Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
576187 | 2mmw RC | 21000 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 2.220 0.071 0.599
2 HA2 GLY 1 HA3 GLY 1 2.839 -0.158 -1.625
3 HA3 GLY 1 HA2 GLY 1 1.288 -0.973 -1.910
4 H GLY 2 H GLY 2 1.443 2.406 -0.536
5 HA2 GLY 2 HA3 GLY 2 1.349 3.711 -3.102
6 HA3 GLY 2 HA2 GLY 2 -0.302 3.410 -2.483
7 H ALA 3 H ALA 3 -0.814 5.703 -1.984
8 HA ALA 3 HA ALA 3 0.698 6.770 0.358
9 HB1 ALA 3 HB1 ALA 3 1.072 8.942 -0.791
10 HB2 ALA 3 HB2 ALA 3 1.884 7.621 -1.680
11 HB3 ALA 3 HB3 ALA 3 0.338 8.286 -2.288
12 H GLY 4 H GLY 4 -1.864 5.632 0.466
13 HA2 GLY 4 HA3 GLY 4 -3.810 7.874 0.321
14 HA3 GLY 4 HA2 GLY 4 -4.140 6.164 0.640
15 H HIS 5 H HIS 5 -5.256 6.455 2.682
16 HA HIS 5 HA HIS 5 -4.008 8.235 4.700
17 HB2 HIS 5 HB2 HIS 5 -6.769 7.003 4.356
18 HB3 HIS 5 HB3 HIS 5 -6.187 7.221 6.010
19 HD1 HIS 5 HD1 HIS 5 -5.950 9.467 2.944
20 HD2 HIS 5 HD2 HIS 5 -7.069 9.452 6.998
21 HE1 HIS 5 HE1 HIS 5 -6.660 11.844 3.473
22 H VAL 6 H VAL 6 -4.621 4.640 4.304
23 HA VAL 6 HA VAL 6 -3.888 4.375 7.165
24 HB VAL 6 HB VAL 6 -5.017 2.376 5.178
25 HG11 VAL 6 HG11 VAL 6 -5.536 0.945 7.146
26 HG12 VAL 6 HG12 VAL 6 -3.782 1.237 7.076
27 HG13 VAL 6 HG13 VAL 6 -4.802 2.133 8.243
28 HG21 VAL 6 HG21 VAL 6 -7.187 2.715 6.391
29 HG22 VAL 6 HG22 VAL 6 -6.426 3.988 7.388
30 HG23 VAL 6 HG23 VAL 6 -6.640 4.226 5.633
31 HA PRO 7 HA PRO 7 0.181 3.144 5.626
32 HB2 PRO 7 HB2 PRO 7 1.289 1.795 7.781
33 HB3 PRO 7 HB3 PRO 7 1.067 3.568 7.701
34 HG2 PRO 7 HG2 PRO 7 -0.850 1.562 8.959
35 HG3 PRO 7 HG3 PRO 7 -0.171 3.038 9.725
36 HD2 PRO 7 HD2 PRO 7 -2.643 3.101 8.651
37 HD3 PRO 7 HD3 PRO 7 -1.546 4.487 8.300
38 H GLU 8 H GLU 8 1.069 1.271 4.441
39 HA GLU 8 HA GLU 8 -0.701 -1.107 4.407
40 HB2 GLU 8 HB2 GLU 8 1.804 -0.500 2.767
41 HB3 GLU 8 HB3 GLU 8 0.748 -1.924 2.559
42 HG2 GLU 8 HG2 GLU 8 -1.172 -0.441 2.025
43 HG3 GLU 8 HG3 GLU 8 -0.120 0.989 2.172
44 H TYR 9 H TYR 9 2.866 -0.315 4.940
45 HA TYR 9 HA TYR 9 3.052 -2.843 6.550
46 HB2 TYR 9 HB2 TYR 9 5.071 -1.734 4.505
47 HB3 TYR 9 HB3 TYR 9 5.222 -3.267 5.387
48 HD1 TYR 9 HD2 TYR 9 3.285 -5.017 5.083
49 HD2 TYR 9 HD1 TYR 9 4.033 -1.810 2.321
50 HE1 TYR 9 HE2 TYR 9 2.029 -6.221 3.325
51 HE2 TYR 9 HE1 TYR 9 2.729 -2.969 0.598
52 HH TYR 9 HH TYR 9 1.445 -4.916 0.056
53 H PHE 10 H PHE 10 5.281 -2.797 7.787
54 HA PHE 10 HA PHE 10 5.964 0.006 8.592
55 HB2 PHE 10 HB2 PHE 10 5.154 -2.365 10.382
56 HB3 PHE 10 HB3 PHE 10 6.009 -0.949 11.007
57 HD1 PHE 10 HD1 PHE 10 2.813 -2.053 9.376
58 HD2 PHE 10 HD2 PHE 10 4.908 1.267 11.131
59 HE1 PHE 10 HE1 PHE 10 0.658 -0.897 9.774
60 HE2 PHE 10 HE2 PHE 10 2.745 2.382 11.599
61 HZ PHE 10 HZ PHE 10 0.616 1.213 11.084
62 H VAL 11 H VAL 11 8.007 -0.078 10.041
63 HA VAL 11 HA VAL 11 9.954 -1.841 8.580
64 HB VAL 11 HB VAL 11 11.612 -0.166 8.977
65 HG11 VAL 11 HG11 VAL 11 10.031 0.503 7.205
66 HG12 VAL 11 HG12 VAL 11 8.984 1.332 8.383
67 HG13 VAL 11 HG13 VAL 11 10.628 1.934 8.099
68 HG21 VAL 11 HG21 VAL 11 11.323 0.321 11.373
69 HG22 VAL 11 HG22 VAL 11 11.236 1.840 10.467
70 HG23 VAL 11 HG23 VAL 11 9.744 1.069 11.074
71 H ARG 12 H ARG 12 12.063 -1.952 10.466
72 HA ARG 12 HA ARG 12 10.816 -3.657 12.499
73 HB2 ARG 12 HB2 ARG 12 12.990 -4.133 11.228
74 HB3 ARG 12 HB3 ARG 12 13.789 -2.924 12.260
75 HG2 ARG 12 HG2 ARG 12 13.071 -4.309 14.305
76 HG3 ARG 12 HG3 ARG 12 12.267 -5.446 13.193
77 HD2 ARG 12 HD2 ARG 12 14.322 -6.496 13.709
78 HD3 ARG 12 HD3 ARG 12 14.530 -5.830 12.054
79 HE ARG 12 HE ARG 12 15.502 -3.937 14.007
80 HH11 ARG 12 HH11 ARG 12 16.332 -7.165 12.623
81 HH12 ARG 12 HH12 ARG 12 18.035 -6.968 13.008
82 HH21 ARG 12 HH21 ARG 12 17.702 -3.796 14.475
83 HH22 ARG 12 HH22 ARG 12 18.801 -5.105 14.034
84 H GLY 13 H GLY 13 9.498 -1.531 13.194
85 HA2 GLY 13 HA3 GLY 13 9.105 -0.342 15.155
86 HA3 GLY 13 HA2 GLY 13 10.703 -0.813 15.731
87 H ASP 14 H ASP 14 9.007 1.518 13.444
88 HA ASP 14 HA ASP 14 10.376 3.599 14.778
89 HB2 ASP 14 HB2 ASP 14 12.125 2.586 12.881
90 HB3 ASP 14 HB3 ASP 14 11.360 3.856 11.923
91 H THR 15 H THR 15 9.216 3.320 11.302
92 HA THR 15 HA THR 15 6.713 4.591 11.933
93 HB THR 15 HB THR 15 7.646 6.516 10.078
94 HG1 THR 15 HG1 THR 15 9.738 7.175 10.992
95 HG21 THR 15 HG21 THR 15 7.668 6.941 13.124
96 HG22 THR 15 HG22 THR 15 6.226 7.056 12.077
97 HG23 THR 15 HG23 THR 15 7.581 8.193 11.866
98 HA PRO 16 HA PRO 16 6.314 2.337 8.101
99 HB2 PRO 16 HB2 PRO 16 3.941 3.263 7.006
100 HB3 PRO 16 HB3 PRO 16 3.967 2.479 8.614
101 HG2 PRO 16 HG2 PRO 16 4.161 5.486 8.068
102 HG3 PRO 16 HG3 PRO 16 2.900 4.685 9.057
103 HD2 PRO 16 HD2 PRO 16 5.126 5.744 10.253
104 HD3 PRO 16 HD3 PRO 16 4.557 4.114 10.788
105 H ILE 17 H ILE 17 6.170 2.605 5.580
106 HA ILE 17 HA ILE 17 7.064 5.331 4.708
107 HB ILE 17 HB ILE 17 8.341 2.769 3.646
108 HG12 ILE 17 HG12 ILE 17 9.436 4.412 5.999
109 HG13 ILE 17 HG13 ILE 17 8.838 2.735 6.060
110 HG21 ILE 17 HG21 ILE 17 8.504 5.117 2.401
111 HG22 ILE 17 HG22 ILE 17 9.535 5.606 3.756
112 HG23 ILE 17 HG23 ILE 17 10.016 4.255 2.686
113 HD11 ILE 17 HD11 ILE 17 11.344 3.670 4.517
114 HD12 ILE 17 HD12 ILE 17 11.310 2.683 5.976
115 HD13 ILE 17 HD13 ILE 17 10.657 2.018 4.458
116 H SER 18 H SER 18 4.350 4.238 4.533
117 HA SER 18 HA SER 18 3.847 4.599 1.784
118 HB2 SER 18 HB2 SER 18 3.171 2.145 1.233
119 HB3 SER 18 HB3 SER 18 4.920 2.404 1.242
120 HG SER 18 HG SER 18 4.353 0.571 2.596
121 H PHE 19 H PHE 19 1.507 4.211 1.242
122 HA PHE 19 HA PHE 19 -0.180 3.210 3.434
123 HB2 PHE 19 HB2 PHE 19 -0.470 6.061 2.311
124 HB3 PHE 19 HB3 PHE 19 -1.517 5.335 3.535
125 HD1 PHE 19 HD1 PHE 19 1.968 6.511 2.764
126 HD2 PHE 19 HD2 PHE 19 -0.826 5.508 5.878
127 HE1 PHE 19 HE1 PHE 19 3.581 7.287 4.463
128 HE2 PHE 19 HE2 PHE 19 0.775 6.327 7.572
129 HZ PHE 19 HZ PHE 19 2.959 7.274 6.865
130 H TYR 20 H TYR 20 -2.673 3.480 2.654
131 HA TYR 20 HA TYR 20 -2.764 1.527 0.598
132 HB2 TYR 20 HB2 TYR 20 -4.933 3.455 1.630
133 HB3 TYR 20 HB3 TYR 20 -5.268 2.104 0.530
134 HD1 TYR 20 HD1 TYR 20 -2.769 1.023 2.972
135 HD2 TYR 20 HD2 TYR 20 -6.969 1.771 2.421
136 HE1 TYR 20 HE1 TYR 20 -3.276 -0.600 4.714
137 HE2 TYR 20 HE2 TYR 20 -7.477 0.152 4.213
138 HH TYR 20 HH TYR 20 -4.976 -1.676 5.991
139 H GLY 21 H GLY 21 -4.219 1.859 -1.567
140 HA2 GLY 21 HA3 GLY 21 -4.060 4.566 -2.650
141 HA3 GLY 21 HA2 GLY 21 -2.838 3.460 -3.347
Start of MODEL 2
1 H1 GLY 1 H GLY 1 2.348 -0.119 0.799
2 HA2 GLY 1 HA3 GLY 1 3.045 -0.410 -1.394
3 HA3 GLY 1 HA2 GLY 1 1.492 -1.210 -1.715
4 H GLY 2 H GLY 2 1.657 2.198 -0.450
5 HA2 GLY 2 HA3 GLY 2 1.665 3.414 -3.063
6 HA3 GLY 2 HA2 GLY 2 -0.008 3.194 -2.467
7 H ALA 3 H ALA 3 -0.422 5.531 -2.092
8 HA ALA 3 HA ALA 3 1.036 6.603 0.285
9 HB1 ALA 3 HB1 ALA 3 2.316 7.375 -1.730
10 HB2 ALA 3 HB2 ALA 3 0.811 8.066 -2.407
11 HB3 ALA 3 HB3 ALA 3 1.510 8.738 -0.899
12 H GLY 4 H GLY 4 -1.541 5.531 0.338
13 HA2 GLY 4 HA3 GLY 4 -3.437 7.795 0.024
14 HA3 GLY 4 HA2 GLY 4 -3.812 6.101 0.373
15 H HIS 5 H HIS 5 -4.958 6.328 2.379
16 HA HIS 5 HA HIS 5 -3.874 8.277 4.349
17 HB2 HIS 5 HB2 HIS 5 -6.602 7.278 3.666
18 HB3 HIS 5 HB3 HIS 5 -6.294 7.193 5.399
19 HD1 HIS 5 HD1 HIS 5 -5.978 9.375 6.650
20 HD2 HIS 5 HD2 HIS 5 -6.581 9.801 2.512
21 HE1 HIS 5 HE1 HIS 5 -6.469 11.826 6.285
22 H VAL 6 H VAL 6 -4.375 4.675 4.083
23 HA VAL 6 HA VAL 6 -3.842 4.526 7.016
24 HB VAL 6 HB VAL 6 -4.959 2.494 5.046
25 HG11 VAL 6 HG11 VAL 6 -5.601 1.149 7.024
