 7 3HB ARG 7 2.083 -6.011 -10.697
57 HG2 ARG 7 2HG ARG 7 2.385 -7.472 -13.253
58 HG3 ARG 7 3HG ARG 7 0.957 -7.821 -12.277
59 HD2 ARG 7 2HD ARG 7 1.066 -5.089 -12.194
60 HD3 ARG 7 3HD ARG 7 1.647 -5.435 -13.822
61 HE ARG 7 HE ARG 7 -0.755 -6.851 -13.115
62 HH11 ARG 7 1HH1 ARG 7 0.564 -3.906 -14.420
63 HH12 ARG 7 2HH1 ARG 7 -0.875 -3.495 -15.294
64 HH21 ARG 7 1HH2 ARG 7 -2.655 -6.322 -14.261
65 HH22 ARG 7 2HH2 ARG 7 -2.705 -4.870 -15.202
66 H VAL 8 H VAL 8 3.898 -4.050 -12.007
67 HA VAL 8 HA VAL 8 3.291 -3.911 -14.668
68 HB VAL 8 HB VAL 8 3.519 -1.958 -13.128
69 HG11 VAL 8 1HG1 VAL 8 6.355 -1.596 -13.837
70 HG12 VAL 8 2HG1 VAL 8 5.493 -1.192 -12.351
71 HG13 VAL 8 3HG1 VAL 8 6.018 -2.850 -12.645
72 HG21 VAL 8 3HG2 VAL 8 5.021 -1.656 -15.726
73 HG22 VAL 8 1HG2 VAL 8 3.265 -1.718 -15.578
74 HG23 VAL 8 2HG2 VAL 8 4.165 -0.390 -14.845
75 H LEU 9 H LEU 9 6.358 -4.731 -13.221
76 HA LEU 9 HA LEU 9 8.105 -4.318 -15.327
77 HB2 LEU 9 2HB LEU 9 8.013 -6.353 -13.132
78 HB3 LEU 9 3HB LEU 9 9.288 -6.400 -14.349
79 HG LEU 9 HG LEU 9 10.100 -5.292 -12.372
80 HD11 LEU 9 1HD1 LEU 9 9.899 -2.829 -13.795
81 HD12 LEU 9 2HD1 LEU 9 10.061 -4.150 -14.951
82 HD13 LEU 9 3HD1 LEU 9 11.266 -3.938 -13.680
83 HD21 LEU 9 3HD2 LEU 9 7.660 -4.535 -11.791
84 HD22 LEU 9 1HD2 LEU 9 8.127 -3.076 -12.665
85 HD23 LEU 9 2HD2 LEU 9 9.046 -3.587 -11.250
86 H SER 10 H SER 10 5.996 -7.092 -14.697
87 HA SER 10 HA SER 10 6.742 -8.219 -17.304
88 HB2 SER 10 2HB SER 10 6.400 -9.427 -14.824
89 HB3 SER 10 3HB SER 10 4.924 -9.836 -15.698
90 HG SER 10 HG SER 10 6.111 -11.296 -16.622
91 H GLY 11 H GLY 11 4.086 -6.870 -15.491
92 HA2 GLY 11 2HA GLY 11 1.974 -7.706 -17.178
93 HA3 GLY 11 3HA GLY 11 1.929 -6.338 -16.076
94 H ILE 12 H ILE 12 4.348 -5.209 -17.498
95 HA ILE 12 HA ILE 12 2.840 -3.735 -19.481
96 HB ILE 12 HB ILE 12 4.484 -2.677 -17.866
97 HG12 ILE 12 2HG1 ILE 12 5.553 -1.714 -20.361
98 HG13 ILE 12 3HG1 ILE 12 3.840 -2.071 -20.546
99 HG21 ILE 12 1HG2 ILE 12 6.602 -3.525 -19.809
100 HG22 ILE 12 2HG2 ILE 12 6.783 -2.844 -18.193
101 HG23 ILE 12 3HG2 ILE 12 6.220 -4.503 -18.392
102 HD11 ILE 12 3HD1 ILE 12 3.356 -0.641 -18.612
103 HD12 ILE 12 1HD1 ILE 12 5.071 -0.254 -18.489
104 HD13 ILE 12 2HD1 ILE 12 4.157 0.234 -19.917
105 H LEU 13 H LEU 13 5.282 -6.213 -19.383
106 HA LEU 13 HA LEU 13 6.425 -6.031 -21.887
107 HB2 LEU 13 2HB LEU 13 6.455 -7.848 -19.822
108 HB3 LEU 13 3HB LEU 13 5.753 -8.771 -21.148
109 HG LEU 13 HG LEU 13 7.793 -7.982 -22.504
110 HD11 LEU 13 1HD1 LEU 13 8.648 -7.321 -19.700
111 HD12 LEU 13 2HD1 LEU 13 8.691 -6.292 -21.131
112 HD13 LEU 13 3HD1 LEU 13 9.798 -7.657 -20.994
113 HD21 LEU 13 3HD2 LEU 13 9.059 -9.738 -20.686
114 HD22 LEU 13 1HD2 LEU 13 8.296 -10.123 -22.228
115 HD23 LEU 13 2HD2 LEU 13 7.351 -10.175 -20.740
Start of MODEL 13
1 H1 PHE 1 H PHE 1 1.684 -0.885 0.874
2 HA PHE 1 HA PHE 1 2.491 0.847 -1.224
3 HB2 PHE 1 2HB PHE 1 4.242 -0.561 -1.427
4 HB3 PHE 1 3HB PHE 1 3.613 -1.309 0.037
5 HD1 PHE 1 HD1 PHE 1 2.026 -3.272 -0.213
6 HD2 PHE 1 HD2 PHE 1 4.384 -1.761 -3.419
7 HE1 PHE 1 HE1 PHE 1 1.739 -5.396 -1.422
8 HE2 PHE 1 HE2 PHE 1 4.100 -3.882 -4.633
9 HZ PHE 1 HZ PHE 1 2.776 -5.703 -3.635
10 H LEU 2 H LEU 2 2.688 -0.125 -3.536
11 HA LEU 2 HA LEU 2 0.003 -1.044 -4.316
12 HB2 LEU 2 2HB LEU 2 1.894 0.911 -5.441
13 HB3 LEU 2 3HB LEU 2 1.090 -0.124 -6.619
14 HG LEU 2 HG LEU 2 -0.913 0.845 -4.882
15 HD11 LEU 2 1HD1 LEU 2 -0.684 3.175 -4.870
16 HD12 LEU 2 2HD1 LEU 2 0.672 3.136 -5.997
17 HD13 LEU 2 3HD1 LEU 2 0.885 2.568 -4.341
18 HD21 LEU 2 3HD2 LEU 2 -1.004 0.245 -7.326
19 HD22 LEU 2 1HD2 LEU 2 -0.266 1.812 -7.657
20 HD23 LEU 2 2HD2 LEU 2 -1.845 1.729 -6.875
21 HA PRO 3 HA PRO 3 2.178 -4.795 -5.433
22 HB2 PRO 3 2HB PRO 3 -0.055 -6.172 -6.130
23 HB3 PRO 3 3HB PRO 3 0.439 -5.930 -4.450
24 HG2 PRO 3 2HG PRO 3 -1.608 -4.448 -6.055
25 HG3 PRO 3 3HG PRO 3 -1.699 -5.019 -4.379
26 HD2 PRO 3 2HD PRO 3 -1.152 -2.444 -5.012
27 HD3 PRO 3 3HD PRO 3 -0.482 -3.236 -3.572
28 H LEU 4 H LEU 4 0.727 -2.507 -7.342
29 HA LEU 4 HA LEU 4 0.832 -4.056 -9.811
30 HB2 LEU 4 2HB LEU 4 0.096 -1.165 -9.383
31 HB3 LEU 4 3HB LEU 4 -0.107 -2.086 -10.872
32 HG LEU 4 HG LEU 4 -1.605 -2.465 -8.283
33 HD11 LEU 4 1HD1 LEU 4 -3.552 -1.911 -9.724
34 HD12 LEU 4 2HD1 LEU 4 -2.425 -1.513 -11.021
35 HD13 LEU 4 3HD1 LEU 4 -2.411 -0.580 -9.524
36 HD21 LEU 4 3HD2 LEU 4 -1.143 -4.627 -9.309
37 HD22 LEU 4 1HD2 LEU 4 -1.778 -4.043 -10.847
38 HD23 LEU 4 2HD2 LEU 4 -2.850 -4.211 -9.457
39 H ILE 5 H ILE 5 2.671 -1.733 -8.028
40 HA ILE 5 HA ILE 5 4.258 -0.748 -10.166
41 HB ILE 5 HB ILE 5 5.527 0.361 -8.584
42 HG12 ILE 5 2HG1 ILE 5 4.879 -1.901 -6.688
43 HG13 ILE 5 3HG1 ILE 5 6.444 -1.518 -7.398
44 HG21 ILE 5 1HG2 ILE 5 3.978 1.471 -7.360
45 HG22 ILE 5 2HG2 ILE 5 2.869 0.512 -8.340
46 HG23 ILE 5 3HG2 ILE 5 3.276 -0.008 -6.705
47 HD11 ILE 5 3HD1 ILE 5 6.551 -0.775 -5.182
48 HD12 ILE 5 1HD1 ILE 5 6.304 0.680 -6.147
49 HD13 ILE 5 2HD1 ILE 5 4.953 -0.033 -5.265
50 H GLY 6 H GLY 6 4.569 -3.470 -7.947
51 HA2 GLY 6 2HA GLY 6 7.216 -4.150 -8.882
52 HA3 GLY 6 3HA GLY 6 6.234 -5.077 -7.757
53 H ARG 7 H ARG 7 4.065 -4.702 -10.001
54 HA ARG 7 HA ARG 7 4.836 -7.158 -11.404
55 HB2 ARG 7 2HB ARG 7 2.753 -7.586 -10.543
56 HB3 ARG 7 3HB ARG 7 2.247 -5.905 -10.644
57 HG2 ARG 7 2HG ARG 7 2.688 -7.340 -13.195
58 HG3 ARG 7 3HG ARG 7 1.278 -7.794 -12.237
59 HD2 ARG 7 2HD ARG 7 1.208 -5.049 -12.164
60 HD3 ARG 7 3HD ARG 7 1.795 -5.380 -13.794
61 HE ARG 7 HE ARG 7 -0.510 -6.930 -13.030
62 HH11 ARG 7 1HH1 ARG 7 0.625 -3.953 -14.434
63 HH12 ARG 7 2HH1 ARG 7 -0.841 -3.655 -15.308