26 HG12 VAL 6 HG12 VAL 6 -3.835 1.387 7.013
27 HG13 VAL 6 HG13 VAL 6 -4.870 2.345 8.120
28 HG21 VAL 6 HG21 VAL 6 -7.161 2.944 6.155
29 HG22 VAL 6 HG22 VAL 6 -6.404 4.228 7.142
30 HG23 VAL 6 HG23 VAL 6 -6.530 4.410 5.369
31 HA PRO 7 HA PRO 7 0.238 3.130 5.654
32 HB2 PRO 7 HB2 PRO 7 1.228 1.819 7.884
33 HB3 PRO 7 HB3 PRO 7 1.057 3.597 7.748
34 HG2 PRO 7 HG2 PRO 7 -0.950 1.673 8.992
35 HG3 PRO 7 HG3 PRO 7 -0.258 3.159 9.738
36 HD2 PRO 7 HD2 PRO 7 -2.694 3.252 8.579
37 HD3 PRO 7 HD3 PRO 7 -1.544 4.601 8.235
38 H GLU 8 H GLU 8 1.079 1.210 4.537
39 HA GLU 8 HA GLU 8 -0.743 -1.130 4.524
40 HB2 GLU 8 HB2 GLU 8 1.833 -0.627 2.958
41 HB3 GLU 8 HB3 GLU 8 0.752 -2.033 2.753
42 HG2 GLU 8 HG2 GLU 8 -1.112 -0.522 2.111
43 HG3 GLU 8 HG3 GLU 8 -0.030 0.888 2.249
44 H TYR 9 H TYR 9 2.783 -0.363 5.241
45 HA TYR 9 HA TYR 9 2.896 -2.894 6.855
46 HB2 TYR 9 HB2 TYR 9 5.009 -1.794 4.897
47 HB3 TYR 9 HB3 TYR 9 5.103 -3.333 5.779
48 HD1 TYR 9 HD2 TYR 9 3.149 -5.049 5.395
49 HD2 TYR 9 HD1 TYR 9 4.069 -1.848 2.670
50 HE1 TYR 9 HE2 TYR 9 1.992 -6.257 3.590
51 HE2 TYR 9 HE1 TYR 9 2.879 -3.045 0.868
52 HH TYR 9 HH TYR 9 1.386 -6.262 1.282
53 H PHE 10 H PHE 10 5.077 -2.859 8.171
54 HA PHE 10 HA PHE 10 5.802 -0.056 8.944
55 HB2 PHE 10 HB2 PHE 10 4.877 -2.362 10.758
56 HB3 PHE 10 HB3 PHE 10 5.748 -0.946 11.371
57 HD1 PHE 10 HD1 PHE 10 2.577 -2.031 9.692
58 HD2 PHE 10 HD2 PHE 10 4.709 1.304 11.376
59 HE1 PHE 10 HE1 PHE 10 0.444 -0.802 9.973
60 HE2 PHE 10 HE2 PHE 10 2.564 2.495 11.726
61 HZ PHE 10 HZ PHE 10 0.420 1.362 11.192
62 H VAL 11 H VAL 11 7.801 -0.179 10.459
63 HA VAL 11 HA VAL 11 9.735 -2.025 9.079
64 HB VAL 11 HB VAL 11 11.413 -0.362 9.421
65 HG11 VAL 11 HG11 VAL 11 8.818 1.161 8.748
66 HG12 VAL 11 HG12 VAL 11 10.480 1.716 8.465
67 HG13 VAL 11 HG13 VAL 11 9.863 0.269 7.614
68 HG21 VAL 11 HG21 VAL 11 11.107 0.221 11.798
69 HG22 VAL 11 HG22 VAL 11 11.068 1.705 10.834
70 HG23 VAL 11 HG23 VAL 11 9.549 0.993 11.444
71 H ARG 12 H ARG 12 11.801 -2.108 10.945
72 HA ARG 12 HA ARG 12 10.642 -3.672 13.136
73 HB2 ARG 12 HB2 ARG 12 13.491 -2.673 12.598
74 HB3 ARG 12 HB3 ARG 12 13.045 -3.758 13.934
75 HG2 ARG 12 HG2 ARG 12 12.352 -5.536 12.453
76 HG3 ARG 12 HG3 ARG 12 12.422 -4.512 11.002
77 HD2 ARG 12 HD2 ARG 12 14.870 -5.183 12.720
78 HD3 ARG 12 HD3 ARG 12 14.374 -6.098 11.253
79 HE ARG 12 HE ARG 12 14.537 -3.371 10.488
80 HH11 ARG 12 HH11 ARG 12 16.746 -5.991 11.600
81 HH12 ARG 12 HH12 ARG 12 18.104 -5.314 10.711
82 HH21 ARG 12 HH21 ARG 12 16.332 -2.588 9.386
83 HH22 ARG 12 HH22 ARG 12 17.880 -3.431 9.479
84 H GLY 13 H GLY 13 9.118 -1.709 13.733
85 HA2 GLY 13 HA3 GLY 13 8.606 -0.259 15.470
86 HA3 GLY 13 HA2 GLY 13 10.136 -0.759 16.202
87 H ASP 14 H ASP 14 8.705 1.561 13.749
88 HA ASP 14 HA ASP 14 10.101 3.613 15.116
89 HB2 ASP 14 HB2 ASP 14 11.890 2.490 13.354
90 HB3 ASP 14 HB3 ASP 14 11.209 3.723 12.290
91 H THR 15 H THR 15 9.065 3.271 11.607
92 HA THR 15 HA THR 15 6.581 4.643 12.103
93 HB THR 15 HB THR 15 7.618 6.465 10.216
94 HG1 THR 15 HG1 THR 15 9.703 7.102 11.154
95 HG21 THR 15 HG21 THR 15 7.554 8.209 11.937
96 HG22 THR 15 HG22 THR 15 7.591 7.010 13.248
97 HG23 THR 15 HG23 THR 15 6.170 7.111 12.170
98 HA PRO 16 HA PRO 16 6.242 2.244 8.353
99 HB2 PRO 16 HB2 PRO 16 3.937 3.197 7.147
100 HB3 PRO 16 HB3 PRO 16 3.888 2.469 8.783
101 HG2 PRO 16 HG2 PRO 16 4.187 5.445 8.134
102 HG3 PRO 16 HG3 PRO 16 2.873 4.713 9.111
103 HD2 PRO 16 HD2 PRO 16 5.080 5.759 10.348
104 HD3 PRO 16 HD3 PRO 16 4.452 4.161 10.913
105 H ILE 17 H ILE 17 6.200 2.421 5.824
106 HA ILE 17 HA ILE 17 7.165 5.095 4.877
107 HB ILE 17 HB ILE 17 8.476 2.490 3.975
108 HG12 ILE 17 HG12 ILE 17 9.489 4.243 6.294
109 HG13 ILE 17 HG13 ILE 17 8.875 2.574 6.412
110 HG21 ILE 17 HG21 ILE 17 8.678 4.768 2.637
111 HG22 ILE 17 HG22 ILE 17 9.658 5.335 4.001
112 HG23 ILE 17 HG23 ILE 17 10.185 3.933 3.021
113 HD11 ILE 17 HD11 ILE 17 11.350 2.518 6.428
114 HD12 ILE 17 HD12 ILE 17 10.751 1.774 4.922
115 HD13 ILE 17 HD13 ILE 17 11.443 3.427 4.921
116 H SER 18 H SER 18 4.479 4.122 4.628
117 HA SER 18 HA SER 18 4.050 4.427 1.897
118 HB2 SER 18 HB2 SER 18 3.324 1.977 1.304
119 HB3 SER 18 HB3 SER 18 5.050 2.302 1.225
120 HG SER 18 HG SER 18 3.768 1.100 3.494
121 H PHE 19 H PHE 19 1.727 4.081 1.270
122 HA PHE 19 HA PHE 19 -0.040 3.159 3.443
123 HB2 PHE 19 HB2 PHE 19 -0.221 5.977 2.223
124 HB3 PHE 19 HB3 PHE 19 -1.334 5.320 3.429
125 HD1 PHE 19 HD2 PHE 19 2.213 6.365 2.761
126 HD2 PHE 19 HD1 PHE 19 -0.730 5.536 5.790
127 HE1 PHE 19 HE2 PHE 19 3.778 7.153 4.500
128 HE2 PHE 19 HE1 PHE 19 0.828 6.359 7.522
129 HZ PHE 19 HZ PHE 19 3.061 7.235 6.874
130 H TYR 20 H TYR 20 -2.509 3.481 2.555
131 HA TYR 20 HA TYR 20 -2.587 1.463 0.549
132 HB2 TYR 20 HB2 TYR 20 -4.728 3.483 1.457
133 HB3 TYR 20 HB3 TYR 20 -5.065 2.114 0.381
134 HD1 TYR 20 HD2 TYR 20 -2.678 1.039 2.942
135 HD2 TYR 20 HD1 TYR 20 -6.835 1.872 2.223
136 HE1 TYR 20 HE2 TYR 20 -3.284 -0.518 4.713
137 HE2 TYR 20 HE1 TYR 20 -7.445 0.315 4.039
138 HH TYR 20 HH TYR 20 -5.050 -1.521 5.953
139 H GLY 21 H GLY 21 -3.983 1.805 -1.663
140 HA2 GLY 21 HA3 GLY 21 -3.153 4.421 -2.913
141 HA3 GLY 21 HA2 GLY 21 -2.836 2.850 -3.698
Start of MODEL 3
1 H1 GLY 1 H GLY 1 2.268 -0.028 0.705
2 HA2 GLY 1 HA3 GLY 1 2.907 -0.290 -1.511
3 HA3 GLY 1 HA2 GLY 1 1.362 -1.124 -1.789
4 H GLY 2 H GLY 2 1.695 2.297 -0.540
5 HA2 GLY 2 HA3 GLY 2 1.472 3.534 -3.104
6 HA3 GLY 2 HA2 GLY 2 -0.166 3.280 -2.431
7 H ALA 3 H ALA 3 -0.601 5.605 -2.035
8 HA ALA 3 HA ALA 3 0.909 6.676 0.305
9 HB1 ALA 3 HB1 ALA 3 1.383 8.810 -0.880
10 HB2 ALA 3 HB2 ALA 3 2.160 7.441 -1.728
11 HB3 ALA 3 HB3 ALA 3 0.647 8.146 -2.374
12 H GLY 4 H GLY 4 -1.696 5.627 0.394
13 HA2 GLY 4 HA3 GLY 4 -3.541 7.957 0.203
14 HA3 GLY 4 HA2 GLY 4 -3.956 6.263 0.518
15 H HIS 5 H HIS 5 -5.083 6.583 2.555
16 HA HIS 5 HA HIS 5 -3.778 8.294 4.590
17 HB2 HIS 5 HB2 HIS 5 -6.556 7.028 4.344
18 HB3 HIS 5 HB3 HIS 5 -5.900 7.397 5.947
19 HD1 HIS 5 HD1 HIS 5 -7.172 9.373 6.593
20 HD2 HIS 5 HD2 HIS 5 -5.424 9.716 2.782
21 HE1 HIS 5 HE1 HIS 5 -7.519 11.771 5.905
22 H VAL 6 H VAL 6 -4.612 4.731 4.229
23 HA VAL 6 HA VAL 6 -3.890 4.453 7.075
24 HB VAL 6 HB VAL 6 -5.012 2.455 5.083
25 HG11 VAL 6 HG11 VAL 6 -3.812 1.316 6.999
26 HG12 VAL 6 HG12 VAL 6 -4.843 2.221 8.155
27 HG13 VAL 6 HG13 VAL 6 -5.574 1.043 7.041
28 HG21 VAL 6 HG21 VAL 6 -6.609 4.333 5.518
29 HG22 VAL 6 HG22 VAL 6 -7.186 2.827 6.270
30 HG23 VAL 6 HG23 VAL 6 -6.424 4.093 7.278
31 HA PRO 7 HA PRO 7 0.207 3.151 5.655
32 HB2 PRO 7 HB2 PRO 7 1.231 1.824 7.857
33 HB3 PRO 7 HB3 PRO 7 1.034 3.602 7.749
34 HG2 PRO 7 HG2 PRO 7 -0.930 1.626 8.977
35 HG3 PRO 7 HG3 PRO 7 -0.256 3.108 9.744
36 HD2 PRO 7 HD2 PRO 7 -2.704 3.190 8.605
37 HD3 PRO 7 HD3 PRO 7 -1.572 4.557 8.272
38 H GLU 8 H GLU 8 1.076 1.256 4.513
39 HA GLU 8 HA GLU 8 -0.719 -1.108 4.487
40 HB2 GLU 8 HB2 GLU 8 1.817 -0.559 2.874
41 HB3 GLU 8 HB3 GLU 8 0.739 -1.969 2.685
42 HG2 GLU 8 HG2 GLU 8 -1.153 -0.460 2.114
43 HG3 GLU 8 HG3 GLU 8 -0.072 0.952 2.222
44 H TYR 9 H TYR 9 2.832 -0.331 5.101
45 HA TYR 9 HA TYR 9 2.965 -2.844 6.748
46 HB2 TYR 9 HB2 TYR 9 5.025 -1.790 4.712
47 HB3 TYR 9 HB3 TYR 9 5.145 -3.312 5.627
48 HD1 TYR 9 HD2 TYR 9 3.172 -5.031 5.356
49 HD2 TYR 9 HD1 TYR 9 4.043 -1.929 2.504
50 HE1 TYR 9 HE2 TYR 9 1.876 -6.240 3.629
51 HE2 TYR 9 HE1 TYR 9 2.717 -3.103 0.804
52 HH TYR 9 HH TYR 9 1.299 -4.972 0.343
53 H PHE 10 H PHE 10 5.150 -2.832 8.029
54 HA PHE 10 HA PHE 10 5.877 -0.034 8.826
55 HB2 PHE 10 HB2 PHE 10 4.989 -2.375 10.612
56 HB3 PHE 10 HB3 PHE 10 5.850 -0.959 11.240
57 HD1 PHE 10 HD1 PHE 10 2.675 -2.057 9.575
58 HD2 PHE 10 HD2 PHE 10 4.785 1.275 11.297
59 HE1 PHE 10 HE1 PHE 10 0.529 -0.861 9.903
60 HE2 PHE 10 HE2 PHE 10 2.630 2.437 11.683
61 HZ PHE 10 HZ PHE 10 0.494 1.290 11.146
62 H VAL 11 H VAL 11 7.893 -0.156 10.311
63 HA VAL 11 HA VAL 11 9.819 -2.036 8.965
64 HB VAL 11 HB VAL 11 11.516 -0.402 9.317
65 HG11 VAL 11 HG11 VAL 11 10.646 1.674 8.326
66 HG12 VAL 11 HG12 VAL 11 9.963 0.245 7.496
67 HG13 VAL 11 HG13 VAL 11 8.964 1.192 8.630
68 HG21 VAL 11 HG21 VAL 11 9.655 1.005 11.304
69 HG22 VAL 11 HG22 VAL 11 11.191 0.202 11.686
70 HG23 VAL 11 HG23 VAL 11 11.198 1.676 10.706
71 H ARG 12 H ARG 12 11.862 -2.120 10.903
72 HA ARG 12 HA ARG 12 10.597 -3.675 13.044
73 HB2 ARG 12 HB2 ARG 12 13.492 -2.733 12.688
74 HB3 ARG 12 HB3 ARG 12 12.915 -3.857 13.944
75 HG2 ARG 12 HG2 ARG 12 12.200 -5.504 12.234
76 HG3 ARG 12 HG3 ARG 12 12.693 -4.427 10.905
77 HD2 ARG 12 HD2 ARG 12 14.574 -5.528 13.051
78 HD3 ARG 12 HD3 ARG 12 14.389 -6.223 11.402
79 HE ARG 12 HE ARG 12 15.013 -3.505 11.004
80 HH11 ARG 12 HH11 ARG 12 16.601 -6.396 12.462
81 HH12 ARG 12 HH12 ARG 12 18.207 -5.759 12.134
82 HH21 ARG 12 HH21 ARG 12 17.106 -2.787 10.626
83 HH22 ARG 12 HH22 ARG 12 18.493 -3.768 11.103
84 H GLY 13 H GLY 13 9.105 -1.661 13.597
85 HA2 GLY 13 HA3 GLY 13 8.591 -0.204 15.332
86 HA3 GLY 13 HA2 GLY 13 10.091 -0.741 16.096
87 H ASP 14 H ASP 14 8.774 1.599 13.603
88 HA ASP 14 HA ASP 14 10.211 3.622 15.001
89 HB2 ASP 14 HB2 ASP 14 12.011 2.516 13.320
90 HB3 ASP 14 HB3 ASP 14 11.287 3.621 12.146
91 H THR 15 H THR 15 9.107 3.265 11.514
92 HA THR 15 HA THR 15 6.646 4.642 12.028
93 HB THR 15 HB THR 15 7.630 6.493 10.132
94 HG1 THR 15 HG1 THR 15 9.844 5.810 10.618
95 HG21 THR 15 HG21 THR 15 7.574 8.223 11.849
96 HG22 THR 15 HG22 THR 15 7.606 7.026 13.161
97 HG23 THR 15 HG23 THR 15 6.191 7.115 12.074
98 HA PRO 16 HA PRO 16 6.309 2.267 8.249
99 HB2 PRO 16 HB2 PRO 16 3.964 3.179 7.098
100 HB3 PRO 16 HB3 PRO 16 3.956 2.431 8.727
101 HG2 PRO 16 HG2 PRO 16 4.172 5.420 8.103
102 HG3 PRO 16 HG3 PRO 16 2.893 4.646 9.096
103 HD2 PRO 16 HD2 PRO 16 5.100 5.733 10.305
104 HD3 PRO 16 HD3 PRO 16 4.513 4.117 10.867
105 H ILE 17 H ILE 17 6.200 2.499 5.719
106 HA ILE 17 HA ILE 17 7.139 5.204 4.825
107 HB ILE 17 HB ILE 17 8.418 2.620 3.823
108 HG12 ILE 17 HG12 ILE 17 9.464 4.279 6.195
109 HG13 ILE 17 HG13 ILE 17 8.855 2.604 6.249
110 HG21 ILE 17 HG21 ILE 17 9.623 5.457 3.934
111 HG22 ILE 17 HG22 ILE 17 10.135 4.083 2.902
112 HG23 ILE 17 HG23 ILE 17 8.627 4.938 2.558
113 HD11 ILE 17 HD11 ILE 17 10.721 1.879 4.700
114 HD12 ILE 17 HD12 ILE 17 11.410 3.531 4.779
115 HD13 ILE 17 HD13 ILE 17 11.327 2.545 6.239
116 H SER 18 H SER 18 4.434 4.160 4.613
117 HA SER 18 HA SER 18 3.978 4.480 1.848
118 HB2 SER 18 HB2 SER 18 3.267 2.046 1.316
119 HB3 SER 18 HB3 SER 18 5.016 2.294 1.320
120 HG SER 18 HG SER 18 4.439 0.465 2.694
121 H PHE 19 H PHE 19 1.641 4.132 1.258
122 HA PHE 19 HA PHE 19 -0.097 3.207 3.447
123 HB2 PHE 19 HB2 PHE 19 -0.304 6.037 2.260
124 HB3 PHE 19 HB3 PHE 19 -1.397 5.355 3.474
125 HD1 PHE 19 HD2 PHE 19 2.125 6.458 2.767
126 HD2 PHE 19 HD1 PHE 19 -0.740 5.508 5.832
127 HE1 PHE 19 HE2 PHE 19 3.713 7.229 4.494
128 HE2 PHE 19 HE1 PHE 19 0.825 6.341 7.551
129 HZ PHE 19 HZ PHE 19 3.038 7.251 6.882
130 H TYR 20 H TYR 20 -2.578 3.504 2.605
131 HA TYR 20 HA TYR 20 -2.655 1.507 0.593
132 HB2 TYR 20 HB2 TYR 20 -4.817 3.492 1.507
133 HB3 TYR 20 HB3 TYR 20 -5.124 2.129 0.406
134 HD1 TYR 20 HD1 TYR 20 -2.743 1.051 2.966
135 HD2 TYR 20 HD2 TYR 20 -6.906 1.875 2.265
136 HE1 TYR 20 HE1 TYR 20 -3.341 -0.551 4.701
137 HE2 TYR 20 HE2 TYR 20 -7.509 0.284 4.056
138 HH TYR 20 HH TYR 20 -5.099 -1.630 5.881
139 H GLY 21 H GLY 21 -3.920 1.735 -1.628
140 HA2 GLY 21 HA3 GLY 21 -4.071 4.314 -2.832
141 HA3 GLY 21 HA2 GLY 21 -2.496 3.597 -3.264
Start of MODEL 4
1 H1 GLY 1 H GLY 1 2.061 -0.170 0.698
2 HA2 GLY 1 HA3 GLY 1 2.733 -0.321 -1.514
3 HA3 GLY 1 HA2 GLY 1 1.179 -1.122 -1.839
4 H GLY 2 H GLY 2 1.154 2.236 -0.478
5 HA2 GLY 2 HA3 GLY 2 1.199 3.502 -3.101
6 HA3 GLY 2 HA2 GLY 2 -0.456 3.262 -2.466
7 H ALA 3 H ALA 3 -0.909 5.571 -1.993
8 HA ALA 3 HA ALA 3 0.651 6.634 0.316
9 HB1 ALA 3 HB1 ALA 3 0.338 8.119 -2.352
10 HB2 ALA 3 HB2 ALA 3 1.095 8.775 -0.864
11 HB3 ALA 3 HB3 ALA 3 1.862 7.412 -1.732
12 H GLY 4 H GLY 4 -1.942 5.581 0.454
13 HA2 GLY 4 HA3 GLY 4 -3.819 7.869 0.238
14 HA3 GLY 4 HA2 GLY 4 -4.205 6.183 0.605
15 H HIS 5 H HIS 5 -5.225 6.372 2.684
16 HA HIS 5 HA HIS 5 -3.993 8.296 4.610
17 HB2 HIS 5 HB2 HIS 5 -6.789 7.530 3.936
18 HB3 HIS 5 HB3 HIS 5 -6.475 7.357 5.667
19 HD1 HIS 5 HD1 HIS 5 -5.382 9.963 3.115
20 HD2 HIS 5 HD2 HIS 5 -7.281 9.569 6.846
21 HE1 HIS 5 HE1 HIS 5 -5.881 12.321 3.881
22 H VAL 6 H VAL 6 -4.407 4.727 4.272
23 HA VAL 6 HA VAL 6 -3.898 4.526 7.222
24 HB VAL 6 HB VAL 6 -5.141 2.566 5.252
25 HG11 VAL 6 HG11 VAL 6 -4.958 2.391 8.325
26 HG12 VAL 6 HG12 VAL 6 -5.767 1.225 7.252
27 HG13 VAL 6 HG13 VAL 6 -3.995 1.406 7.177
28 HG21 VAL 6 HG21 VAL 6 -6.478 4.321 7.397
29 HG22 VAL 6 HG22 VAL 6 -6.642 4.515 5.628
30 HG23 VAL 6 HG23 VAL 6 -7.297 3.064 6.424
31 HA PRO 7 HA PRO 7 0.084 3.097 5.650
32 HB2 PRO 7 HB2 PRO 7 1.143 1.711 7.808
33 HB3 PRO 7 HB3 PRO 7 1.022 3.497 7.712
34 HG2 PRO 7 HG2 PRO 7 -0.965 1.605 9.031
35 HG3 PRO 7 HG3 PRO 7 -0.215 3.075 9.749
36 HD2 PRO 7 HD2 PRO 7 -2.708 3.204 8.709
37 HD3 PRO 7 HD3 PRO 7 -1.557 4.548 8.333
38 H GLU 8 H GLU 8 0.851 1.176 4.464
39 HA GLU 8 HA GLU 8 -1.084 -1.055 4.398
40 HB2 GLU 8 HB2 GLU 8 1.539 -0.678 2.868
41 HB3 GLU 8 HB3 GLU 8 0.383 -2.016 2.619
42 HG2 GLU 8 HG2 GLU 8 -1.400 -0.379 2.024
43 HG3 GLU 8 HG3 GLU 8 -0.232 0.957 2.188
44 H TYR 9 H TYR 9 2.484 -0.563 5.155
45 HA TYR 9 HA TYR 9 2.273 -2.758 7.134
46 HB2 TYR 9 HB2 TYR 9 4.218 -3.969 6.028
47 HB3 TYR 9 HB3 TYR 9 2.758 -3.954 5.025
48 HD1 TYR 9 HD2 TYR 9 6.071 -2.228 5.555
49 HD2 TYR 9 HD1 TYR 9 2.811 -2.921 2.831
50 HE1 TYR 9 HE2 TYR 9 7.339 -1.123 3.743
51 HE2 TYR 9 HE1 TYR 9 4.070 -1.814 1.032
52 HH TYR 9 HH TYR 9 6.135 -0.791 0.400
53 H PHE 10 H PHE 10 4.552 -3.029 8.251
54 HA PHE 10 HA PHE 10 5.760 -0.281 8.524
55 HB2 PHE 10 HB2 PHE 10 4.973 -2.322 10.683
56 HB3 PHE 10 HB3 PHE 10 5.938 -0.865 10.989
57 HD1 PHE 10 HD1 PHE 10 2.584 -2.023 9.686
58 HD2 PHE 10 HD2 PHE 10 4.857 1.308 11.195
59 HE1 PHE 10 HE1 PHE 10 0.491 -0.759 10.062
60 HE2 PHE 10 HE2 PHE 10 2.745 2.504 11.709
61 HZ PHE 10 HZ PHE 10 0.563 1.408 11.276
62 H VAL 11 H VAL 11 7.955 -0.438 9.683
63 HA VAL 11 HA VAL 11 9.444 -2.761 8.515
64 HB VAL 11 HB VAL 11 11.428 -1.486 8.680
65 HG11 VAL 11 HG11 VAL 11 11.018 0.563 7.484
66 HG12 VAL 11 HG12 VAL 11 9.826 -0.638 6.914
67 HG13 VAL 11 HG13 VAL 11 9.326 0.665 8.034
68 HG21 VAL 11 HG21 VAL 11 11.379 -0.681 10.998
69 HG22 VAL 11 HG22 VAL 11 11.600 0.718 9.930
70 HG23 VAL 11 HG23 VAL 11 10.001 0.381 10.651
71 H ARG 12 H ARG 12 11.415 -3.315 10.196
72 HA ARG 12 HA ARG 12 10.345 -4.398 12.578
73 HB2 ARG 12 HB2 ARG 12 12.732 -4.438 13.424
74 HB3 ARG 12 HB3 ARG 12 12.466 -5.257 11.877
75 HG2 ARG 12 HG2 ARG 12 13.682 -3.698 10.615
76 HG3 ARG 12 HG3 ARG 12 13.394 -2.347 11.728