64 HH21 ARG 7 1HH2 ARG 7 -2.444 -6.548 -14.176
65 HH22 ARG 7 2HH2 ARG 7 -2.586 -5.131 -15.160
66 H VAL 8 H VAL 8 3.930 -3.817 -11.934
67 HA VAL 8 HA VAL 8 3.350 -3.725 -14.604
68 HB VAL 8 HB VAL 8 3.407 -1.760 -13.064
69 HG11 VAL 8 1HG1 VAL 8 6.217 -1.184 -13.733
70 HG12 VAL 8 2HG1 VAL 8 5.307 -0.849 -12.259
71 HG13 VAL 8 3HG1 VAL 8 5.961 -2.462 -12.545
72 HG21 VAL 8 3HG2 VAL 8 4.794 -0.409 -15.049
73 HG22 VAL 8 1HG2 VAL 8 4.188 -1.858 -15.852
74 HG23 VAL 8 2HG2 VAL 8 3.067 -0.770 -15.033
75 H LEU 9 H LEU 9 6.447 -4.315 -13.113
76 HA LEU 9 HA LEU 9 8.187 -3.772 -15.198
77 HB2 LEU 9 2HB LEU 9 9.232 -4.311 -13.218
78 HB3 LEU 9 3HB LEU 9 8.204 -5.714 -12.936
79 HG LEU 9 HG LEU 9 10.086 -5.832 -15.230
80 HD11 LEU 9 1HD1 LEU 9 12.000 -5.899 -14.063
81 HD12 LEU 9 2HD1 LEU 9 11.247 -6.675 -12.670
82 HD13 LEU 9 3HD1 LEU 9 11.110 -4.930 -12.888
83 HD21 LEU 9 3HD2 LEU 9 10.044 -8.074 -13.438
84 HD22 LEU 9 1HD2 LEU 9 9.542 -7.981 -15.126
85 HD23 LEU 9 2HD2 LEU 9 8.397 -7.589 -13.843
86 H SER 10 H SER 10 6.280 -6.691 -14.587
87 HA SER 10 HA SER 10 7.150 -7.771 -17.175
88 HB2 SER 10 2HB SER 10 5.683 -9.776 -16.096
89 HB3 SER 10 3HB SER 10 7.411 -9.572 -15.809
90 HG SER 10 HG SER 10 6.329 -9.806 -13.845
91 H GLY 11 H GLY 11 4.372 -6.615 -15.411
92 HA2 GLY 11 2HA GLY 11 2.357 -7.611 -17.129
93 HA3 GLY 11 3HA GLY 11 2.192 -6.247 -16.033
94 H ILE 12 H ILE 12 4.543 -4.944 -17.418
95 HA ILE 12 HA ILE 12 2.963 -3.590 -19.430
96 HB ILE 12 HB ILE 12 4.498 -2.410 -17.792
97 HG12 ILE 12 2HG1 ILE 12 5.520 -1.009 -19.842
98 HG13 ILE 12 3HG1 ILE 12 4.350 -1.979 -20.729
99 HG21 ILE 12 1HG2 ILE 12 6.687 -3.167 -19.703
100 HG22 ILE 12 2HG2 ILE 12 6.820 -2.370 -18.136
101 HG23 ILE 12 3HG2 ILE 12 6.376 -4.075 -18.223
102 HD11 ILE 12 3HD1 ILE 12 3.944 0.283 -18.947
103 HD12 ILE 12 1HD1 ILE 12 2.906 -0.368 -20.215
104 HD13 ILE 12 2HD1 ILE 12 2.883 -1.083 -18.603
105 H LEU 13 H LEU 13 5.580 -5.880 -19.286
106 HA LEU 13 HA LEU 13 6.746 -5.618 -21.771
107 HB2 LEU 13 2HB LEU 13 7.544 -7.153 -20.053
108 HB3 LEU 13 3HB LEU 13 6.118 -8.164 -20.282
109 HG LEU 13 HG LEU 13 7.545 -7.821 -22.768
110 HD11 LEU 13 1HD1 LEU 13 9.101 -8.925 -20.435
111 HD12 LEU 13 2HD1 LEU 13 9.516 -7.521 -21.418
112 HD13 LEU 13 3HD1 LEU 13 9.539 -9.133 -22.131
113 HD21 LEU 13 3HD2 LEU 13 5.887 -9.568 -22.258
114 HD22 LEU 13 1HD2 LEU 13 6.997 -10.254 -21.071
115 HD23 LEU 13 2HD2 LEU 13 7.432 -10.241 -22.780
Start of MODEL 14
1 H1 PHE 1 H PHE 1 0.702 0.266 0.176
2 HA PHE 1 HA PHE 1 2.709 0.986 -1.287
3 HB2 PHE 1 2HB PHE 1 4.405 -0.485 -1.509
4 HB3 PHE 1 3HB PHE 1 3.762 -1.211 -0.039
5 HD1 PHE 1 HD1 PHE 1 2.101 -3.114 -0.277
6 HD2 PHE 1 HD2 PHE 1 4.489 -1.690 -3.500
7 HE1 PHE 1 HE1 PHE 1 1.728 -5.226 -1.482
8 HE2 PHE 1 HE2 PHE 1 4.118 -3.800 -4.711
9 HZ PHE 1 HZ PHE 1 2.735 -5.571 -3.703
10 H LEU 2 H LEU 2 2.859 0.007 -3.603
11 HA LEU 2 HA LEU 2 0.136 -0.804 -4.370
12 HB2 LEU 2 2HB LEU 2 2.099 1.073 -5.505
13 HB3 LEU 2 3HB LEU 2 1.247 0.072 -6.679
14 HG LEU 2 HG LEU 2 0.216 2.298 -6.324
15 HD11 LEU 2 1HD1 LEU 2 -1.028 -0.239 -6.395
16 HD12 LEU 2 2HD1 LEU 2 -1.649 1.303 -6.982
17 HD13 LEU 2 3HD1 LEU 2 -1.983 0.791 -5.328
18 HD21 LEU 2 3HD2 LEU 2 0.700 2.621 -3.982
19 HD22 LEU 2 1HD2 LEU 2 -0.288 1.225 -3.551
20 HD23 LEU 2 2HD2 LEU 2 -1.046 2.666 -4.231
21 HA PRO 3 HA PRO 3 2.158 -4.639 -5.496
22 HB2 PRO 3 2HB PRO 3 -0.133 -5.930 -6.172
23 HB3 PRO 3 3HB PRO 3 0.384 -5.705 -4.497
24 HG2 PRO 3 2HG PRO 3 -1.617 -4.147 -6.087
25 HG3 PRO 3 3HG PRO 3 -1.717 -4.712 -4.409
26 HD2 PRO 3 2HD PRO 3 -1.077 -2.161 -5.051
27 HD3 PRO 3 3HD PRO 3 -0.425 -2.976 -3.615
28 H LEU 4 H LEU 4 0.779 -2.299 -7.396
29 HA LEU 4 HA LEU 4 0.802 -3.854 -9.864
30 HB2 LEU 4 2HB LEU 4 0.194 -0.932 -9.444
31 HB3 LEU 4 3HB LEU 4 -0.073 -1.857 -10.920
32 HG LEU 4 HG LEU 4 -1.541 -2.159 -8.302
33 HD11 LEU 4 1HD1 LEU 4 -3.487 -1.522 -9.731
34 HD12 LEU 4 2HD1 LEU 4 -2.345 -1.134 -11.017
35 HD13 LEU 4 3HD1 LEU 4 -2.299 -0.239 -9.498
36 HD21 LEU 4 3HD2 LEU 4 -2.871 -3.856 -9.414
37 HD22 LEU 4 1HD2 LEU 4 -1.173 -4.333 -9.386
38 HD23 LEU 4 2HD2 LEU 4 -1.887 -3.703 -10.871
39 H ILE 5 H ILE 5 2.749 -1.606 -8.099
40 HA ILE 5 HA ILE 5 4.358 -0.692 -10.254
41 HB ILE 5 HB ILE 5 5.680 0.373 -8.686
42 HG12 ILE 5 2HG1 ILE 5 4.961 -1.855 -6.777
43 HG13 ILE 5 3HG1 ILE 5 6.533 -1.536 -7.499
44 HG21 ILE 5 1HG2 ILE 5 4.187 1.546 -7.451
45 HG22 ILE 5 2HG2 ILE 5 3.035 0.632 -8.423
46 HG23 ILE 5 3HG2 ILE 5 3.429 0.097 -6.789
47 HD11 ILE 5 3HD1 ILE 5 5.256 -0.346 -5.151
48 HD12 ILE 5 1HD1 ILE 5 6.964 -0.559 -5.536
49 HD13 ILE 5 2HD1 ILE 5 6.069 0.800 -6.216
50 H GLY 6 H GLY 6 4.581 -3.410 -8.018
51 HA2 GLY 6 2HA GLY 6 7.189 -4.202 -8.979
52 HA3 GLY 6 3HA GLY 6 6.187 -5.078 -7.832
53 H ARG 7 H ARG 7 4.004 -4.639 -10.052
54 HA ARG 7 HA ARG 7 4.658 -7.137 -11.440
55 HB2 ARG 7 2HB ARG 7 2.572 -7.482 -10.558
56 HB3 ARG 7 3HB ARG 7 2.135 -5.781 -10.648
57 HG2 ARG 7 2HG ARG 7 2.473 -7.231 -13.207
58 HG3 ARG 7 3HG ARG 7 1.058 -7.619 -12.227
59 HD2 ARG 7 2HD ARG 7 1.287 -4.814 -12.237
60 HD3 ARG 7 3HD ARG 7 1.536 -5.343 -13.900
61 HE ARG 7 HE ARG 7 -0.917 -5.317 -12.486
62 HH11 ARG 7 1HH1 ARG 7 0.900 -7.175 -14.802
63 HH12 ARG 7 2HH1 ARG 7 -0.504 -7.860 -15.550
64 HH21 ARG 7 1HH2 ARG 7 -2.774 -6.213 -13.461
65 HH22 ARG 7 2HH2 ARG 7 -2.594 -7.311 -14.787
66 H VAL 8 H VAL 8 3.879 -3.768 -11.992
67 HA VAL 8 HA VAL 8 3.268 -3.680 -14.655
68 HB VAL 8 HB VAL 8 3.419 -1.704 -13.137
69 HG11 VAL 8 1HG1 VAL 8 5.949 -2.498 -12.638
70 HG12 VAL 8 2HG1 VAL 8 6.241 -1.240 -13.841
71 HG13 VAL 8 3HG1 VAL 8 5.360 -0.859 -12.361
72 HG21 VAL 8 3HG2 VAL 8 3.739 -0.185 -14.868
73 HG22 VAL 8 1HG2 VAL 8 5.018 -1.148 -15.608
74 HG23 VAL 8 2HG2 VAL 8 3.339 -1.676 -15.720
75 H LEU 9 H LEU 9 6.360 -4.373 -13.196
76 HA LEU 9 HA LEU 9 8.091 -3.918 -15.308
77 HB2 LEU 9 2HB LEU 9 9.138 -4.473 -13.332
78 HB3 LEU 9 3HB LEU 9 8.065 -5.838 -13.027
79 HG LEU 9 HG LEU 9 9.916 -6.040 -15.340
80 HD11 LEU 9 1HD1 LEU 9 10.798 -5.576 -12.603
81 HD12 LEU 9 2HD1 LEU 9 11.713 -5.555 -14.110
82 HD13 LEU 9 3HD1 LEU 9 11.405 -7.084 -13.287
83 HD21 LEU 9 3HD2 LEU 9 9.801 -8.256 -13.508
84 HD22 LEU 9 1HD2 LEU 9 9.327 -8.176 -15.205
85 HD23 LEU 9 2HD2 LEU 9 8.177 -7.724 -13.946
86 H SER 10 H SER 10 6.081 -6.754 -14.642
87 HA SER 10 HA SER 10 6.880 -7.898 -17.225
88 HB2 SER 10 2HB SER 10 6.720 -9.121 -14.807
89 HB3 SER 10 3HB SER 10 5.111 -9.461 -15.443
90 HG SER 10 HG SER 10 7.515 -9.958 -16.864
91 H GLY 11 H GLY 11 4.169 -6.609 -15.449
92 HA2 GLY 11 2HA GLY 11 2.098 -7.544 -17.136
93 HA3 GLY 11 3HA GLY 11 1.999 -6.162 -16.054
94 H ILE 12 H ILE 12 4.385 -4.968 -17.475
95 HA ILE 12 HA ILE 12 2.840 -3.577 -19.490
96 HB ILE 12 HB ILE 12 4.431 -2.437 -17.879
97 HG12 ILE 12 2HG1 ILE 12 5.296 -1.729 -20.638
98 HG13 ILE 12 3HG1 ILE 12 3.570 -1.685 -20.296
99 HG21 ILE 12 1HG2 ILE 12 6.572 -3.316 -19.795
100 HG22 ILE 12 2HG2 ILE 12 6.753 -2.486 -18.250
101 HG23 ILE 12 3HG2 ILE 12 6.242 -4.173 -18.290
102 HD11 ILE 12 3HD1 ILE 12 3.829 -0.017 -18.671
103 HD12 ILE 12 1HD1 ILE 12 5.573 -0.260 -18.581
104 HD13 ILE 12 2HD1 ILE 12 4.857 0.474 -20.017
105 H LEU 13 H LEU 13 5.369 -5.964 -19.340
106 HA LEU 13 HA LEU 13 6.522 -5.776 -21.838
107 HB2 LEU 13 2HB LEU 13 6.836 -7.448 -19.804
108 HB3 LEU 13 3HB LEU 13 5.841 -8.484 -20.824
109 HG LEU 13 HG LEU 13 7.613 -7.943 -22.650
110 HD11 LEU 13 1HD1 LEU 13 9.737 -7.301 -21.960
111 HD12 LEU 13 2HD1 LEU 13 9.389 -7.620 -20.261
112 HD13 LEU 13 3HD1 LEU 13 8.672 -6.220 -21.059
113 HD21 LEU 13 3HD2 LEU 13 7.811 -9.831 -20.348
114 HD22 LEU 13 1HD2 LEU 13 9.117 -9.763 -21.531
115 HD23 LEU 13 2HD2 LEU 13 7.478 -10.159 -22.049
Start of MODEL 15
1 H1 PHE 1 H PHE 1 1.157 -0.749 0.297
2 HA PHE 1 HA PHE 1 2.659 1.075 -1.455
3 HB2 PHE 1 2HB PHE 1 4.418 -0.322 -1.654
4 HB3 PHE 1 3HB PHE 1 3.824 -1.040 -0.160
5 HD1 PHE 1 HD2 PHE 1 2.251 -3.023 -0.331
6 HD2 PHE 1 HD1 PHE 1 4.531 -1.569 -3.618
7 HE1 PHE 1 HE2 PHE 1 1.960 -5.178 -1.482
8 HE2 PHE 1 HE1 PHE 1 4.243 -3.721 -4.775
9 HZ PHE 1 HZ PHE 1 2.958 -5.530 -3.706
10 H LEU 2 H LEU 2 2.814 0.045 -3.743
11 HA LEU 2 HA LEU 2 0.123 -0.922 -4.440
12 HB2 LEU 2 2HB LEU 2 1.967 1.022 -5.658
13 HB3 LEU 2 3HB LEU 2 1.141 -0.048 -6.789
14 HG LEU 2 HG LEU 2 -1.018 0.710 -5.626
15 HD11 LEU 2 1HD1 LEU 2 -0.004 1.745 -3.681
16 HD12 LEU 2 2HD1 LEU 2 -0.903 2.941 -4.614
17 HD13 LEU 2 3HD1 LEU 2 0.857 2.887 -4.713
18 HD21 LEU 2 3HD2 LEU 2 0.690 2.233 -7.520
19 HD22 LEU 2 1HD2 LEU 2 -0.772 3.010 -6.911
20 HD23 LEU 2 2HD2 LEU 2 -0.883 1.473 -7.770
21 HA PRO 3 HA PRO 3 2.315 -4.676 -5.515
22 HB2 PRO 3 2HB PRO 3 0.083 -6.092 -6.135
23 HB3 PRO 3 3HB PRO 3 0.607 -5.805 -4.472
24 HG2 PRO 3 2HG PRO 3 -1.486 -4.382 -6.070
25 HG3 PRO 3 3HG PRO 3 -1.539 -4.914 -4.379
26 HD2 PRO 3 2HD PRO 3 -1.032 -2.349 -5.084
27 HD3 PRO 3 3HD PRO 3 -0.325 -3.101 -3.639
28 H LEU 4 H LEU 4 0.807 -2.447 -7.447
29 HA LEU 4 HA LEU 4 0.882 -4.054 -9.882
30 HB2 LEU 4 2HB LEU 4 0.122 -1.160 -9.518
31 HB3 LEU 4 3HB LEU 4 -0.111 -2.131 -10.970
32 HG LEU 4 HG LEU 4 -1.533 -2.448 -8.330
33 HD11 LEU 4 1HD1 LEU 4 -2.365 -0.591 -9.619
34 HD12 LEU 4 2HD1 LEU 4 -3.523 -1.918 -9.694
35 HD13 LEU 4 3HD1 LEU 4 -2.464 -1.594 -11.066
36 HD21 LEU 4 3HD2 LEU 4 -1.125 -4.636 -9.271
37 HD22 LEU 4 1HD2 LEU 4 -1.710 -4.101 -10.846
38 HD23 LEU 4 2HD2 LEU 4 -2.823 -4.209 -9.483
39 H ILE 5 H ILE 5 2.723 -1.665 -8.189
40 HA ILE 5 HA ILE 5 4.256 -0.708 -10.378
41 HB ILE 5 HB ILE 5 5.545 0.446 -8.844
42 HG12 ILE 5 2HG1 ILE 5 4.956 -1.781 -6.889
43 HG13 ILE 5 3HG1 ILE 5 6.503 -1.399 -7.637
44 HG21 ILE 5 1HG2 ILE 5 4.006 1.567 -7.618
45 HG22 ILE 5 2HG2 ILE 5 2.889 0.572 -8.551
46 HG23 ILE 5 3HG2 ILE 5 3.336 0.097 -6.913
47 HD11 ILE 5 3HD1 ILE 5 5.883 0.938 -6.374
48 HD12 ILE 5 1HD1 ILE 5 5.231 -0.273 -5.271
49 HD13 ILE 5 2HD1 ILE 5 6.932 -0.327 -5.734
50 H GLY 6 H GLY 6 4.650 -3.376 -8.106
51 HA2 GLY 6 2HA GLY 6 7.282 -4.046 -9.096
52 HA3 GLY 6 3HA GLY 6 6.346 -4.952 -7.917
53 H ARG 7 H ARG 7 4.120 -4.644 -10.134
54 HA ARG 7 HA ARG 7 4.877 -7.138 -11.480
55 HB2 ARG 7 2HB ARG 7 2.824 -7.576 -10.563
56 HB3 ARG 7 3HB ARG 7 2.300 -5.901 -10.666
57 HG2 ARG 7 2HG ARG 7 2.669 -7.375 -13.209
58 HG3 ARG 7 3HG ARG 7 1.286 -7.806 -12.201
59 HD2 ARG 7 2HD ARG 7 1.037 -5.154 -12.122
60 HD3 ARG 7 3HD ARG 7 1.867 -5.298 -13.671
61 HE ARG 7 HE ARG 7 -0.085 -6.054 -14.564
62 HH11 ARG 7 1HH1 ARG 7 -0.161 -6.607 -11.127
63 HH12 ARG 7 2HH1 ARG 7 -1.787 -7.205 -11.127
64 HH21 ARG 7 1HH2 ARG 7 -2.226 -6.840 -14.577
65 HH22 ARG 7 2HH2 ARG 7 -2.960 -7.338 -13.090
66 H VAL 8 H VAL 8 3.977 -3.814 -12.066
67 HA VAL 8 HA VAL 8 3.289 -3.782 -14.713
68 HB VAL 8 HB VAL 8 3.420 -1.778 -13.239
69 HG11 VAL 8 1HG1 VAL 8 6.220 -1.260 -13.990
70 HG12 VAL 8 2HG1 VAL 8 5.351 -0.874 -12.503
71 HG13 VAL 8 3HG1 VAL 8 5.975 -2.503 -12.764
72 HG21 VAL 8 3HG2 VAL 8 4.338 -0.250 -15.080
73 HG22 VAL 8 1HG2 VAL 8 4.626 -1.735 -15.986
74 HG23 VAL 8 2HG2 VAL 8 2.988 -1.307 -15.491
75 H LEU 9 H LEU 9 6.448 -4.338 -13.328
76 HA LEU 9 HA LEU 9 8.084 -3.889 -15.525
77 HB2 LEU 9 2HB LEU 9 9.707 -5.216 -14.455
78 HB3 LEU 9 3HB LEU 9 8.775 -4.449 -13.171