77 HD2 ARG 12 HD2 ARG 12 15.173 -4.763 12.371
78 HD3 ARG 12 HD3 ARG 12 15.763 -3.215 11.669
79 HE ARG 12 HE ARG 12 14.293 -2.555 14.011
80 HH11 ARG 12 HH11 ARG 12 17.342 -4.250 13.107
81 HH12 ARG 12 HH12 ARG 12 18.120 -3.799 14.618
82 HH21 ARG 12 HH21 ARG 12 15.373 -2.027 15.908
83 HH22 ARG 12 HH22 ARG 12 17.033 -2.565 16.177
84 H GLY 13 H GLY 13 8.890 -2.532 13.315
85 HA2 GLY 13 HA3 GLY 13 8.475 -0.935 14.947
86 HA3 GLY 13 HA2 GLY 13 9.942 -1.580 15.699
87 H ASP 14 H ASP 14 8.801 0.870 13.206
88 HA ASP 14 HA ASP 14 10.449 2.779 14.598
89 HB2 ASP 14 HB2 ASP 14 12.075 1.471 12.930
90 HB3 ASP 14 HB3 ASP 14 11.359 2.502 11.686
91 H THR 15 H THR 15 9.024 2.413 11.223
92 HA THR 15 HA THR 15 6.921 4.244 11.778
93 HB THR 15 HB THR 15 8.474 6.089 11.820
94 HG1 THR 15 HG1 THR 15 7.929 7.157 9.781
95 HG21 THR 15 HG21 THR 15 10.519 4.893 11.007
96 HG22 THR 15 HG22 THR 15 10.290 6.424 10.130
97 HG23 THR 15 HG23 THR 15 9.866 4.878 9.341
98 HA PRO 16 HA PRO 16 6.063 1.996 7.990
99 HB2 PRO 16 HB2 PRO 16 3.773 3.211 7.019
100 HB3 PRO 16 HB3 PRO 16 3.778 2.368 8.602
101 HG2 PRO 16 HG2 PRO 16 4.264 5.354 8.135
102 HG3 PRO 16 HG3 PRO 16 2.972 4.649 9.162
103 HD2 PRO 16 HD2 PRO 16 5.327 5.448 10.284
104 HD3 PRO 16 HD3 PRO 16 4.651 3.858 10.789
105 H ILE 17 H ILE 17 5.963 2.266 5.523
106 HA ILE 17 HA ILE 17 6.954 4.931 4.587
107 HB ILE 17 HB ILE 17 8.221 2.299 3.685
108 HG12 ILE 17 HG12 ILE 17 9.286 4.138 5.913
109 HG13 ILE 17 HG13 ILE 17 8.689 2.468 6.114
110 HG21 ILE 17 HG21 ILE 17 8.388 4.551 2.276
111 HG22 ILE 17 HG22 ILE 17 9.424 5.138 3.589
112 HG23 ILE 17 HG23 ILE 17 9.900 3.707 2.625
113 HD11 ILE 17 HD11 ILE 17 11.208 3.251 4.506
114 HD12 ILE 17 HD12 ILE 17 11.153 2.496 6.102
115 HD13 ILE 17 HD13 ILE 17 10.543 1.596 4.680
116 H SER 18 H SER 18 4.274 4.064 4.417
117 HA SER 18 HA SER 18 3.729 4.365 1.717
118 HB2 SER 18 HB2 SER 18 2.922 1.953 1.141
119 HB3 SER 18 HB3 SER 18 4.650 2.219 0.990
120 HG SER 18 HG SER 18 3.436 1.028 3.302
121 H PHE 19 H PHE 19 1.369 4.116 1.214
122 HA PHE 19 HA PHE 19 -0.310 3.163 3.453
123 HB2 PHE 19 HB2 PHE 19 -0.516 6.009 2.293
124 HB3 PHE 19 HB3 PHE 19 -1.583 5.325 3.531
125 HD1 PHE 19 HD2 PHE 19 1.948 6.340 2.733
126 HD2 PHE 19 HD1 PHE 19 -0.893 5.522 5.864
127 HE1 PHE 19 HE2 PHE 19 3.615 7.021 4.424
128 HE2 PHE 19 HE1 PHE 19 0.768 6.235 7.552
129 HZ PHE 19 HZ PHE 19 3.008 7.035 6.832
130 H TYR 20 H TYR 20 -2.799 3.468 2.701
131 HA TYR 20 HA TYR 20 -2.983 1.491 0.676
132 HB2 TYR 20 HB2 TYR 20 -5.068 3.529 1.661
133 HB3 TYR 20 HB3 TYR 20 -5.454 2.155 0.594
134 HD1 TYR 20 HD1 TYR 20 -2.999 1.029 3.050
135 HD2 TYR 20 HD2 TYR 20 -7.164 1.986 2.524
136 HE1 TYR 20 HE1 TYR 20 -3.571 -0.510 4.852
137 HE2 TYR 20 HE2 TYR 20 -7.735 0.448 4.371
138 HH TYR 20 HH TYR 20 -5.311 -1.457 6.175
139 H GLY 21 H GLY 21 -4.379 1.787 -1.487
140 HA2 GLY 21 HA3 GLY 21 -3.012 3.730 -3.131
141 HA3 GLY 21 HA2 GLY 21 -4.465 2.817 -3.603
Start of MODEL 5
1 H1 GLY 1 H GLY 1 2.304 -0.267 0.986
2 HA2 GLY 1 HA3 GLY 1 3.049 -0.635 -1.182
3 HA3 GLY 1 HA2 GLY 1 1.555 -1.558 -1.466
4 H GLY 2 H GLY 2 1.504 1.927 -0.398
5 HA2 GLY 2 HA3 GLY 2 1.417 2.984 -3.091
6 HA3 GLY 2 HA2 GLY 2 -0.222 2.703 -2.433
7 H ALA 3 H ALA 3 -0.779 5.037 -2.167
8 HA ALA 3 HA ALA 3 0.727 6.352 0.055
9 HB1 ALA 3 HB1 ALA 3 1.083 8.394 -1.294
10 HB2 ALA 3 HB2 ALA 3 1.905 6.992 -2.042
11 HB3 ALA 3 HB3 ALA 3 0.362 7.590 -2.726
12 H GLY 4 H GLY 4 -1.852 5.212 0.260
13 HA2 GLY 4 HA3 GLY 4 -3.796 7.431 -0.107
14 HA3 GLY 4 HA2 GLY 4 -4.132 5.756 0.361
15 H HIS 5 H HIS 5 -5.287 6.246 2.349
16 HA HIS 5 HA HIS 5 -4.033 8.174 4.224
17 HB2 HIS 5 HB2 HIS 5 -6.808 6.930 3.979
18 HB3 HIS 5 HB3 HIS 5 -6.212 7.285 5.603
19 HD1 HIS 5 HD1 HIS 5 -7.345 9.339 6.240
20 HD2 HIS 5 HD2 HIS 5 -5.694 9.527 2.375
21 HE1 HIS 5 HE1 HIS 5 -7.658 11.725 5.484
22 H VAL 6 H VAL 6 -4.649 4.563 4.114
23 HA VAL 6 HA VAL 6 -3.968 4.537 7.009
24 HB VAL 6 HB VAL 6 -5.075 2.382 5.178
25 HG11 VAL 6 HG11 VAL 6 -4.920 2.405 8.253
26 HG12 VAL 6 HG12 VAL 6 -5.645 1.129 7.249
27 HG13 VAL 6 HG13 VAL 6 -3.887 1.405 7.184
28 HG21 VAL 6 HG21 VAL 6 -7.265 2.839 6.316
29 HG22 VAL 6 HG22 VAL 6 -6.517 4.191 7.215
30 HG23 VAL 6 HG23 VAL 6 -6.697 4.280 5.442
31 HA PRO 7 HA PRO 7 0.108 3.168 5.634
32 HB2 PRO 7 HB2 PRO 7 1.190 1.994 7.907
33 HB3 PRO 7 HB3 PRO 7 0.973 3.757 7.681
34 HG2 PRO 7 HG2 PRO 7 -0.969 1.866 9.081
35 HG3 PRO 7 HG3 PRO 7 -0.292 3.408 9.717
36 HD2 PRO 7 HD2 PRO 7 -2.753 3.373 8.628
37 HD3 PRO 7 HD3 PRO 7 -1.647 4.728 8.172
38 H GLU 8 H GLU 8 1.010 1.180 4.629
39 HA GLU 8 HA GLU 8 -0.835 -1.137 4.696
40 HB2 GLU 8 HB2 GLU 8 1.791 -0.756 3.178
41 HB3 GLU 8 HB3 GLU 8 0.692 -2.157 3.027
42 HG2 GLU 8 HG2 GLU 8 -1.147 -0.652 2.264
43 HG3 GLU 8 HG3 GLU 8 -0.041 0.744 2.345
44 H TYR 9 H TYR 9 2.719 -0.442 5.436
45 HA TYR 9 HA TYR 9 2.551 -2.477 7.591
46 HB2 TYR 9 HB2 TYR 9 4.532 -3.724 6.596
47 HB3 TYR 9 HB3 TYR 9 3.085 -3.809 5.574
48 HD1 TYR 9 HD2 TYR 9 6.366 -2.004 6.029
49 HD2 TYR 9 HD1 TYR 9 3.148 -2.917 3.319
50 HE1 TYR 9 HE2 TYR 9 7.653 -1.028 4.157
51 HE2 TYR 9 HE1 TYR 9 4.412 -1.904 1.465
52 HH TYR 9 HH TYR 9 6.518 -0.984 0.777
53 H PHE 10 H PHE 10 4.858 -2.592 8.714
54 HA PHE 10 HA PHE 10 5.944 0.213 8.788
55 HB2 PHE 10 HB2 PHE 10 5.244 -1.692 11.104
56 HB3 PHE 10 HB3 PHE 10 6.116 -0.163 11.311
57 HD1 PHE 10 HD1 PHE 10 2.849 -1.589 10.075
58 HD2 PHE 10 HD2 PHE 10 4.929 1.962 11.350
59 HE1 PHE 10 HE1 PHE 10 0.693 -0.399 10.303
60 HE2 PHE 10 HE2 PHE 10 2.753 3.076 11.760
61 HZ PHE 10 HZ PHE 10 0.635 1.864 11.329
62 H VAL 11 H VAL 11 8.123 0.264 9.986
63 HA VAL 11 HA VAL 11 9.763 -1.973 8.868
64 HB VAL 11 HB VAL 11 11.666 -0.561 9.022
65 HG11 VAL 11 HG11 VAL 11 9.973 0.140 7.258
66 HG12 VAL 11 HG12 VAL 11 9.417 1.417 8.381
67 HG13 VAL 11 HG13 VAL 11 11.087 1.437 7.773
68 HG21 VAL 11 HG21 VAL 11 10.100 1.246 10.943
69 HG22 VAL 11 HG22 VAL 11 11.524 0.270 11.350
70 HG23 VAL 11 HG23 VAL 11 11.690 1.626 10.216
71 H ARG 12 H ARG 12 11.852 -2.124 10.770
72 HA ARG 12 HA ARG 12 10.507 -3.546 12.936
73 HB2 ARG 12 HB2 ARG 12 13.447 -2.763 12.554
74 HB3 ARG 12 HB3 ARG 12 12.824 -3.829 13.842
75 HG2 ARG 12 HG2 ARG 12 12.022 -5.483 12.177
76 HG3 ARG 12 HG3 ARG 12 12.501 -4.424 10.827
77 HD2 ARG 12 HD2 ARG 12 14.878 -4.543 11.542
78 HD3 ARG 12 HD3 ARG 12 14.420 -5.664 12.875
79 HE ARG 12 HE ARG 12 13.421 -6.749 10.428
80 HH11 ARG 12 HH11 ARG 12 16.597 -6.063 11.988
81 HH12 ARG 12 HH12 ARG 12 17.391 -7.354 11.096
82 HH21 ARG 12 HH21 ARG 12 14.528 -8.379 9.341
83 HH22 ARG 12 HH22 ARG 12 16.248 -8.645 9.633
84 H GLY 13 H GLY 13 9.093 -1.558 13.573
85 HA2 GLY 13 HA3 GLY 13 8.652 -0.089 15.318
86 HA3 GLY 13 HA2 GLY 13 10.183 -0.620 16.027
87 H ASP 14 H ASP 14 8.809 1.646 13.472
88 HA ASP 14 HA ASP 14 10.329 3.718 14.763
89 HB2 ASP 14 HB2 ASP 14 12.034 2.535 13.082
90 HB3 ASP 14 HB3 ASP 14 11.189 3.458 11.829
91 H THR 15 H THR 15 8.889 3.186 11.423
92 HA THR 15 HA THR 15 6.625 4.820 11.979
93 HB THR 15 HB THR 15 7.720 6.512 9.946
94 HG1 THR 15 HG1 THR 15 9.873 5.647 10.424
95 HG21 THR 15 HG21 THR 15 7.801 7.178 12.947
96 HG22 THR 15 HG22 THR 15 6.371 7.347 11.898
97 HG23 THR 15 HG23 THR 15 7.841 8.305 11.576
98 HA PRO 16 HA PRO 16 5.875 2.476 8.252
99 HB2 PRO 16 HB2 PRO 16 3.582 3.562 7.181
100 HB3 PRO 16 HB3 PRO 16 3.578 2.888 8.841
101 HG2 PRO 16 HG2 PRO 16 4.019 5.817 8.078