79 HG LEU 9 HG LEU 9 7.453 -6.737 -13.245
80 HD11 LEU 9 1HD1 LEU 9 10.028 -8.019 -13.694
81 HD12 LEU 9 2HD1 LEU 9 9.364 -7.267 -15.144
82 HD13 LEU 9 3HD1 LEU 9 8.420 -8.469 -14.263
83 HD21 LEU 9 3HD2 LEU 9 8.796 -7.500 -11.415
84 HD22 LEU 9 1HD2 LEU 9 8.720 -5.739 -11.347
85 HD23 LEU 9 2HD2 LEU 9 10.171 -6.536 -11.957
86 H SER 10 H SER 10 6.159 -6.728 -14.688
87 HA SER 10 HA SER 10 6.963 -7.999 -17.211
88 HB2 SER 10 2HB SER 10 7.241 -9.641 -15.618
89 HB3 SER 10 3HB SER 10 5.940 -9.025 -14.601
90 HG SER 10 HG SER 10 5.049 -10.781 -15.476
91 H GLY 11 H GLY 11 4.240 -6.667 -15.483
92 HA2 GLY 11 2HA GLY 11 2.187 -7.720 -17.132
93 HA3 GLY 11 3HA GLY 11 2.051 -6.315 -16.086
94 H ILE 12 H ILE 12 4.409 -5.103 -17.549
95 HA ILE 12 HA ILE 12 2.823 -3.798 -19.589
96 HB ILE 12 HB ILE 12 4.394 -2.580 -18.018
97 HG12 ILE 12 2HG1 ILE 12 4.884 -2.149 -20.971
98 HG13 ILE 12 3HG1 ILE 12 3.440 -1.617 -20.117
99 HG21 ILE 12 1HG2 ILE 12 6.532 -3.520 -19.915
100 HG22 ILE 12 2HG2 ILE 12 6.726 -2.562 -18.448
101 HG23 ILE 12 3HG2 ILE 12 6.248 -4.255 -18.338
102 HD11 ILE 12 3HD1 ILE 12 5.580 -0.609 -18.643
103 HD12 ILE 12 1HD1 ILE 12 6.007 -0.354 -20.335
104 HD13 ILE 12 2HD1 ILE 12 4.489 0.284 -19.703
105 H LEU 13 H LEU 13 5.407 -6.121 -19.392
106 HA LEU 13 HA LEU 13 6.542 -5.971 -21.901
107 HB2 LEU 13 2HB LEU 13 6.560 -7.770 -19.758
108 HB3 LEU 13 3HB LEU 13 6.106 -8.723 -21.169
109 HG LEU 13 HG LEU 13 8.487 -8.854 -20.836
110 HD11 LEU 13 1HD1 LEU 13 9.240 -8.219 -23.006
111 HD12 LEU 13 2HD1 LEU 13 7.969 -7.007 -23.157
112 HD13 LEU 13 3HD1 LEU 13 7.556 -8.722 -23.151
113 HD21 LEU 13 3HD2 LEU 13 8.209 -6.104 -20.132
114 HD22 LEU 13 1HD2 LEU 13 9.374 -6.244 -21.448
115 HD23 LEU 13 2HD2 LEU 13 9.613 -7.157 -19.958
Start of MODEL 16
1 H1 PHE 1 H PHE 1 1.187 -0.686 0.273
2 HA PHE 1 HA PHE 1 2.885 1.021 -1.381
3 HB2 PHE 1 2HB PHE 1 4.593 -0.432 -1.618
4 HB3 PHE 1 3HB PHE 1 3.985 -1.155 -0.132
5 HD1 PHE 1 HD2 PHE 1 2.342 -3.079 -0.326
6 HD2 PHE 1 HD1 PHE 1 4.648 -1.647 -3.605
7 HE1 PHE 1 HE2 PHE 1 1.968 -5.202 -1.512
8 HE2 PHE 1 HE1 PHE 1 4.277 -3.768 -4.796
9 HZ PHE 1 HZ PHE 1 2.936 -5.549 -3.749
10 H LEU 2 H LEU 2 2.988 0.027 -3.688
11 HA LEU 2 HA LEU 2 0.260 -0.833 -4.381
12 HB2 LEU 2 2HB LEU 2 2.161 1.069 -5.577
13 HB3 LEU 2 3HB LEU 2 1.295 0.047 -6.722
14 HG LEU 2 HG LEU 2 0.197 2.211 -6.415
15 HD11 LEU 2 1HD1 LEU 2 -1.484 0.058 -5.157
16 HD12 LEU 2 2HD1 LEU 2 -1.073 0.079 -6.871
17 HD13 LEU 2 3HD1 LEU 2 -2.010 1.401 -6.173
18 HD21 LEU 2 3HD2 LEU 2 -0.266 1.353 -3.563
19 HD22 LEU 2 1HD2 LEU 2 -0.783 2.857 -4.324
20 HD23 LEU 2 2HD2 LEU 2 0.933 2.546 -4.063
21 HA PRO 3 HA PRO 3 2.311 -4.641 -5.538
22 HB2 PRO 3 2HB PRO 3 0.026 -5.967 -6.165
23 HB3 PRO 3 3HB PRO 3 0.572 -5.728 -4.501
24 HG2 PRO 3 2HG PRO 3 -1.481 -4.205 -6.058
25 HG3 PRO 3 3HG PRO 3 -1.541 -4.765 -4.376
26 HD2 PRO 3 2HD PRO 3 -0.949 -2.207 -5.040
27 HD3 PRO 3 3HD PRO 3 -0.259 -3.008 -3.614
28 H LEU 4 H LEU 4 0.868 -2.327 -7.419
29 HA LEU 4 HA LEU 4 0.869 -3.892 -9.882
30 HB2 LEU 4 2HB LEU 4 0.210 -0.983 -9.454
31 HB3 LEU 4 3HB LEU 4 -0.058 -1.910 -10.929
32 HG LEU 4 HG LEU 4 -1.489 -2.230 -8.294
33 HD11 LEU 4 1HD1 LEU 4 -2.340 -1.263 -11.015
34 HD12 LEU 4 2HD1 LEU 4 -2.314 -0.352 -9.506
35 HD13 LEU 4 3HD1 LEU 4 -3.465 -1.671 -9.718
36 HD21 LEU 4 3HD2 LEU 4 -1.075 -4.410 -9.346
37 HD22 LEU 4 1HD2 LEU 4 -1.814 -3.822 -10.835
38 HD23 LEU 4 2HD2 LEU 4 -2.785 -3.977 -9.371
39 H ILE 5 H ILE 5 2.805 -1.600 -8.163
40 HA ILE 5 HA ILE 5 4.355 -0.659 -10.346
41 HB ILE 5 HB ILE 5 5.694 0.423 -8.803
42 HG12 ILE 5 2HG1 ILE 5 5.042 -1.817 -6.882
43 HG13 ILE 5 3HG1 ILE 5 6.596 -1.475 -7.635
44 HG21 ILE 5 1HG2 ILE 5 4.205 1.575 -7.546
45 HG22 ILE 5 2HG2 ILE 5 3.047 0.636 -8.487
46 HG23 ILE 5 3HG2 ILE 5 3.488 0.117 -6.861
47 HD11 ILE 5 3HD1 ILE 5 5.296 -0.221 -5.304
48 HD12 ILE 5 1HD1 ILE 5 6.998 -0.561 -5.614
49 HD13 ILE 5 2HD1 ILE 5 6.227 0.838 -6.363
50 H GLY 6 H GLY 6 4.672 -3.377 -8.122
51 HA2 GLY 6 2HA GLY 6 7.272 -4.122 -9.143
52 HA3 GLY 6 3HA GLY 6 6.312 -5.016 -7.974
53 H ARG 7 H ARG 7 4.083 -4.594 -10.166
54 HA ARG 7 HA ARG 7 4.744 -7.086 -11.562
55 HB2 ARG 7 2HB ARG 7 2.683 -7.472 -10.642
56 HB3 ARG 7 3HB ARG 7 2.218 -5.777 -10.706
57 HG2 ARG 7 2HG ARG 7 2.515 -7.209 -13.282
58 HG3 ARG 7 3HG ARG 7 1.125 -7.611 -12.272
59 HD2 ARG 7 2HD ARG 7 1.324 -4.807 -12.271
60 HD3 ARG 7 3HD ARG 7 1.559 -5.319 -13.942
61 HE ARG 7 HE ARG 7 -0.877 -5.333 -12.497
62 HH11 ARG 7 1HH1 ARG 7 0.931 -7.147 -14.855
63 HH12 ARG 7 2HH1 ARG 7 -0.475 -7.840 -15.592
64 HH21 ARG 7 1HH2 ARG 7 -2.736 -6.239 -13.459
65 HH22 ARG 7 2HH2 ARG 7 -2.560 -7.322 -14.798
66 H VAL 8 H VAL 8 3.952 -3.724 -12.084
67 HA VAL 8 HA VAL 8 3.256 -3.629 -14.730
68 HB VAL 8 HB VAL 8 3.447 -1.657 -13.213
69 HG11 VAL 8 1HG1 VAL 8 5.987 -2.451 -12.779
70 HG12 VAL 8 2HG1 VAL 8 6.250 -1.194 -13.989
71 HG13 VAL 8 3HG1 VAL 8 5.407 -0.811 -12.487
72 HG21 VAL 8 3HG2 VAL 8 3.501 -0.228 -14.971
73 HG22 VAL 8 1HG2 VAL 8 5.010 -0.887 -15.601
74 HG23 VAL 8 2HG2 VAL 8 3.490 -1.733 -15.890
75 H LEU 9 H LEU 9 6.392 -4.312 -13.361
76 HA LEU 9 HA LEU 9 8.035 -3.863 -15.560
77 HB2 LEU 9 2HB LEU 9 9.637 -5.206 -14.500
78 HB3 LEU 9 3HB LEU 9 8.699 -4.479 -13.198
79 HG LEU 9 HG LEU 9 7.374 -6.764 -13.359
80 HD11 LEU 9 1HD1 LEU 9 9.567 -8.377 -13.663
81 HD12 LEU 9 2HD1 LEU 9 9.771 -7.201 -14.961
82 HD13 LEU 9 3HD1 LEU 9 8.287 -8.147 -14.855
83 HD21 LEU 9 3HD2 LEU 9 8.760 -5.739 -11.468
84 HD22 LEU 9 1HD2 LEU 9 10.069 -6.775 -12.038
85 HD23 LEU 9 2HD2 LEU 9 8.558 -7.491 -11.477
86 H SER 10 H SER 10 6.035 -6.654 -14.750