102 HG3 PRO 16 HG3 PRO 16 2.755 5.199 9.184
103 HD2 PRO 16 HD2 PRO 16 5.176 6.149 10.136
104 HD3 PRO 16 HD3 PRO 16 4.440 4.688 10.899
105 H ILE 17 H ILE 17 6.173 2.474 5.865
106 HA ILE 17 HA ILE 17 7.145 5.116 4.785
107 HB ILE 17 HB ILE 17 8.108 2.321 4.019
108 HG12 ILE 17 HG12 ILE 17 8.662 2.491 6.375
109 HG13 ILE 17 HG13 ILE 17 10.122 2.613 5.390
110 HG21 ILE 17 HG21 ILE 17 8.755 3.868 2.265
111 HG22 ILE 17 HG22 ILE 17 9.219 5.131 3.426
112 HG23 ILE 17 HG23 ILE 17 10.201 3.655 3.245
113 HD11 ILE 17 HD11 ILE 17 8.788 4.790 7.082
114 HD12 ILE 17 HD12 ILE 17 10.480 4.265 7.048
115 HD13 ILE 17 HD13 ILE 17 9.838 5.266 5.723
116 H SER 18 H SER 18 4.290 3.557 4.678
117 HA SER 18 HA SER 18 3.945 4.084 1.835
118 HB2 SER 18 HB2 SER 18 3.650 1.168 2.832
119 HB3 SER 18 HB3 SER 18 3.471 1.769 1.153
120 HG SER 18 HG SER 18 5.816 2.169 1.267
121 H PHE 19 H PHE 19 1.569 3.791 1.201
122 HA PHE 19 HA PHE 19 -0.225 3.036 3.428
123 HB2 PHE 19 HB2 PHE 19 -0.404 5.775 2.045
124 HB3 PHE 19 HB3 PHE 19 -1.505 5.174 3.297
125 HD1 PHE 19 HD1 PHE 19 2.030 6.184 2.530
126 HD2 PHE 19 HD2 PHE 19 -0.896 5.546 5.628
127 HE1 PHE 19 HE1 PHE 19 3.596 7.111 4.202
128 HE2 PHE 19 HE2 PHE 19 0.664 6.499 7.293
129 HZ PHE 19 HZ PHE 19 2.883 7.358 6.569
130 H TYR 20 H TYR 20 -2.671 3.246 2.599
131 HA TYR 20 HA TYR 20 -2.761 1.127 0.708
132 HB2 TYR 20 HB2 TYR 20 -4.923 3.165 1.556
133 HB3 TYR 20 HB3 TYR 20 -5.266 1.727 0.567
134 HD1 TYR 20 HD1 TYR 20 -2.797 0.831 3.116
135 HD2 TYR 20 HD2 TYR 20 -6.990 1.567 2.455
136 HE1 TYR 20 HE1 TYR 20 -3.340 -0.630 4.989
137 HE2 TYR 20 HE2 TYR 20 -7.530 0.106 4.372
138 HH TYR 20 HH TYR 20 -5.069 -1.592 6.324
139 H GLY 21 H GLY 21 -4.199 1.295 -1.492
140 HA2 GLY 21 HA3 GLY 21 -2.761 3.085 -3.238
141 HA3 GLY 21 HA2 GLY 21 -4.236 2.184 -3.657
Start of MODEL 6
1 H1 GLY 1 H GLY 1 2.488 -0.365 0.875
2 HA2 GLY 1 HA3 GLY 1 3.121 -0.389 -1.357
3 HA3 GLY 1 HA2 GLY 1 1.674 -1.399 -1.596
4 H GLY 2 H GLY 2 1.674 2.094 -0.444
5 HA2 GLY 2 HA3 GLY 2 1.268 3.212 -3.055
6 HA3 GLY 2 HA2 GLY 2 -0.309 2.815 -2.306
7 H ALA 3 H ALA 3 -0.917 5.146 -2.033
8 HA ALA 3 HA ALA 3 0.546 6.451 0.219
9 HB1 ALA 3 HB1 ALA 3 0.825 8.539 -1.090
10 HB2 ALA 3 HB2 ALA 3 1.697 7.188 -1.874
11 HB3 ALA 3 HB3 ALA 3 0.129 7.740 -2.536
12 H GLY 4 H GLY 4 -1.971 5.223 0.426
13 HA2 GLY 4 HA3 GLY 4 -4.003 7.381 0.136
14 HA3 GLY 4 HA2 GLY 4 -4.272 5.681 0.560
15 H HIS 5 H HIS 5 -5.411 6.101 2.594
16 HA HIS 5 HA HIS 5 -4.163 7.997 4.498
17 HB2 HIS 5 HB2 HIS 5 -6.877 6.572 4.382
18 HB3 HIS 5 HB3 HIS 5 -6.229 7.069 5.946
19 HD1 HIS 5 HD1 HIS 5 -7.728 8.581 2.936
20 HD2 HIS 5 HD2 HIS 5 -5.680 9.679 6.439
21 HE1 HIS 5 HE1 HIS 5 -8.132 11.071 3.221
22 H VAL 6 H VAL 6 -4.716 4.366 4.316
23 HA VAL 6 HA VAL 6 -3.945 4.295 7.171
24 HB VAL 6 HB VAL 6 -4.989 2.133 5.310
25 HG11 VAL 6 HG11 VAL 6 -5.443 0.784 7.356
26 HG12 VAL 6 HG12 VAL 6 -3.706 1.149 7.267
27 HG13 VAL 6 HG13 VAL 6 -4.765 2.066 8.380
28 HG21 VAL 6 HG21 VAL 6 -7.172 2.446 6.512
29 HG22 VAL 6 HG22 VAL 6 -6.460 3.802 7.433
30 HG23 VAL 6 HG23 VAL 6 -6.695 3.937 5.671
31 HA PRO 7 HA PRO 7 0.181 3.128 5.724
32 HB2 PRO 7 HB2 PRO 7 1.316 1.915 7.954
33 HB3 PRO 7 HB3 PRO 7 1.058 3.673 7.776
34 HG2 PRO 7 HG2 PRO 7 -0.821 1.704 9.150
35 HG3 PRO 7 HG3 PRO 7 -0.191 3.252 9.810
36 HD2 PRO 7 HD2 PRO 7 -2.656 3.162 8.743
37 HD3 PRO 7 HD3 PRO 7 -1.608 4.559 8.297
38 H GLU 8 H GLU 8 1.152 1.228 4.647
39 HA GLU 8 HA GLU 8 -0.593 -1.159 4.623
40 HB2 GLU 8 HB2 GLU 8 2.010 -0.597 3.117
41 HB3 GLU 8 HB3 GLU 8 0.984 -2.044 2.911
42 HG2 GLU 8 HG2 GLU 8 -0.937 -0.590 2.222
43 HG3 GLU 8 HG3 GLU 8 0.112 0.840 2.372
44 H TYR 9 H TYR 9 2.927 -0.366 5.382
45 HA TYR 9 HA TYR 9 2.837 -2.472 7.459
46 HB2 TYR 9 HB2 TYR 9 4.854 -3.624 6.409
47 HB3 TYR 9 HB3 TYR 9 3.399 -3.733 5.412
48 HD1 TYR 9 HD2 TYR 9 6.599 -1.785 5.877
49 HD2 TYR 9 HD1 TYR 9 3.427 -2.810 3.161
50 HE1 TYR 9 HE2 TYR 9 7.836 -0.725 4.021
51 HE2 TYR 9 HE1 TYR 9 4.663 -1.765 1.315
52 HH TYR 9 HH TYR 9 6.670 -0.669 0.646
53 H PHE 10 H PHE 10 5.151 -2.557 8.564
54 HA PHE 10 HA PHE 10 6.147 0.269 8.748
55 HB2 PHE 10 HB2 PHE 10 5.491 -1.754 10.979
56 HB3 PHE 10 HB3 PHE 10 6.343 -0.231 11.258
57 HD1 PHE 10 HD1 PHE 10 3.087 -1.660 10.003
58 HD2 PHE 10 HD2 PHE 10 5.131 1.905 11.275
59 HE1 PHE 10 HE1 PHE 10 0.915 -0.515 10.301
60 HE2 PHE 10 HE2 PHE 10 2.947 2.993 11.710
61 HZ PHE 10 HZ PHE 10 0.841 1.735 11.348
62 H VAL 11 H VAL 11 8.317 0.326 9.980
63 HA VAL 11 HA VAL 11 10.040 -1.803 8.772
64 HB VAL 11 HB VAL 11 11.875 -0.300 8.986
65 HG11 VAL 11 HG11 VAL 11 11.201 1.739 7.859
66 HG12 VAL 11 HG12 VAL 11 10.257 0.380 7.189
67 HG13 VAL 11 HG13 VAL 11 9.495 1.540 8.311
68 HG21 VAL 11 HG21 VAL 11 11.698 0.464 11.333
69 HG22 VAL 11 HG22 VAL 11 11.771 1.877 10.267
70 HG23 VAL 11 HG23 VAL 11 10.212 1.355 10.963
71 H ARG 12 H ARG 12 12.149 -1.980 10.628
72 HA ARG 12 HA ARG 12 10.856 -3.307 12.875
73 HB2 ARG 12 HB2 ARG 12 13.824 -2.601 12.513
74 HB3 ARG 12 HB3 ARG 12 13.091 -3.662 13.736
75 HG2 ARG 12 HG2 ARG 12 12.055 -4.808 11.412
76 HG3 ARG 12 HG3 ARG 12 13.564 -4.172 10.764
77 HD2 ARG 12 HD2 ARG 12 14.887 -5.403 12.416
78 HD3 ARG 12 HD3 ARG 12 13.478 -6.000 13.281
79 HE ARG 12 HE ARG 12 14.612 -7.045 10.804
80 HH11 ARG 12 HH11 ARG 12 11.466 -6.713 12.583
81 HH12 ARG 12 HH12 ARG 12 10.778 -8.079 11.724
82 HH21 ARG 12 HH21 ARG 12 13.615 -8.781 9.796
83 HH22 ARG 12 HH22 ARG 12 11.958 -9.232 10.198
84 H GLY 13 H GLY 13 9.467 -1.349 13.504
85 HA2 GLY 13 HA3 GLY 13 9.056 0.115 15.258
86 HA3 GLY 13 HA2 GLY 13 10.615 -0.391 15.915
87 H ASP 14 H ASP 14 9.125 1.844 13.396
88 HA ASP 14 HA ASP 14 10.582 3.954 14.681
89 HB2 ASP 14 HB2 ASP 14 12.318 2.843 12.971
90 HB3 ASP 14 HB3 ASP 14 11.460 3.792 11.751
91 H THR 15 H THR 15 9.207 3.429 11.322
92 HA THR 15 HA THR 15 6.835 4.883 11.884
93 HB THR 15 HB THR 15 7.824 6.716 9.930
94 HG1 THR 15 HG1 THR 15 10.030 5.987 10.403
95 HG21 THR 15 HG21 THR 15 6.402 7.390 11.882
96 HG22 THR 15 HG22 THR 15 7.804 8.456 11.613
97 HG23 THR 15 HG23 THR 15 7.827 7.283 12.943
98 HA PRO 16 HA PRO 16 6.324 2.546 8.120
99 HB2 PRO 16 HB2 PRO 16 3.948 3.464 7.042
100 HB3 PRO 16 HB3 PRO 16 3.985 2.790 8.696
101 HG2 PRO 16 HG2 PRO 16 4.254 5.751 7.955
102 HG3 PRO 16 HG3 PRO 16 2.996 5.051 9.018
103 HD2 PRO 16 HD2 PRO 16 5.309 6.120 10.067
104 HD3 PRO 16 HD3 PRO 16 4.672 4.583 10.760
105 H ILE 17 H ILE 17 6.187 2.682 5.617
106 HA ILE 17 HA ILE 17 6.968 5.373 4.568
107 HB ILE 17 HB ILE 17 8.364 2.804 3.666
108 HG12 ILE 17 HG12 ILE 17 9.381 4.681 5.867
109 HG13 ILE 17 HG13 ILE 17 8.898 2.977 6.061
110 HG21 ILE 17 HG21 ILE 17 8.363 5.063 2.245
111 HG22 ILE 17 HG22 ILE 17 9.387 5.711 3.537
112 HG23 ILE 17 HG23 ILE 17 9.933 4.319 2.555
113 HD11 ILE 17 HD11 ILE 17 10.745 2.250 4.510
114 HD12 ILE 17 HD12 ILE 17 11.314 3.944 4.403
115 HD13 ILE 17 HD13 ILE 17 11.357 3.105 5.952
116 H SER 18 H SER 18 4.321 4.242 4.508
117 HA SER 18 HA SER 18 3.748 4.415 1.800
118 HB2 SER 18 HB2 SER 18 3.061 1.846 1.475
119 HB3 SER 18 HB3 SER 18 4.712 2.314 1.062
120 HG SER 18 HG SER 18 5.311 1.430 3.187
121 H PHE 19 H PHE 19 1.445 3.935 1.280
122 HA PHE 19 HA PHE 19 -0.212 3.032 3.529
123 HB2 PHE 19 HB2 PHE 19 -0.572 5.802 2.225
124 HB3 PHE 19 HB3 PHE 19 -1.614 5.132 3.482
125 HD1 PHE 19 HD1 PHE 19 1.845 6.354 2.665
126 HD2 PHE 19 HD2 PHE 19 -0.937 5.450 5.816