87 HA SER 10 HA SER 10 6.809 -7.929 -17.279
88 HB2 SER 10 2HB SER 10 6.045 -8.926 -14.643
89 HB3 SER 10 3HB SER 10 5.153 -9.709 -15.947
90 HG SER 10 HG SER 10 7.014 -10.856 -15.714
91 H GLY 11 H GLY 11 4.122 -6.527 -15.553
92 HA2 GLY 11 2HA GLY 11 2.045 -7.506 -17.222
93 HA3 GLY 11 3HA GLY 11 1.944 -6.110 -16.159
94 H ILE 12 H ILE 12 4.344 -4.951 -17.599
95 HA ILE 12 HA ILE 12 2.805 -3.576 -19.630
96 HB ILE 12 HB ILE 12 4.404 -2.422 -18.040
97 HG12 ILE 12 2HG1 ILE 12 5.166 -1.853 -20.886
98 HG13 ILE 12 3HG1 ILE 12 3.509 -1.602 -20.350
99 HG21 ILE 12 1HG2 ILE 12 6.518 -3.425 -19.933
100 HG22 ILE 12 2HG2 ILE 12 6.741 -2.461 -18.474
101 HG23 ILE 12 3HG2 ILE 12 6.211 -4.138 -18.349
102 HD11 ILE 12 3HD1 ILE 12 4.565 -0.195 -18.474
103 HD12 ILE 12 1HD1 ILE 12 5.998 -0.188 -19.501
104 HD13 ILE 12 2HD1 ILE 12 4.480 0.480 -20.101
105 H LEU 13 H LEU 13 5.321 -5.976 -19.450
106 HA LEU 13 HA LEU 13 6.470 -5.831 -21.953
107 HB2 LEU 13 2HB LEU 13 6.404 -7.667 -19.831
108 HB3 LEU 13 3HB LEU 13 5.967 -8.577 -21.275
109 HG LEU 13 HG LEU 13 8.090 -7.552 -22.310
110 HD11 LEU 13 1HD1 LEU 13 9.814 -6.884 -20.792
111 HD12 LEU 13 2HD1 LEU 13 8.787 -7.217 -19.398
112 HD13 LEU 13 3HD1 LEU 13 8.392 -5.886 -20.486
113 HD21 LEU 13 3HD2 LEU 13 8.163 -9.614 -20.114
114 HD22 LEU 13 1HD2 LEU 13 9.497 -9.310 -21.226
115 HD23 LEU 13 2HD2 LEU 13 7.950 -9.889 -21.843
Start of MODEL 17
1 H1 PHE 1 H PHE 1 1.544 0.759 0.607
2 HA PHE 1 HA PHE 1 2.722 0.963 -1.331
3 HB2 PHE 1 2HB PHE 1 4.495 -0.412 -1.565
4 HB3 PHE 1 3HB PHE 1 3.928 -1.150 -0.071
5 HD1 PHE 1 HD1 PHE 1 2.375 -3.148 -0.241
6 HD2 PHE 1 HD2 PHE 1 4.599 -1.640 -3.542
7 HE1 PHE 1 HE1 PHE 1 2.095 -5.297 -1.407
8 HE2 PHE 1 HE2 PHE 1 4.322 -3.786 -4.713
9 HZ PHE 1 HZ PHE 1 3.068 -5.617 -3.647
10 H LEU 2 H LEU 2 2.862 -0.045 -3.631
11 HA LEU 2 HA LEU 2 0.174 -1.035 -4.304
12 HB2 LEU 2 2HB LEU 2 1.981 0.942 -5.526
13 HB3 LEU 2 3HB LEU 2 1.156 -0.128 -6.657
14 HG LEU 2 HG LEU 2 -0.678 0.988 -4.711
15 HD11 LEU 2 1HD1 LEU 2 1.011 2.873 -6.333
16 HD12 LEU 2 2HD1 LEU 2 0.699 2.903 -4.598
17 HD13 LEU 2 3HD1 LEU 2 -0.593 3.294 -5.733
18 HD21 LEU 2 3HD2 LEU 2 -0.620 1.410 -7.685
19 HD22 LEU 2 1HD2 LEU 2 -2.014 1.351 -6.606
20 HD23 LEU 2 2HD2 LEU 2 -1.113 -0.123 -6.963
21 HA PRO 3 HA PRO 3 2.394 -4.754 -5.439
22 HB2 PRO 3 2HB PRO 3 0.171 -6.190 -6.044
23 HB3 PRO 3 3HB PRO 3 0.713 -5.911 -4.385
24 HG2 PRO 3 2HG PRO 3 -1.416 -4.498 -5.944
25 HG3 PRO 3 3HG PRO 3 -1.442 -5.046 -4.258
26 HD2 PRO 3 2HD PRO 3 -0.973 -2.470 -4.945
27 HD3 PRO 3 3HD PRO 3 -0.239 -3.225 -3.516
28 H LEU 4 H LEU 4 0.837 -2.526 -7.333
29 HA LEU 4 HA LEU 4 0.899 -4.110 -9.782
30 HB2 LEU 4 2HB LEU 4 0.111 -1.229 -9.380
31 HB3 LEU 4 3HB LEU 4 -0.127 -2.186 -10.841
32 HG LEU 4 HG LEU 4 -1.516 -2.549 -8.189
33 HD11 LEU 4 1HD1 LEU 4 -2.390 -0.690 -9.441
34 HD12 LEU 4 2HD1 LEU 4 -3.528 -2.034 -9.534
35 HD13 LEU 4 3HD1 LEU 4 -2.480 -1.669 -10.905
36 HD21 LEU 4 3HD2 LEU 4 -2.766 -4.338 -9.276
37 HD22 LEU 4 1HD2 LEU 4 -1.044 -4.714 -9.222
38 HD23 LEU 4 2HD2 LEU 4 -1.778 -4.159 -10.727
39 H ILE 5 H ILE 5 2.735 -1.716 -8.092
40 HA ILE 5 HA ILE 5 4.230 -0.723 -10.291
41 HB ILE 5 HB ILE 5 5.524 0.433 -8.763
42 HG12 ILE 5 2HG1 ILE 5 4.987 -1.819 -6.821
43 HG13 ILE 5 3HG1 ILE 5 6.520 -1.411 -7.585
44 HG21 ILE 5 1HG2 ILE 5 3.990 1.524 -7.506
45 HG22 ILE 5 2HG2 ILE 5 2.872 0.526 -8.435
46 HG23 ILE 5 3HG2 ILE 5 3.344 0.040 -6.807
47 HD11 ILE 5 3HD1 ILE 5 6.670 -0.644 -5.374
48 HD12 ILE 5 1HD1 ILE 5 6.385 0.793 -6.356
49 HD13 ILE 5 2HD1 ILE 5 5.063 0.080 -5.431
50 H GLY 6 H GLY 6 4.681 -3.406 -8.047
51 HA2 GLY 6 2HA GLY 6 7.308 -4.038 -9.076
52 HA3 GLY 6 3HA GLY 6 6.397 -4.965 -7.893
53 H ARG 7 H ARG 7 4.141 -4.662 -10.079
54 HA ARG 7 HA ARG 7 4.907 -7.135 -11.456
55 HB2 ARG 7 2HB ARG 7 2.872 -7.605 -10.518
56 HB3 ARG 7 3HB ARG 7 2.327 -5.935 -10.600
57 HG2 ARG 7 2HG ARG 7 2.681 -7.383 -13.160
58 HG3 ARG 7 3HG ARG 7 1.315 -7.838 -12.139
59 HD2 ARG 7 2HD ARG 7 1.327 -5.049 -12.139
60 HD3 ARG 7 3HD ARG 7 1.676 -5.508 -13.806
61 HE ARG 7 HE ARG 7 -0.539 -6.927 -12.641
62 HH11 ARG 7 1HH1 ARG 7 0.459 -4.066 -14.354
63 HH12 ARG 7 2HH1 ARG 7 -1.107 -3.768 -15.034
64 HH21 ARG 7 1HH2 ARG 7 -2.605 -6.546 -13.529
65 HH22 ARG 7 2HH2 ARG 7 -2.849 -5.179 -14.562
66 H VAL 8 H VAL 8 3.964 -3.817 -12.002
67 HA VAL 8 HA VAL 8 3.243 -3.771 -14.640
68 HB VAL 8 HB VAL 8 3.369 -1.778 -13.150
69 HG11 VAL 8 1HG1 VAL 8 5.938 -2.479 -12.714
70 HG12 VAL 8 2HG1 VAL 8 6.153 -1.218 -13.930
71 HG13 VAL 8 3HG1 VAL 8 5.298 -0.861 -12.429
72 HG21 VAL 8 3HG2 VAL 8 3.453 -0.319 -14.909
73 HG22 VAL 8 1HG2 VAL 8 4.903 -1.053 -15.592
74 HG23 VAL 8 2HG2 VAL 8 3.338 -1.841 -15.792
75 H LEU 9 H LEU 9 6.425 -4.302 -13.300
76 HA LEU 9 HA LEU 9 8.027 -3.816 -15.512
77 HB2 LEU 9 2HB LEU 9 9.679 -5.134 -14.475
78 HB3 LEU 9 3HB LEU 9 8.754 -4.389 -13.172
79 HG LEU 9 HG LEU 9 7.457 -6.691 -13.250
80 HD11 LEU 9 1HD1 LEU 9 10.056 -7.919 -13.757
81 HD12 LEU 9 2HD1 LEU 9 9.322 -7.191 -15.186
82 HD13 LEU 9 3HD1 LEU 9 8.443 -8.415 -14.270
83 HD21 LEU 9 3HD2 LEU 9 10.189 -6.533 -11.996
84 HD22 LEU 9 1HD2 LEU 9 8.780 -7.425 -11.421
85 HD23 LEU 9 2HD2 LEU 9 8.785 -5.662 -11.378
86 H SER 10 H SER 10 6.146 -6.683 -14.677
87 HA SER 10 HA SER 10 6.932 -7.924 -17.220
88 HB2 SER 10 2HB SER 10 6.359 -8.953 -14.579
89 HB3 SER 10 3HB SER 10 5.323 -9.723 -15.781
90 HG SER 10 HG SER 10 7.265 -10.852 -15.614
91 H GLY 11 H GLY 11 4.217 -6.636 -15.447
92 HA2 GLY 11 2HA GLY 11 2.154 -7.699 -17.080
93 HA3 GLY 11 3HA GLY 11 2.016 -6.304 -16.020