127 HE1 PHE 19 HE1 PHE 19 3.422 7.275 4.324
128 HE2 PHE 19 HE2 PHE 19 0.632 6.398 7.470
129 HZ PHE 19 HZ PHE 19 2.798 7.355 6.724
130 H TYR 20 H TYR 20 -2.703 3.161 2.736
131 HA TYR 20 HA TYR 20 -2.728 1.108 0.776
132 HB2 TYR 20 HB2 TYR 20 -4.959 3.022 1.716
133 HB3 TYR 20 HB3 TYR 20 -5.259 1.602 0.700
134 HD1 TYR 20 HD2 TYR 20 -2.714 0.702 3.166
135 HD2 TYR 20 HD1 TYR 20 -6.934 1.354 2.630
136 HE1 TYR 20 HE2 TYR 20 -3.177 -0.845 4.987
137 HE2 TYR 20 HE1 TYR 20 -7.395 -0.192 4.496
138 HH TYR 20 HH TYR 20 -4.845 -1.979 6.250
139 H GLY 21 H GLY 21 -4.229 1.301 -1.392
140 HA2 GLY 21 HA3 GLY 21 -3.877 3.980 -2.648
141 HA3 GLY 21 HA2 GLY 21 -3.018 2.590 -3.368
Start of MODEL 7
1 H1 GLY 1 H GLY 1 2.303 -0.074 0.739
2 HA2 GLY 1 HA3 GLY 1 2.918 -0.246 -1.494
3 HA3 GLY 1 HA2 GLY 1 1.458 -1.238 -1.721
4 H GLY 2 H GLY 2 1.491 2.229 -0.518
5 HA2 GLY 2 HA3 GLY 2 1.044 3.392 -3.108
6 HA3 GLY 2 HA2 GLY 2 -0.519 2.993 -2.334
7 H ALA 3 H ALA 3 -1.119 5.315 -1.995
8 HA ALA 3 HA ALA 3 0.403 6.572 0.243
9 HB1 ALA 3 HB1 ALA 3 0.675 8.682 -1.033
10 HB2 ALA 3 HB2 ALA 3 1.517 7.337 -1.859
11 HB3 ALA 3 HB3 ALA 3 -0.058 7.916 -2.479
12 H GLY 4 H GLY 4 -2.133 5.362 0.464
13 HA2 GLY 4 HA3 GLY 4 -4.132 7.557 0.255
14 HA3 GLY 4 HA2 GLY 4 -4.427 5.852 0.623
15 H HIS 5 H HIS 5 -5.450 6.055 2.714
16 HA HIS 5 HA HIS 5 -4.275 8.006 4.637
17 HB2 HIS 5 HB2 HIS 5 -7.007 6.707 4.305
18 HB3 HIS 5 HB3 HIS 5 -6.451 6.966 5.963
19 HD1 HIS 5 HD1 HIS 5 -6.140 9.172 2.874
20 HD2 HIS 5 HD2 HIS 5 -7.482 9.182 6.861
21 HE1 HIS 5 HE1 HIS 5 -6.934 11.539 3.334
22 H VAL 6 H VAL 6 -4.708 4.377 4.373
23 HA VAL 6 HA VAL 6 -3.957 4.270 7.251
24 HB VAL 6 HB VAL 6 -5.059 2.155 5.363
25 HG11 VAL 6 HG11 VAL 6 -4.785 2.049 8.431
26 HG12 VAL 6 HG12 VAL 6 -5.508 0.792 7.405
27 HG13 VAL 6 HG13 VAL 6 -3.764 1.125 7.287
28 HG21 VAL 6 HG21 VAL 6 -6.727 3.979 5.765
29 HG22 VAL 6 HG22 VAL 6 -7.221 2.485 6.592
30 HG23 VAL 6 HG23 VAL 6 -6.479 3.817 7.524
31 HA PRO 7 HA PRO 7 0.119 3.116 5.674
32 HB2 PRO 7 HB2 PRO 7 1.322 1.879 7.857
33 HB3 PRO 7 HB3 PRO 7 1.047 3.640 7.714
34 HG2 PRO 7 HG2 PRO 7 -0.783 1.634 9.105
35 HG3 PRO 7 HG3 PRO 7 -0.142 3.174 9.775
36 HD2 PRO 7 HD2 PRO 7 -2.639 3.087 8.770
37 HD3 PRO 7 HD3 PRO 7 -1.609 4.500 8.329
38 H GLU 8 H GLU 8 1.052 1.236 4.533
39 HA GLU 8 HA GLU 8 -0.687 -1.153 4.545
40 HB2 GLU 8 HB2 GLU 8 1.878 -0.638 2.962
41 HB3 GLU 8 HB3 GLU 8 0.788 -2.031 2.771
42 HG2 GLU 8 HG2 GLU 8 -1.089 -0.500 2.150
43 HG3 GLU 8 HG3 GLU 8 0.009 0.898 2.280
44 H TYR 9 H TYR 9 2.851 -0.363 5.219
45 HA TYR 9 HA TYR 9 2.816 -2.502 7.267
46 HB2 TYR 9 HB2 TYR 9 4.818 -3.630 6.159
47 HB3 TYR 9 HB3 TYR 9 3.335 -3.740 5.200
48 HD1 TYR 9 HD2 TYR 9 6.544 -1.792 5.581
49 HD2 TYR 9 HD1 TYR 9 3.269 -2.778 2.971
50 HE1 TYR 9 HE2 TYR 9 7.729 -0.739 3.698
51 HE2 TYR 9 HE1 TYR 9 4.445 -1.692 1.091
52 HH TYR 9 HH TYR 9 7.756 -0.399 1.327
53 H PHE 10 H PHE 10 5.136 -2.614 8.333
54 HA PHE 10 HA PHE 10 6.128 0.213 8.571
55 HB2 PHE 10 HB2 PHE 10 5.509 -1.879 10.746
56 HB3 PHE 10 HB3 PHE 10 6.366 -0.366 11.062
57 HD1 PHE 10 HD1 PHE 10 3.092 -1.750 9.818
58 HD2 PHE 10 HD2 PHE 10 5.171 1.779 11.135
59 HE1 PHE 10 HE1 PHE 10 0.929 -0.605 10.181
60 HE2 PHE 10 HE2 PHE 10 2.998 2.860 11.641
61 HZ PHE 10 HZ PHE 10 0.882 1.619 11.285
62 H VAL 11 H VAL 11 8.306 0.205 9.824
63 HA VAL 11 HA VAL 11 10.045 -1.739 8.354
64 HB VAL 11 HB VAL 11 11.820 -0.146 8.598
65 HG11 VAL 11 HG11 VAL 11 10.167 0.529 6.890
66 HG12 VAL 11 HG12 VAL 11 9.268 1.497 8.084
67 HG13 VAL 11 HG13 VAL 11 10.937 1.937 7.676
68 HG21 VAL 11 HG21 VAL 11 10.142 1.300 10.726
69 HG22 VAL 11 HG22 VAL 11 11.673 0.463 11.016
70 HG23 VAL 11 HG23 VAL 11 11.655 1.925 10.021
71 H ARG 12 H ARG 12 12.286 -1.810 10.131
72 HA ARG 12 HA ARG 12 11.273 -3.532 12.237
73 HB2 ARG 12 HB2 ARG 12 13.572 -3.657 10.998
74 HB3 ARG 12 HB3 ARG 12 14.069 -2.289 11.998
75 HG2 ARG 12 HG2 ARG 12 14.869 -4.121 13.270
76 HG3 ARG 12 HG3 ARG 12 13.277 -3.896 14.038
77 HD2 ARG 12 HD2 ARG 12 12.364 -5.732 12.511
78 HD3 ARG 12 HD3 ARG 12 14.010 -5.867 11.793
79 HE ARG 12 HE ARG 12 14.168 -6.212 14.646
80 HH11 ARG 12 HH11 ARG 12 13.016 -7.924 11.685
81 HH12 ARG 12 HH12 ARG 12 13.335 -9.501 12.392
82 HH21 ARG 12 HH21 ARG 12 14.516 -8.282 15.463
83 HH22 ARG 12 HH22 ARG 12 14.151 -9.707 14.487
84 H GLY 13 H GLY 13 9.673 -1.587 12.983
85 HA2 GLY 13 HA3 GLY 13 9.169 -0.232 14.801
86 HA3 GLY 13 HA2 GLY 13 10.725 -0.716 15.483
87 H ASP 14 H ASP 14 9.196 1.625 13.086
88 HA ASP 14 HA ASP 14 10.590 3.677 14.496
89 HB2 ASP 14 HB2 ASP 14 12.371 2.713 12.734
90 HB3 ASP 14 HB3 ASP 14 11.551 3.787 11.596
91 H THR 15 H THR 15 9.364 3.471 11.029
92 HA THR 15 HA THR 15 6.888 4.771 11.757
93 HB THR 15 HB THR 15 7.718 6.638 9.828
94 HG1 THR 15 HG1 THR 15 9.918 7.235 10.459
95 HG21 THR 15 HG21 THR 15 7.900 8.343 11.585
96 HG22 THR 15 HG22 THR 15 8.171 7.121 12.843
97 HG23 THR 15 HG23 THR 15 6.586 7.229 12.030
98 HA PRO 16 HA PRO 16 6.244 2.506 7.983
99 HB2 PRO 16 HB2 PRO 16 3.861 3.489 6.972
100 HB3 PRO 16 HB3 PRO 16 3.922 2.764 8.604
101 HG2 PRO 16 HG2 PRO 16 4.223 5.744 7.947
102 HG3 PRO 16 HG3 PRO 16 2.974 5.028 9.012
103 HD2 PRO 16 HD2 PRO 16 5.316 6.032 10.071
104 HD3 PRO 16 HD3 PRO 16 4.682 4.466 10.701
105 H ILE 17 H ILE 17 6.145 2.682 5.493
106 HA ILE 17 HA ILE 17 6.875 5.414 4.493
107 HB ILE 17 HB ILE 17 8.230 2.874 3.461
108 HG12 ILE 17 HG12 ILE 17 9.332 4.655 5.704
109 HG13 ILE 17 HG13 ILE 17 8.840 2.948 5.847
110 HG21 ILE 17 HG21 ILE 17 9.779 4.415 2.368
111 HG22 ILE 17 HG22 ILE 17 8.213 5.191 2.133
112 HG23 ILE 17 HG23 ILE 17 9.281 5.774 3.421
113 HD11 ILE 17 HD11 ILE 17 11.299 3.053 5.657
114 HD12 ILE 17 HD12 ILE 17 10.628 2.273 4.201
115 HD13 ILE 17 HD13 ILE 17 11.212 3.965 4.153
116 H SER 18 H SER 18 4.212 4.103 4.502
117 HA SER 18 HA SER 18 3.713 4.319 1.711
118 HB2 SER 18 HB2 SER 18 3.039 1.471 2.509
119 HB3 SER 18 HB3 SER 18 3.577 2.068 0.921
120 HG SER 18 HG SER 18 5.759 1.899 1.843
121 H PHE 19 H PHE 19 1.320 3.961 1.211
122 HA PHE 19 HA PHE 19 -0.321 3.123 3.478
123 HB2 PHE 19 HB2 PHE 19 -0.707 5.920 2.241
124 HB3 PHE 19 HB3 PHE 19 -1.732 5.213 3.492
125 HD1 PHE 19 HD1 PHE 19 1.713 6.463 2.663
126 HD2 PHE 19 HD2 PHE 19 -1.023 5.466 5.829
127 HE1 PHE 19 HE1 PHE 19 3.319 7.330 4.327
128 HE2 PHE 19 HE2 PHE 19 0.578 6.355 7.487
129 HZ PHE 19 HZ PHE 19 2.735 7.331 6.737
130 H TYR 20 H TYR 20 -2.821 3.228 2.749
131 HA TYR 20 HA TYR 20 -2.846 1.202 0.761
132 HB2 TYR 20 HB2 TYR 20 -5.110 3.044 1.745
133 HB3 TYR 20 HB3 TYR 20 -5.373 1.624 0.716
134 HD1 TYR 20 HD2 TYR 20 -2.797 0.778 3.160
135 HD2 TYR 20 HD1 TYR 20 -7.034 1.327 2.671
136 HE1 TYR 20 HE2 TYR 20 -3.201 -0.770 4.994
137 HE2 TYR 20 HE1 TYR 20 -7.436 -0.212 4.556
138 HH TYR 20 HH TYR 20 -4.826 -1.836 6.372
139 H GLY 21 H GLY 21 -4.299 1.368 -1.407
140 HA2 GLY 21 HA3 GLY 21 -4.783 3.843 -2.576
141 HA3 GLY 21 HA2 GLY 21 -3.099 3.468 -3.024
Start of MODEL 8
1 H1 GLY 1 H GLY 1 2.285 -0.048 0.738
2 HA2 GLY 1 HA3 GLY 1 2.947 -0.299 -1.471
3 HA3 GLY 1 HA2 GLY 1 1.388 -1.096 -1.780
4 H GLY 2 H GLY 2 1.746 2.301 -0.478
5 HA2 GLY 2 HA3 GLY 2 1.617 3.574 -3.032
6 HA3 GLY 2 HA2 GLY 2 -0.040 3.330 -2.405
7 H ALA 3 H ALA 3 -0.484 5.640 -1.999
8 HA ALA 3 HA ALA 3 0.974 6.690 0.383
9 HB1 ALA 3 HB1 ALA 3 2.236 7.495 -1.635
10 HB2 ALA 3 HB2 ALA 3 0.723 8.188 -2.289
11 HB3 ALA 3 HB3 ALA 3 1.432 8.843 -0.780