94 H ILE 12 H ILE 12 4.341 -5.053 -17.501
95 HA ILE 12 HA ILE 12 2.715 -3.749 -19.510
96 HB ILE 12 HB ILE 12 4.292 -2.527 -17.949
97 HG12 ILE 12 2HG1 ILE 12 4.763 -2.056 -20.898
98 HG13 ILE 12 3HG1 ILE 12 3.300 -1.574 -20.046
99 HG21 ILE 12 1HG2 ILE 12 6.459 -3.270 -19.876
100 HG22 ILE 12 2HG2 ILE 12 6.591 -2.558 -18.269
101 HG23 ILE 12 3HG2 ILE 12 6.145 -4.255 -18.446
102 HD11 ILE 12 3HD1 ILE 12 5.937 -0.328 -20.113
103 HD12 ILE 12 1HD1 ILE 12 4.353 0.372 -19.781
104 HD13 ILE 12 2HD1 ILE 12 5.239 -0.455 -18.499
105 H LEU 13 H LEU 13 5.328 -6.045 -19.365
106 HA LEU 13 HA LEU 13 6.430 -5.861 -21.887
107 HB2 LEU 13 2HB LEU 13 6.394 -7.746 -19.766
108 HB3 LEU 13 3HB LEU 13 6.108 -8.619 -21.270
109 HG LEU 13 HG LEU 13 8.451 -6.776 -20.818
110 HD11 LEU 13 1HD1 LEU 13 9.777 -8.596 -20.239
111 HD12 LEU 13 2HD1 LEU 13 8.591 -9.769 -20.811
112 HD13 LEU 13 3HD1 LEU 13 8.292 -8.865 -19.326
113 HD21 LEU 13 3HD2 LEU 13 7.510 -7.432 -23.172
114 HD22 LEU 13 1HD2 LEU 13 8.319 -8.964 -22.840
115 HD23 LEU 13 2HD2 LEU 13 9.246 -7.463 -22.861
Start of MODEL 18
1 H1 PHE 1 H PHE 1 2.156 -0.009 0.887
2 HA PHE 1 HA PHE 1 2.624 1.073 -1.428
3 HB2 PHE 1 2HB PHE 1 4.401 -0.303 -1.621
4 HB3 PHE 1 3HB PHE 1 3.817 -1.019 -0.122
5 HD1 PHE 1 HD1 PHE 1 2.268 -3.022 -0.280
6 HD2 PHE 1 HD2 PHE 1 4.531 -1.561 -3.577
7 HE1 PHE 1 HE1 PHE 1 2.004 -5.188 -1.417
8 HE2 PHE 1 HE2 PHE 1 4.269 -3.725 -4.719
9 HZ PHE 1 HZ PHE 1 3.004 -5.541 -3.640
10 H LEU 2 H LEU 2 2.794 0.031 -3.711
11 HA LEU 2 HA LEU 2 0.114 -0.972 -4.402
12 HB2 LEU 2 2HB LEU 2 1.937 0.986 -5.633
13 HB3 LEU 2 3HB LEU 2 1.122 -0.100 -6.757
14 HG LEU 2 HG LEU 2 -1.053 0.635 -5.749
15 HD11 LEU 2 1HD1 LEU 2 -0.448 3.112 -4.723
16 HD12 LEU 2 2HD1 LEU 2 0.792 2.074 -4.019
17 HD13 LEU 2 3HD1 LEU 2 -0.914 1.689 -3.790
18 HD21 LEU 2 3HD2 LEU 2 -0.686 1.617 -7.790
19 HD22 LEU 2 1HD2 LEU 2 0.793 2.419 -7.262
20 HD23 LEU 2 2HD2 LEU 2 -0.777 3.042 -6.754
21 HA PRO 3 HA PRO 3 2.352 -4.706 -5.453
22 HB2 PRO 3 2HB PRO 3 0.137 -6.153 -6.063
23 HB3 PRO 3 3HB PRO 3 0.659 -5.849 -4.402
24 HG2 PRO 3 2HG PRO 3 -1.453 -4.462 -6.008
25 HG3 PRO 3 3HG PRO 3 -1.498 -4.984 -4.314
26 HD2 PRO 3 2HD PRO 3 -1.023 -2.418 -5.035
27 HD3 PRO 3 3HD PRO 3 -0.306 -3.151 -3.586
28 H LEU 4 H LEU 4 0.815 -2.508 -7.399
29 HA LEU 4 HA LEU 4 0.908 -4.129 -9.823
30 HB2 LEU 4 2HB LEU 4 0.115 -1.243 -9.478
31 HB3 LEU 4 3HB LEU 4 -0.108 -2.225 -10.924
32 HG LEU 4 HG LEU 4 -1.527 -2.531 -8.281
33 HD11 LEU 4 1HD1 LEU 4 -2.415 -0.718 -9.563
34 HD12 LEU 4 2HD1 LEU 4 -3.524 -2.082 -9.698
35 HD13 LEU 4 3HD1 LEU 4 -2.434 -1.697 -11.030
36 HD21 LEU 4 3HD2 LEU 4 -2.755 -4.355 -9.329
37 HD22 LEU 4 1HD2 LEU 4 -1.031 -4.721 -9.255
38 HD23 LEU 4 2HD2 LEU 4 -1.759 -4.209 -10.778
39 H ILE 5 H ILE 5 2.722 -1.709 -8.148
40 HA ILE 5 HA ILE 5 4.243 -0.748 -10.343
41 HB ILE 5 HB ILE 5 5.518 0.432 -8.819
42 HG12 ILE 5 2HG1 ILE 5 4.959 -1.790 -6.849
43 HG13 ILE 5 3HG1 ILE 5 6.500 -1.393 -7.600
44 HG21 ILE 5 1HG2 ILE 5 3.967 1.541 -7.598
45 HG22 ILE 5 2HG2 ILE 5 2.862 0.528 -8.524
46 HG23 ILE 5 3HG2 ILE 5 3.314 0.067 -6.883
47 HD11 ILE 5 3HD1 ILE 5 6.586 -0.609 -5.376
48 HD12 ILE 5 1HD1 ILE 5 6.391 0.810 -6.404
49 HD13 ILE 5 2HD1 ILE 5 5.010 0.169 -5.514
50 H GLY 6 H GLY 6 4.669 -3.396 -8.053
51 HA2 GLY 6 2HA GLY 6 7.308 -4.042 -9.040
52 HA3 GLY 6 3HA GLY 6 6.383 -4.951 -7.854
53 H ARG 7 H ARG 7 4.153 -4.684 -10.072
54 HA ARG 7 HA ARG 7 4.939 -7.178 -11.400
55 HB2 ARG 7 2HB ARG 7 2.892 -7.635 -10.479
56 HB3 ARG 7 3HB ARG 7 2.348 -5.967 -10.594
57 HG2 ARG 7 2HG ARG 7 2.733 -7.454 -13.127
58 HG3 ARG 7 3HG ARG 7 1.356 -7.895 -12.115
59 HD2 ARG 7 2HD ARG 7 1.382 -5.100 -12.168
60 HD3 ARG 7 3HD ARG 7 1.722 -5.603 -13.824
61 HE ARG 7 HE ARG 7 -0.500 -6.972 -12.604
62 HH11 ARG 7 1HH1 ARG 7 0.519 -4.190 -14.432
63 HH12 ARG 7 2HH1 ARG 7 -1.045 -3.908 -15.122
64 HH21 ARG 7 1HH2 ARG 7 -2.564 -6.611 -13.506
65 HH22 ARG 7 2HH2 ARG 7 -2.798 -5.285 -14.593
66 H VAL 8 H VAL 8 3.999 -3.870 -12.009
67 HA VAL 8 HA VAL 8 3.310 -3.865 -14.656
68 HB VAL 8 HB VAL 8 3.417 -1.849 -13.197
69 HG11 VAL 8 1HG1 VAL 8 5.336 -0.918 -12.468
70 HG12 VAL 8 2HG1 VAL 8 5.982 -2.541 -12.718
71 HG13 VAL 8 3HG1 VAL 8 6.210 -1.301 -13.951
72 HG21 VAL 8 3HG2 VAL 8 3.326 -0.544 -15.018
73 HG22 VAL 8 1HG2 VAL 8 4.968 -0.958 -15.511
74 HG23 VAL 8 2HG2 VAL 8 3.629 -2.032 -15.915
75 H LEU 9 H LEU 9 6.476 -4.372 -13.270
76 HA LEU 9 HA LEU 9 8.105 -3.920 -15.471
77 HB2 LEU 9 2HB LEU 9 9.744 -5.221 -14.393
78 HB3 LEU 9 3HB LEU 9 8.804 -4.457 -13.113
79 HG LEU 9 HG LEU 9 7.508 -6.760 -13.172
80 HD11 LEU 9 1HD1 LEU 9 8.494 -8.486 -14.181
81 HD12 LEU 9 2HD1 LEU 9 10.096 -8.018 -13.611
82 HD13 LEU 9 3HD1 LEU 9 9.428 -7.280 -15.066
83 HD21 LEU 9 3HD2 LEU 9 8.867 -7.498 -11.340
84 HD22 LEU 9 1HD2 LEU 9 8.759 -5.739 -11.278
85 HD23 LEU 9 2HD2 LEU 9 10.223 -6.512 -11.886
86 H SER 10 H SER 10 6.214 -6.775 -14.614
87 HA SER 10 HA SER 10 7.030 -8.054 -17.128
88 HB2 SER 10 2HB SER 10 6.467 -9.045 -14.483
89 HB3 SER 10 3HB SER 10 5.389 -9.812 -15.650
90 HG SER 10 HG SER 10 7.187 -10.476 -16.822
91 H GLY 11 H GLY 11 4.292 -6.746 -15.405
92 HA2 GLY 11 2HA GLY 11 2.250 -7.833 -17.047
93 HA3 GLY 11 3HA GLY 11 2.099 -6.422 -16.010
94 H ILE 12 H ILE 12 4.441 -5.192 -17.482
95 HA ILE 12 HA ILE 12 2.838 -3.920 -19.530
96 HB ILE 12 HB ILE 12 4.397 -2.673 -17.968
97 HG12 ILE 12 2HG1 ILE 12 5.402 -1.370 -20.085
98 HG13 ILE 12 3HG1 ILE 12 4.226 -2.378 -20.922
99 HG21 ILE 12 1HG2 ILE 12 6.546 -3.588 -19.863
100 HG22 ILE 12 2HG2 ILE 12 6.725 -2.635 -18.391
101 HG23 ILE 12 3HG2 ILE 12 6.269 -4.335 -18.290
102 HD11 ILE 12 3HD1 ILE 12 2.635 -1.468 -19.024
103 HD12 ILE 12 1HD1 ILE 12 3.807 -0.151 -19.015
104 HD13 ILE 12 2HD1 ILE 12 2.945 -0.554 -20.500
105 H LEU 13 H LEU 13 5.450 -6.212 -19.319
106 HA LEU 13 HA LEU 13 6.582 -6.065 -21.830
107 HB2 LEU 13 2HB LEU 13 6.658 -7.826 -19.675
108 HB3 LEU 13 3HB LEU 13 6.154 -8.815 -21.044
109 HG LEU 13 HG LEU 13 8.570 -8.899 -20.714
110 HD11 LEU 13 1HD1 LEU 13 9.151 -8.715 -22.945
111 HD12 LEU 13 2HD1 LEU 13 8.143 -7.291 -23.199
112 HD13 LEU 13 3HD1 LEU 13 7.397 -8.879 -23.020
113 HD21 LEU 13 3HD2 LEU 13 9.953 -7.077 -20.627
114 HD22 LEU 13 1HD2 LEU 13 8.511 -6.408 -19.862
115 HD23 LEU 13 2HD2 LEU 13 8.854 -6.057 -21.557
Start of MODEL 19
1 H1 PHE 1 H PHE 1 0.790 0.439 0.180
2 HA PHE 1 HA PHE 1 2.654 1.012 -1.370
3 HB2 PHE 1 2HB PHE 1 4.419 -0.378 -1.577
4 HB3 PHE 1 3HB PHE 1 3.819 -1.116 -0.095
5 HD1 PHE 1 HD1 PHE 1 2.252 -3.100 -0.301
6 HD2 PHE 1 HD2 PHE 1 4.547 -1.600 -3.556
7 HE1 PHE 1 HE1 PHE 1 1.974 -5.242 -1.480
8 HE2 PHE 1 HE2 PHE 1 4.272 -3.739 -4.740
9 HZ PHE 1 HZ PHE 1 2.983 -5.563 -3.703
10 H LEU 2 H LEU 2 2.826 0.011 -3.670
11 HA LEU 2 HA LEU 2 0.141 -0.954 -4.394
12 HB2 LEU 2 2HB LEU 2 1.988 1.010 -5.579
13 HB3 LEU 2 3HB LEU 2 1.169 -0.048 -6.727
14 HG LEU 2 HG LEU 2 -0.023 2.056 -6.466
15 HD11 LEU 2 1HD1 LEU 2 -1.127 -0.545 -6.068
16 HD12 LEU 2 2HD1 LEU 2 -1.829 0.847 -6.891
17 HD13 LEU 2 3HD1 LEU 2 -2.072 0.633 -5.157
18 HD21 LEU 2 3HD2 LEU 2 -1.166 2.499 -4.272
19 HD22 LEU 2 1HD2 LEU 2 0.582 2.737 -4.273
20 HD23 LEU 2 2HD2 LEU 2 -0.109 1.280 -3.558
21 HA PRO 3 HA PRO 3 2.349 -4.688 -5.504
22 HB2 PRO 3 2HB PRO 3 0.124 -6.102 -6.153
23 HB3 PRO 3 3HB PRO 3 0.639 -5.834 -4.484
24 HG2 PRO 3 2HG PRO 3 -1.450 -4.397 -6.075
25 HG3 PRO 3 3HG PRO 3 -1.510 -4.951 -4.392
26 HD2 PRO 3 2HD PRO 3 -1.006 -2.376 -5.061
27 HD3 PRO 3 3HD PRO 3 -0.305 -3.143 -3.622
28 H LEU 4 H LEU 4 0.846 -2.439 -7.416
29 HA LEU 4 HA LEU 4 0.938 -4.015 -9.870
30 HB2 LEU 4 2HB LEU 4 0.169 -1.128 -9.476
31 HB3 LEU 4 3HB LEU 4 -0.055 -2.083 -10.940
32 HG LEU 4 HG LEU 4 -1.489 -2.432 -8.309
33 HD11 LEU 4 1HD1 LEU 4 -2.374 -1.510 -11.036
34 HD12 LEU 4 2HD1 LEU 4 -2.353 -0.575 -9.541
35 HD13 LEU 4 3HD1 LEU 4 -3.476 -1.922 -9.722
36 HD21 LEU 4 3HD2 LEU 4 -2.736 -4.212 -9.410
37 HD22 LEU 4 1HD2 LEU 4 -1.017 -4.601 -9.341
38 HD23 LEU 4 2HD2 LEU 4 -1.734 -4.039 -10.851
39 H ILE 5 H ILE 5 2.763 -1.643 -8.138
40 HA ILE 5 HA ILE 5 4.305 -0.655 -10.306
41 HB ILE 5 HB ILE 5 5.582 0.484 -8.752
42 HG12 ILE 5 2HG1 ILE 5 4.991 -1.770 -6.828
43 HG13 ILE 5 3HG1 ILE 5 6.540 -1.374 -7.563
44 HG21 ILE 5 1HG2 ILE 5 4.035 1.584 -7.519
45 HG22 ILE 5 2HG2 ILE 5 2.925 0.598 -8.470
46 HG23 ILE 5 3HG2 ILE 5 3.365 0.103 -6.836
47 HD11 ILE 5 3HD1 ILE 5 6.651 -0.619 -5.343
48 HD12 ILE 5 1HD1 ILE 5 6.411 0.823 -6.328
49 HD13 ILE 5 2HD1 ILE 5 5.057 0.130 -5.435
50 H GLY 6 H GLY 6 4.695 -3.349 -8.065
51 HA2 GLY 6 2HA GLY 6 7.334 -4.001 -9.050
52 HA3 GLY 6 3HA GLY 6 6.394 -4.924 -7.887
53 H ARG 7 H ARG 7 4.179 -4.594 -10.112
54 HA ARG 7 HA ARG 7 4.950 -7.068 -11.485
55 HB2 ARG 7 2HB ARG 7 2.894 -7.524 -10.584
56 HB3 ARG 7 3HB ARG 7 2.365 -5.849 -10.670
57 HG2 ARG 7 2HG ARG 7 2.752 -7.291 -13.228
58 HG3 ARG 7 3HG ARG 7 1.365 -7.738 -12.233
59 HD2 ARG 7 2HD ARG 7 1.415 -4.944 -12.232
60 HD3 ARG 7 3HD ARG 7 1.763 -5.417 -13.895
61 HE ARG 7 HE ARG 7 -0.478 -6.793 -12.722
62 HH11 ARG 7 1HH1 ARG 7 0.574 -3.975 -14.475
63 HH12 ARG 7 2HH1 ARG 7 -0.984 -3.664 -15.167
64 HH21 ARG 7 1HH2 ARG 7 -2.533 -6.394 -13.628
65 HH22 ARG 7 2HH2 ARG 7 -2.751 -5.039 -14.684
66 H VAL 8 H VAL 8 4.045 -3.740 -12.034
67 HA VAL 8 HA VAL 8 3.371 -3.677 -14.684
68 HB VAL 8 HB VAL 8 3.489 -1.691 -13.184
69 HG11 VAL 8 1HG1 VAL 8 6.044 -2.416 -12.706
70 HG12 VAL 8 2HG1 VAL 8 6.291 -1.154 -13.915
71 HG13 VAL 8 3HG1 VAL 8 5.413 -0.793 -12.428
72 HG21 VAL 8 3HG2 VAL 8 5.054 -0.751 -15.464
73 HG22 VAL 8 1HG2 VAL 8 3.729 -1.828 -15.909
74 HG23 VAL 8 2HG2 VAL 8 3.402 -0.362 -14.984
75 H LEU 9 H LEU 9 6.523 -4.243 -13.290
76 HA LEU 9 HA LEU 9 8.169 -3.763 -15.472
77 HB2 LEU 9 2HB LEU 9 9.790 -5.099 -14.410
78 HB3 LEU 9 3HB LEU 9 8.850 -4.350 -13.122
79 HG LEU 9 HG LEU 9 7.534 -6.640 -13.231
80 HD11 LEU 9 1HD1 LEU 9 10.047 -7.990 -13.629
81 HD12 LEU 9 2HD1 LEU 9 9.561 -7.118 -15.082
82 HD13 LEU 9 3HD1 LEU 9 8.473 -8.303 -14.361
83 HD21 LEU 9 3HD2 LEU 9 8.802 -7.382 -11.375
84 HD22 LEU 9 1HD2 LEU 9 8.855 -5.620 -11.339
85 HD23 LEU 9 2HD2 LEU 9 10.245 -6.532 -11.929
86 H SER 10 H SER 10 6.248 -6.616 -14.681
87 HA SER 10 HA SER 10 7.068 -7.855 -17.214
88 HB2 SER 10 2HB SER 10 6.547 -8.896 -14.602
89 HB3 SER 10 3HB SER 10 5.378 -9.592 -15.724
90 HG SER 10 HG SER 10 8.069 -9.480 -16.486
91 H GLY 11 H GLY 11 4.333 -6.550 -15.485
92 HA2 GLY 11 2HA GLY 11 2.291 -7.588 -17.158
93 HA3 GLY 11 3HA GLY 11 2.145 -6.196 -16.095
94 H ILE 12 H ILE 12 4.508 -4.960 -17.530
95 HA ILE 12 HA ILE 12 2.929 -3.633 -19.562
96 HB ILE 12 HB ILE 12 4.491 -2.432 -17.967
97 HG12 ILE 12 2HG1 ILE 12 5.265 -1.807 -20.792
98 HG13 ILE 12 3HG1 ILE 12 3.578 -1.665 -20.310
99 HG21 ILE 12 1HG2 ILE 12 6.676 -3.210 -19.864
100 HG22 ILE 12 2HG2 ILE 12 6.799 -2.470 -18.268
101 HG23 ILE 12 3HG2 ILE 12 6.337 -4.165 -18.420
102 HD11 ILE 12 3HD1 ILE 12 3.944 0.236 -19.213
103 HD12 ILE 12 1HD1 ILE 12 5.420 -0.371 -18.463
104 HD13 ILE 12 2HD1 ILE 12 5.469 0.291 -20.097
105 H LEU 13 H LEU 13 5.518 -5.954 -19.381
106 HA LEU 13 HA LEU 13 6.666 -5.770 -21.882
107 HB2 LEU 13 2HB LEU 13 7.513 -7.266 -20.196
108 HB3 LEU 13 3HB LEU 13 6.036 -8.226 -20.254