12 H GLY 4 H GLY 4 -1.624 5.600 0.396
13 HA2 GLY 4 HA3 GLY 4 -3.506 7.885 0.181
14 HA3 GLY 4 HA2 GLY 4 -3.885 6.189 0.516
15 H HIS 5 H HIS 5 -5.024 6.472 2.531
16 HA HIS 5 HA HIS 5 -3.804 8.284 4.554
17 HB2 HIS 5 HB2 HIS 5 -6.598 7.236 4.040
18 HB3 HIS 5 HB3 HIS 5 -6.124 7.339 5.740
19 HD1 HIS 5 HD1 HIS 5 -5.420 9.709 2.844
20 HD2 HIS 5 HD2 HIS 5 -7.080 9.566 6.705
21 HE1 HIS 5 HE1 HIS 5 -6.062 12.092 3.403
22 H VAL 6 H VAL 6 -4.504 4.712 4.185
23 HA VAL 6 HA VAL 6 -3.904 4.455 7.084
24 HB VAL 6 HB VAL 6 -5.006 2.471 5.064
25 HG11 VAL 6 HG11 VAL 6 -4.905 2.232 8.131
26 HG12 VAL 6 HG12 VAL 6 -5.627 1.061 7.003
27 HG13 VAL 6 HG13 VAL 6 -3.864 1.317 6.995
28 HG21 VAL 6 HG21 VAL 6 -6.592 4.369 5.457
29 HG22 VAL 6 HG22 VAL 6 -7.207 2.870 6.191
30 HG23 VAL 6 HG23 VAL 6 -6.458 4.125 7.220
31 HA PRO 7 HA PRO 7 0.186 3.128 5.682
32 HB2 PRO 7 HB2 PRO 7 1.197 1.777 7.885
33 HB3 PRO 7 HB3 PRO 7 1.013 3.556 7.786
34 HG2 PRO 7 HG2 PRO 7 -0.978 1.593 8.994
35 HG3 PRO 7 HG3 PRO 7 -0.297 3.069 9.769
36 HD2 PRO 7 HD2 PRO 7 -2.737 3.161 8.614
37 HD3 PRO 7 HD3 PRO 7 -1.599 4.529 8.299
38 H GLU 8 H GLU 8 1.058 1.231 4.539
39 HA GLU 8 HA GLU 8 -0.762 -1.112 4.471
40 HB2 GLU 8 HB2 GLU 8 1.801 -0.570 2.898
41 HB3 GLU 8 HB3 GLU 8 0.724 -1.977 2.679
42 HG2 GLU 8 HG2 GLU 8 -1.158 -0.453 2.089
43 HG3 GLU 8 HG3 GLU 8 -0.072 0.951 2.234
44 H TYR 9 H TYR 9 2.793 -0.393 5.118
45 HA TYR 9 HA TYR 9 2.874 -2.917 6.754
46 HB2 TYR 9 HB2 TYR 9 4.986 -1.850 4.784
47 HB3 TYR 9 HB3 TYR 9 5.077 -3.376 5.688
48 HD1 TYR 9 HD2 TYR 9 3.137 -5.106 5.329
49 HD2 TYR 9 HD1 TYR 9 4.007 -1.926 2.568
50 HE1 TYR 9 HE2 TYR 9 1.968 -6.334 3.544
51 HE2 TYR 9 HE1 TYR 9 2.777 -3.120 0.799
52 HH TYR 9 HH TYR 9 1.369 -6.372 1.232
53 H PHE 10 H PHE 10 5.035 -2.906 8.085
54 HA PHE 10 HA PHE 10 5.748 -0.111 8.913
55 HB2 PHE 10 HB2 PHE 10 4.819 -2.470 10.658
56 HB3 PHE 10 HB3 PHE 10 5.698 -1.080 11.313
57 HD1 PHE 10 HD1 PHE 10 2.523 -2.092 9.593
58 HD2 PHE 10 HD2 PHE 10 4.665 1.171 11.399
59 HE1 PHE 10 HE1 PHE 10 0.393 -0.868 9.920
60 HE2 PHE 10 HE2 PHE 10 2.525 2.360 11.783
61 HZ PHE 10 HZ PHE 10 0.378 1.256 11.209
62 H VAL 11 H VAL 11 7.735 -0.263 10.446
63 HA VAL 11 HA VAL 11 9.693 -2.071 9.049
64 HB VAL 11 HB VAL 11 11.347 -0.385 9.397
65 HG11 VAL 11 HG11 VAL 11 8.736 1.120 8.753
66 HG12 VAL 11 HG12 VAL 11 10.391 1.680 8.448
67 HG13 VAL 11 HG13 VAL 11 9.770 0.230 7.606
68 HG21 VAL 11 HG21 VAL 11 10.934 1.682 10.817
69 HG22 VAL 11 HG22 VAL 11 9.465 0.888 11.455
70 HG23 VAL 11 HG23 VAL 11 11.064 0.205 11.780
71 H ARG 12 H ARG 12 11.750 -2.013 11.035
72 HA ARG 12 HA ARG 12 10.571 -3.746 13.091
73 HB2 ARG 12 HB2 ARG 12 13.386 -2.581 12.792
74 HB3 ARG 12 HB3 ARG 12 12.918 -3.836 13.960
75 HG2 ARG 12 HG2 ARG 12 12.414 -5.454 12.217
76 HG3 ARG 12 HG3 ARG 12 12.549 -4.258 10.912
77 HD2 ARG 12 HD2 ARG 12 14.869 -5.090 12.720
78 HD3 ARG 12 HD3 ARG 12 14.552 -5.747 11.076
79 HE ARG 12 HE ARG 12 14.656 -2.927 10.804
80 HH11 ARG 12 HH11 ARG 12 16.873 -5.637 11.653
81 HH12 ARG 12 HH12 ARG 12 18.280 -4.756 11.071
82 HH21 ARG 12 HH21 ARG 12 16.515 -1.880 10.099
83 HH22 ARG 12 HH22 ARG 12 18.087 -2.677 10.202
84 H GLY 13 H GLY 13 8.952 -1.763 13.624
85 HA2 GLY 13 HA3 GLY 13 8.310 -0.363 15.360
86 HA3 GLY 13 HA2 GLY 13 9.763 -0.912 16.203
87 H ASP 14 H ASP 14 8.576 1.524 13.731
88 HA ASP 14 HA ASP 14 9.972 3.503 15.229
89 HB2 ASP 14 HB2 ASP 14 11.843 2.351 13.648
90 HB3 ASP 14 HB3 ASP 14 11.202 3.451 12.426
91 H THR 15 H THR 15 8.996 3.119 11.700
92 HA THR 15 HA THR 15 6.634 4.686 12.099
93 HB THR 15 HB THR 15 7.996 6.661 12.217
94 HG1 THR 15 HG1 THR 15 7.456 7.653 10.128
95 HG21 THR 15 HG21 THR 15 9.855 7.169 10.631
96 HG22 THR 15 HG22 THR 15 9.648 5.581 9.842
97 HG23 THR 15 HG23 THR 15 10.199 5.680 11.543
98 HA PRO 16 HA PRO 16 6.271 2.222 8.357
99 HB2 PRO 16 HB2 PRO 16 3.923 3.163 7.202
100 HB3 PRO 16 HB3 PRO 16 3.920 2.361 8.804
101 HG2 PRO 16 HG2 PRO 16 4.117 5.370 8.287
102 HG3 PRO 16 HG3 PRO 16 2.845 4.551 9.250
103 HD2 PRO 16 HD2 PRO 16 5.006 5.609 10.516
104 HD3 PRO 16 HD3 PRO 16 4.482 3.948 10.989
105 H ILE 17 H ILE 17 6.166 2.469 5.825
106 HA ILE 17 HA ILE 17 7.128 5.171 4.944
107 HB ILE 17 HB ILE 17 8.405 2.586 3.948
108 HG12 ILE 17 HG12 ILE 17 9.432 4.224 6.348
109 HG13 ILE 17 HG13 ILE 17 8.809 2.554 6.387
110 HG21 ILE 17 HG21 ILE 17 10.140 4.038 3.067
111 HG22 ILE 17 HG22 ILE 17 8.647 4.903 2.702
112 HG23 ILE 17 HG23 ILE 17 9.622 5.411 4.092
113 HD11 ILE 17 HD11 ILE 17 11.275 2.475 6.411
114 HD12 ILE 17 HD12 ILE 17 10.685 1.822 4.861
115 HD13 ILE 17 HD13 ILE 17 11.389 3.467 4.958
116 H SER 18 H SER 18 4.413 4.118 4.700
117 HA SER 18 HA SER 18 4.002 4.443 1.923
118 HB2 SER 18 HB2 SER 18 3.298 2.005 1.388
119 HB3 SER 18 HB3 SER 18 5.047 2.259 1.436
120 HG SER 18 HG SER 18 4.430 0.435 2.805
121 H PHE 19 H PHE 19 1.671 4.112 1.311
122 HA PHE 19 HA PHE 19 -0.102 3.189 3.469
123 HB2 PHE 19 HB2 PHE 19 -0.284 6.024 2.296
124 HB3 PHE 19 HB3 PHE 19 -1.390 5.348 3.498
125 HD1 PHE 19 HD1 PHE 19 2.147 6.423 2.832
126 HD2 PHE 19 HD2 PHE 19 -0.772 5.519 5.862
127 HE1 PHE 19 HE1 PHE 19 3.730 7.157 4.578
128 HE2 PHE 19 HE2 PHE 19 0.801 6.295 7.603
129 HZ PHE 19 HZ PHE 19 3.039 7.163 6.961
130 H TYR 20 H TYR 20 -2.562 3.508 2.622
131 HA TYR 20 HA TYR 20 -2.680 1.536 0.593
132 HB2 TYR 20 HB2 TYR 20 -4.785 3.566 1.561
133 HB3 TYR 20 HB3 TYR 20 -5.162 2.242 0.445
134 HD1 TYR 20 HD2 TYR 20 -2.766 1.051 2.959
135 HD2 TYR 20 HD1 TYR 20 -6.915 1.965 2.289
136 HE1 TYR 20 HE2 TYR 20 -3.389 -0.583 4.653
137 HE2 TYR 20 HE1 TYR 20 -7.542 0.338 4.036
138 HH TYR 20 HH TYR 20 -5.165 -1.707 5.762
139 H GLY 21 H GLY 21 -4.071 1.837 -1.584
140 HA2 GLY 21 HA3 GLY 21 -4.506 3.111 -3.522
141 HA3 GLY 21 HA2 GLY 21 -3.693 4.509 -2.789
Start of MODEL 9
1 H1 GLY 1 H GLY 1 2.126 0.143 0.556
2 HA2 GLY 1 HA3 GLY 1 2.723 -0.009 -1.686
3 HA3 GLY 1 HA2 GLY 1 1.204 -0.891 -1.954
4 H GLY 2 H GLY 2 1.491 2.511 -0.612
5 HA2 GLY 2 HA3 GLY 2 1.185 3.822 -3.134
6 HA3 GLY 2 HA2 GLY 2 -0.431 3.512 -2.428
7 H ALA 3 H ALA 3 -0.894 5.823 -1.948
8 HA ALA 3 HA ALA 3 0.667 6.843 0.385
9 HB1 ALA 3 HB1 ALA 3 1.827 7.702 -1.652
10 HB2 ALA 3 HB2 ALA 3 0.283 8.395 -2.235
11 HB3 ALA 3 HB3 ALA 3 1.045 9.026 -0.739
12 H GLY 4 H GLY 4 -1.916 5.725 0.508
13 HA2 GLY 4 HA3 GLY 4 -3.827 8.004 0.453
14 HA3 GLY 4 HA2 GLY 4 -4.181 6.291 0.744
15 H HIS 5 H HIS 5 -5.297 6.643 2.803
16 HA HIS 5 HA HIS 5 -3.919 8.268 4.854
17 HB2 HIS 5 HB2 HIS 5 -6.665 6.911 4.715
18 HB3 HIS 5 HB3 HIS 5 -5.957 7.336 6.281
19 HD1 HIS 5 HD1 HIS 5 -6.861 9.097 3.052
20 HD2 HIS 5 HD2 HIS 5 -6.087 9.794 7.125
21 HE1 HIS 5 HE1 HIS 5 -7.437 11.533 3.455
22 H VAL 6 H VAL 6 -4.729 4.707 4.387
23 HA VAL 6 HA VAL 6 -3.910 4.336 7.197
24 HB VAL 6 HB VAL 6 -5.067 2.389 5.170
25 HG11 VAL 6 HG11 VAL 6 -3.807 1.193 7.010
26 HG12 VAL 6 HG12 VAL 6 -4.812 2.050 8.221
27 HG13 VAL 6 HG13 VAL 6 -5.561 0.898 7.094
28 HG21 VAL 6 HG21 VAL 6 -6.682 4.231 5.718
29 HG22 VAL 6 HG22 VAL 6 -7.212 2.691 6.431
30 HG23 VAL 6 HG23 VAL 6 -6.436 3.931 7.460
31 HA PRO 7 HA PRO 7 0.156 3.103 5.625
32 HB2 PRO 7 HB2 PRO 7 1.258 1.731 7.765
33 HB3 PRO 7 HB3 PRO 7 1.032 3.506 7.712
34 HG2 PRO 7 HG2 PRO 7 -0.887 1.476 8.934
35 HG3 PRO 7 HG3 PRO 7 -0.201 2.942 9.725
36 HD2 PRO 7 HD2 PRO 7 -2.676 3.025 8.663
37 HD3 PRO 7 HD3 PRO 7 -1.573 4.417 8.332
38 H GLU 8 H GLU 8 1.000 1.253 4.402