109 HG LEU 13 HG LEU 13 7.087 -8.232 -22.865
110 HD11 LEU 13 1HD1 LEU 13 9.176 -8.306 -20.755
111 HD12 LEU 13 2HD1 LEU 13 9.257 -7.705 -22.411
112 HD13 LEU 13 3HD1 LEU 13 9.308 -9.440 -22.100
113 HD21 LEU 13 3HD2 LEU 13 7.567 -10.670 -22.175
114 HD22 LEU 13 1HD2 LEU 13 5.901 -10.092 -22.133
115 HD23 LEU 13 2HD2 LEU 13 6.828 -10.220 -20.637
Start of MODEL 20
1 H1 PHE 1 H PHE 1 2.077 0.086 0.761
2 HA PHE 1 HA PHE 1 2.644 1.496 -1.564
3 HB2 PHE 1 2HB PHE 1 4.443 0.141 -1.689
4 HB3 PHE 1 3HB PHE 1 3.879 -0.499 -0.149
5 HD1 PHE 1 HD2 PHE 1 2.365 -2.534 -0.185
6 HD2 PHE 1 HD1 PHE 1 4.581 -1.221 -3.574
7 HE1 PHE 1 HE2 PHE 1 2.132 -4.764 -1.198
8 HE2 PHE 1 HE1 PHE 1 4.351 -3.449 -4.592
9 HZ PHE 1 HZ PHE 1 3.126 -5.224 -3.404
10 H LEU 2 H LEU 2 2.816 0.330 -3.785
11 HA LEU 2 HA LEU 2 0.151 -0.758 -4.399
12 HB2 LEU 2 2HB LEU 2 1.929 1.159 -5.753
13 HB3 LEU 2 3HB LEU 2 1.123 -0.001 -6.806
14 HG LEU 2 HG LEU 2 -0.377 1.730 -4.854
15 HD11 LEU 2 1HD1 LEU 2 -0.777 2.684 -7.454
16 HD12 LEU 2 2HD1 LEU 2 0.968 2.522 -7.264
17 HD13 LEU 2 3HD1 LEU 2 0.045 3.498 -6.122
18 HD21 LEU 2 3HD2 LEU 2 -2.051 1.236 -6.888
19 HD22 LEU 2 1HD2 LEU 2 -1.909 0.187 -5.477
20 HD23 LEU 2 2HD2 LEU 2 -1.058 -0.220 -6.968
21 HA PRO 3 HA PRO 3 2.448 -4.504 -5.257
22 HB2 PRO 3 2HB PRO 3 0.256 -6.021 -5.772
23 HB3 PRO 3 3HB PRO 3 0.782 -5.616 -4.133
24 HG2 PRO 3 2HG PRO 3 -1.363 -4.358 -5.800
25 HG3 PRO 3 3HG PRO 3 -1.390 -4.786 -4.080
26 HD2 PRO 3 2HD PRO 3 -0.965 -2.256 -4.945
27 HD3 PRO 3 3HD PRO 3 -0.227 -2.895 -3.461
28 H LEU 4 H LEU 4 0.862 -2.445 -7.312
29 HA LEU 4 HA LEU 4 0.971 -4.196 -9.643
30 HB2 LEU 4 2HB LEU 4 0.127 -1.309 -9.453
31 HB3 LEU 4 3HB LEU 4 -0.086 -2.376 -10.841
32 HG LEU 4 HG LEU 4 -1.483 -2.565 -8.174
33 HD11 LEU 4 1HD1 LEU 4 -3.495 -2.195 -9.564
34 HD12 LEU 4 2HD1 LEU 4 -2.447 -1.915 -10.954
35 HD13 LEU 4 3HD1 LEU 4 -2.384 -0.825 -9.569
36 HD21 LEU 4 3HD2 LEU 4 -2.689 -4.458 -9.122
37 HD22 LEU 4 1HD2 LEU 4 -0.960 -4.792 -9.039
38 HD23 LEU 4 2HD2 LEU 4 -1.702 -4.370 -10.582
39 H ILE 5 H ILE 5 2.749 -1.654 -8.116
40 HA ILE 5 HA ILE 5 4.239 -0.788 -10.371
41 HB ILE 5 HB ILE 5 5.502 0.497 -8.922
42 HG12 ILE 5 2HG1 ILE 5 4.993 -1.623 -6.828
43 HG13 ILE 5 3HG1 ILE 5 6.523 -1.241 -7.610
44 HG21 ILE 5 1HG2 ILE 5 3.938 1.644 -7.755
45 HG22 ILE 5 2HG2 ILE 5 2.846 0.560 -8.616
46 HG23 ILE 5 3HG2 ILE 5 3.316 0.201 -6.955
47 HD11 ILE 5 3HD1 ILE 5 6.902 -0.092 -5.729
48 HD12 ILE 5 1HD1 ILE 5 5.915 1.146 -6.507
49 HD13 ILE 5 2HD1 ILE 5 5.187 0.042 -5.340
50 H GLY 6 H GLY 6 4.727 -3.298 -7.942
51 HA2 GLY 6 2HA GLY 6 7.372 -3.950 -8.910
52 HA3 GLY 6 3HA GLY 6 6.471 -4.808 -7.669
53 H ARG 7 H ARG 7 4.224 -4.704 -9.883
54 HA ARG 7 HA ARG 7 5.047 -7.253 -11.078
55 HB2 ARG 7 2HB ARG 7 3.014 -7.696 -10.120
56 HB3 ARG 7 3HB ARG 7 2.439 -6.046 -10.321
57 HG2 ARG 7 2HG ARG 7 2.836 -7.662 -12.772
58 HG3 ARG 7 3HG ARG 7 1.473 -8.070 -11.728
59 HD2 ARG 7 2HD ARG 7 1.449 -5.283 -11.934
60 HD3 ARG 7 3HD ARG 7 1.789 -5.869 -13.561
61 HE ARG 7 HE ARG 7 -0.400 -7.211 -12.259
62 HH11 ARG 7 1HH1 ARG 7 0.555 -4.505 -14.230
63 HH12 ARG 7 2HH1 ARG 7 -1.018 -4.286 -14.922
64 HH21 ARG 7 1HH2 ARG 7 -2.476 -6.933 -13.162
65 HH22 ARG 7 2HH2 ARG 7 -2.742 -5.667 -14.313
66 H VAL 8 H VAL 8 4.044 -4.001 -11.862
67 HA VAL 8 HA VAL 8 3.340 -4.155 -14.500
68 HB VAL 8 HB VAL 8 3.418 -2.059 -13.155
69 HG11 VAL 8 1HG1 VAL 8 5.324 -1.055 -12.491
70 HG12 VAL 8 2HG1 VAL 8 5.997 -2.678 -12.654
71 HG13 VAL 8 3HG1 VAL 8 6.197 -1.504 -13.955
72 HG21 VAL 8 3HG2 VAL 8 3.192 -2.154 -15.673
73 HG22 VAL 8 1HG2 VAL 8 3.760 -0.623 -15.005
74 HG23 VAL 8 2HG2 VAL 8 4.904 -1.738 -15.753
75 H LEU 9 H LEU 9 6.523 -4.526 -13.109
76 HA LEU 9 HA LEU 9 8.130 -4.168 -15.342
77 HB2 LEU 9 2HB LEU 9 9.800 -5.376 -14.205
78 HB3 LEU 9 3HB LEU 9 8.853 -4.558 -12.964
79 HG LEU 9 HG LEU 9 7.600 -6.885 -12.884
80 HD11 LEU 9 1HD1 LEU 9 9.599 -7.451 -14.728
81 HD12 LEU 9 2HD1 LEU 9 8.580 -8.611 -13.878
82 HD13 LEU 9 3HD1 LEU 9 10.158 -8.178 -13.222
83 HD21 LEU 9 3HD2 LEU 9 10.318 -6.527 -11.632
84 HD22 LEU 9 1HD2 LEU 9 8.973 -7.489 -11.019
85 HD23 LEU 9 2HD2 LEU 9 8.850 -5.730 -11.063
86 H SER 10 H SER 10 6.298 -7.005 -14.315
87 HA SER 10 HA SER 10 7.125 -8.407 -16.759
88 HB2 SER 10 2HB SER 10 5.737 -10.288 -15.439
89 HB3 SER 10 3HB SER 10 7.446 -9.980 -15.130
90 HG SER 10 HG SER 10 6.627 -9.833 -13.154
91 H GLY 11 H GLY 11 4.375 -7.048 -15.098
92 HA2 GLY 11 2HA GLY 11 2.341 -8.265 -16.655
93 HA3 GLY 11 3HA GLY 11 2.173 -6.795 -15.706
94 H ILE 12 H ILE 12 4.512 -5.662 -17.296
95 HA ILE 12 HA ILE 12 2.864 -4.560 -19.420
96 HB ILE 12 HB ILE 12 4.342 -3.147 -17.923
97 HG12 ILE 12 2HG1 ILE 12 5.318 -1.930 -20.096
98 HG13 ILE 12 3HG1 ILE 12 4.223 -3.053 -20.896
99 HG21 ILE 12 1HG2 ILE 12 6.278 -4.886 -18.374
100 HG22 ILE 12 2HG2 ILE 12 6.621 -3.794 -19.715
101 HG23 ILE 12 3HG2 ILE 12 6.620 -3.184 -18.060
102 HD11 ILE 12 3HD1 ILE 12 3.019 -1.649 -18.642
103 HD12 ILE 12 1HD1 ILE 12 3.553 -0.590 -19.947
104 HD13 ILE 12 2HD1 ILE 12 2.420 -1.899 -20.282
105 H LEU 13 H LEU 13 5.570 -6.714 -19.021
106 HA LEU 13 HA LEU 13 5.345 -7.607 -21.736
107 HB2 LEU 13 2HB LEU 13 7.207 -5.553 -21.152
108 HB3 LEU 13 3HB LEU 13 8.120 -7.033 -21.443
109 HG LEU 13 HG LEU 13 6.096 -6.641 -23.469
110 HD11 LEU 13 1HD1 LEU 13 6.583 -4.247 -22.765
111 HD12 LEU 13 2HD1 LEU 13 6.810 -4.642 -24.468
112 HD13 LEU 13 3HD1 LEU 13 8.207 -4.507 -23.401
113 HD21 LEU 13 3HD2 LEU 13 8.130 -8.110 -23.529
114 HD22 LEU 13 1HD2 LEU 13 9.098 -6.647 -23.703
115 HD23 LEU 13 2HD2 LEU 13 7.916 -7.074 -24.940