39 HA GLU 8 HA GLU 8 -0.759 -1.137 4.367
40 HB2 GLU 8 HB2 GLU 8 1.739 -0.494 2.725
41 HB3 GLU 8 HB3 GLU 8 0.676 -1.913 2.498
42 HG2 GLU 8 HG2 GLU 8 -1.245 -0.423 2.004
43 HG3 GLU 8 HG3 GLU 8 -0.197 1.010 2.153
44 H TYR 9 H TYR 9 2.766 -0.275 5.015
45 HA TYR 9 HA TYR 9 3.003 -2.871 6.504
46 HB2 TYR 9 HB2 TYR 9 5.027 -1.638 4.526
47 HB3 TYR 9 HB3 TYR 9 5.167 -3.228 5.313
48 HD1 TYR 9 HD2 TYR 9 3.164 -4.908 4.915
49 HD2 TYR 9 HD1 TYR 9 4.072 -1.602 2.310
50 HE1 TYR 9 HE2 TYR 9 1.909 -6.000 3.098
51 HE2 TYR 9 HE1 TYR 9 2.809 -2.695 0.491
52 HH TYR 9 HH TYR 9 1.135 -5.828 0.841
53 H PHE 10 H PHE 10 5.256 -2.832 7.716
54 HA PHE 10 HA PHE 10 5.919 -0.047 8.601
55 HB2 PHE 10 HB2 PHE 10 5.141 -2.473 10.333
56 HB3 PHE 10 HB3 PHE 10 5.977 -1.058 10.995
57 HD1 PHE 10 HD1 PHE 10 2.788 -2.169 9.372
58 HD2 PHE 10 HD2 PHE 10 4.870 1.141 11.169
59 HE1 PHE 10 HE1 PHE 10 0.628 -1.019 9.771
60 HE2 PHE 10 HE2 PHE 10 2.703 2.252 11.628
61 HZ PHE 10 HZ PHE 10 0.577 1.092 11.079
62 H VAL 11 H VAL 11 7.979 -0.154 10.021
63 HA VAL 11 HA VAL 11 9.920 -1.907 8.528
64 HB VAL 11 HB VAL 11 11.574 -0.228 8.907
65 HG11 VAL 11 HG11 VAL 11 8.943 1.288 8.375
66 HG12 VAL 11 HG12 VAL 11 10.586 1.869 8.045
67 HG13 VAL 11 HG13 VAL 11 9.952 0.441 7.173
68 HG21 VAL 11 HG21 VAL 11 11.188 1.776 10.401
69 HG22 VAL 11 HG22 VAL 11 9.731 0.964 11.049
70 HG23 VAL 11 HG23 VAL 11 11.337 0.258 11.302
71 H ARG 12 H ARG 12 12.041 -1.961 10.455
72 HA ARG 12 HA ARG 12 10.836 -3.729 12.445
73 HB2 ARG 12 HB2 ARG 12 13.124 -4.000 11.267
74 HB3 ARG 12 HB3 ARG 12 13.758 -2.780 12.396
75 HG2 ARG 12 HG2 ARG 12 12.923 -4.327 14.322
76 HG3 ARG 12 HG3 ARG 12 12.415 -5.475 13.062
77 HD2 ARG 12 HD2 ARG 12 14.492 -6.349 13.680
78 HD3 ARG 12 HD3 ARG 12 14.903 -5.390 12.218
79 HE ARG 12 HE ARG 12 15.253 -3.783 14.594
80 HH11 ARG 12 HH11 ARG 12 16.732 -6.621 12.924
81 HH12 ARG 12 HH12 ARG 12 18.287 -6.348 13.696
82 HH21 ARG 12 HH21 ARG 12 17.280 -3.543 15.547
83 HH22 ARG 12 HH22 ARG 12 18.598 -4.647 15.146
84 H GLY 13 H GLY 13 9.341 -1.704 13.116
85 HA2 GLY 13 HA3 GLY 13 8.792 -0.449 14.986
86 HA3 GLY 13 HA2 GLY 13 10.314 -0.977 15.708
87 H ASP 14 H ASP 14 8.891 1.473 13.364
88 HA ASP 14 HA ASP 14 10.273 3.469 14.833
89 HB2 ASP 14 HB2 ASP 14 12.125 2.442 13.124
90 HB3 ASP 14 HB3 ASP 14 11.395 3.587 11.999
91 H THR 15 H THR 15 9.190 3.182 11.325
92 HA THR 15 HA THR 15 6.776 4.612 11.875
93 HB THR 15 HB THR 15 8.087 6.637 12.046
94 HG1 THR 15 HG1 THR 15 7.394 7.719 10.048
95 HG21 THR 15 HG21 THR 15 9.638 5.772 9.518
96 HG22 THR 15 HG22 THR 15 10.283 5.776 11.188
97 HG23 THR 15 HG23 THR 15 9.851 7.309 10.396
98 HA PRO 16 HA PRO 16 6.381 2.292 8.066
99 HB2 PRO 16 HB2 PRO 16 3.953 3.169 7.022
100 HB3 PRO 16 HB3 PRO 16 4.036 2.324 8.599
101 HG2 PRO 16 HG2 PRO 16 4.102 5.354 8.179
102 HG3 PRO 16 HG3 PRO 16 2.898 4.451 9.156
103 HD2 PRO 16 HD2 PRO 16 5.061 5.552 10.381
104 HD3 PRO 16 HD3 PRO 16 4.628 3.855 10.815
105 H ILE 17 H ILE 17 6.166 2.581 5.556
106 HA ILE 17 HA ILE 17 6.993 5.331 4.702
107 HB ILE 17 HB ILE 17 8.353 2.815 3.632
108 HG12 ILE 17 HG12 ILE 17 9.376 4.468 6.009
109 HG13 ILE 17 HG13 ILE 17 8.836 2.769 6.046
110 HG21 ILE 17 HG21 ILE 17 8.452 5.164 2.401
111 HG22 ILE 17 HG22 ILE 17 9.446 5.697 3.769
112 HG23 ILE 17 HG23 ILE 17 9.998 4.368 2.705
113 HD11 ILE 17 HD11 ILE 17 11.296 2.792 5.990
114 HD12 ILE 17 HD12 ILE 17 10.691 2.138 4.446
115 HD13 ILE 17 HD13 ILE 17 11.325 3.811 4.550
116 H SER 18 H SER 18 4.327 4.234 4.505
117 HA SER 18 HA SER 18 3.808 4.649 1.790
118 HB2 SER 18 HB2 SER 18 3.141 2.196 1.142
119 HB3 SER 18 HB3 SER 18 4.860 2.560 1.050
120 HG SER 18 HG SER 18 3.639 1.269 3.300
121 H PHE 19 H PHE 19 1.470 4.261 1.230
122 HA PHE 19 HA PHE 19 -0.203 3.221 3.427
123 HB2 PHE 19 HB2 PHE 19 -0.466 6.085 2.341
124 HB3 PHE 19 HB3 PHE 19 -1.515 5.356 3.569
125 HD1 PHE 19 HD1 PHE 19 1.965 6.527 2.795
126 HD2 PHE 19 HD2 PHE 19 -0.803 5.439 5.906
127 HE1 PHE 19 HE1 PHE 19 3.592 7.259 4.503
128 HE2 PHE 19 HE2 PHE 19 0.801 6.230 7.609
129 HZ PHE 19 HZ PHE 19 2.988 7.182 6.910
130 H TYR 20 H TYR 20 -2.704 3.537 2.667
131 HA TYR 20 HA TYR 20 -2.830 1.609 0.582
132 HB2 TYR 20 HB2 TYR 20 -4.975 3.525 1.692
133 HB3 TYR 20 HB3 TYR 20 -5.336 2.209 0.559
134 HD1 TYR 20 HD2 TYR 20 -2.804 1.080 2.957
135 HD2 TYR 20 HD1 TYR 20 -7.014 1.788 2.429
136 HE1 TYR 20 HE2 TYR 20 -3.289 -0.587 4.664
137 HE2 TYR 20 HE1 TYR 20 -7.498 0.121 4.183
138 HH TYR 20 HH TYR 20 -4.974 -1.709 5.923
139 H GLY 21 H GLY 21 -4.304 1.962 -1.537
140 HA2 GLY 21 HA3 GLY 21 -5.028 3.618 -3.153
141 HA3 GLY 21 HA2 GLY 21 -3.639 4.645 -2.752
Start of MODEL 10
1 H1 GLY 1 H GLY 1 2.314 -0.071 0.748
2 HA2 GLY 1 HA3 GLY 1 2.970 -0.379 -1.456
3 HA3 GLY 1 HA2 GLY 1 1.400 -1.147 -1.763
4 H GLY 2 H GLY 2 1.706 2.260 -0.449
5 HA2 GLY 2 HA3 GLY 2 1.752 3.536 -3.006
6 HA3 GLY 2 HA2 GLY 2 0.058 3.277 -2.504
7 H ALA 3 H ALA 3 -0.497 5.546 -2.026
8 HA ALA 3 HA ALA 3 0.922 6.654 0.360
9 HB1 ALA 3 HB1 ALA 3 0.622 8.122 -2.322
10 HB2 ALA 3 HB2 ALA 3 1.302 8.811 -0.813
11 HB3 ALA 3 HB3 ALA 3 2.154 7.482 -1.655
12 H GLY 4 H GLY 4 -1.644 5.477 0.363
13 HA2 GLY 4 HA3 GLY 4 -3.608 7.682 0.100
14 HA3 GLY 4 HA2 GLY 4 -3.929 5.979 0.457
15 H HIS 5 H HIS 5 -5.084 6.222 2.468
16 HA HIS 5 HA HIS 5 -4.005 8.183 4.433
17 HB2 HIS 5 HB2 HIS 5 -6.732 7.182 3.748
18 HB3 HIS 5 HB3 HIS 5 -6.421 7.053 5.479
19 HD1 HIS 5 HD1 HIS 5 -5.941 9.231 6.752
20 HD2 HIS 5 HD2 HIS 5 -6.897 9.704 2.683
21 HE1 HIS 5 HE1 HIS 5 -6.498 11.683 6.459
22 H VAL 6 H VAL 6 -4.443 4.572 4.145
23 HA VAL 6 HA VAL 6 -3.897 4.424 7.077
24 HB VAL 6 HB VAL 6 -4.970 2.378 5.095
25 HG11 VAL 6 HG11 VAL 6 -3.810 1.273 7.053
26 HG12 VAL 6 HG12 VAL 6 -4.867 2.196 8.165
27 HG13 VAL 6 HG13 VAL 6 -5.566 0.986 7.066
28 HG21 VAL 6 HG21 VAL 6 -6.596 4.246 5.440
29 HG22 VAL 6 HG22 VAL 6 -7.183 2.755 6.212
30 HG23 VAL 6 HG23 VAL 6 -6.453 4.047 7.209
31 HA PRO 7 HA PRO 7 0.202 3.128 5.668
32 HB2 PRO 7 HB2 PRO 7 1.251 1.822 7.880
33 HB3 PRO 7 HB3 PRO 7 1.035 3.594 7.757
34 HG2 PRO 7 HG2 PRO 7 -0.925 1.621 9.009
35 HG3 PRO 7 HG3 PRO 7 -0.255 3.114 9.759
36 HD2 PRO 7 HD2 PRO 7 -2.703 3.159 8.627
37 HD3 PRO 7 HD3 PRO 7 -1.593 4.537 8.273
38 H GLU 8 H GLU 8 1.102 1.229 4.542
39 HA GLU 8 HA GLU 8 -0.680 -1.145 4.521
40 HB2 GLU 8 HB2 GLU 8 1.861 -0.550 2.929
41 HB3 GLU 8 HB3 GLU 8 0.832 -1.995 2.726
42 HG2 GLU 8 HG2 GLU 8 -1.100 -0.557 2.107
43 HG3 GLU 8 HG3 GLU 8 -0.078 0.894 2.260
44 H TYR 9 H TYR 9 2.877 -0.342 5.119
45 HA TYR 9 HA TYR 9 3.013 -2.845 6.781
46 HB2 TYR 9 HB2 TYR 9 5.113 -1.736 4.815
47 HB3 TYR 9 HB3 TYR 9 5.233 -3.262 5.713
48 HD1 TYR 9 HD2 TYR 9 3.359 -5.044 5.315
49 HD2 TYR 9 HD1 TYR 9 4.094 -1.784 2.613
50 HE1 TYR 9 HE2 TYR 9 2.247 -6.292 3.505
51 HE2 TYR 9 HE1 TYR 9 2.928 -3.002 0.818
52 HH TYR 9 HH TYR 9 1.688 -6.327 1.173
53 H PHE 10 H PHE 10 5.188 -2.763 8.103
54 HA PHE 10 HA PHE 10 5.846 0.053 8.877
55 HB2 PHE 10 HB2 PHE 10 4.988 -2.290 10.685
56 HB3 PHE 10 HB3 PHE 10 5.829 -0.869 11.316
57 HD1 PHE 10 HD1 PHE 10 2.676 -1.973 9.600
58 HD2 PHE 10 HD2 PHE 10 4.733 1.343 11.404
59 HE1 PHE 10 HE1 PHE 10 0.518 -0.800 9.919
60 HE2 PHE 10 HE2 PHE 10 2.564 2.477 11.789
61 HZ PHE 10 HZ PHE 10 0.446 1.321 11.209
62 H VAL 11 H VAL 11 7.856 -0.001 10.373
63 HA VAL 11 HA VAL 11 9.829 -1.831 9.029
64 HB VAL 11 HB VAL 11 11.488 -0.154 9.407
65 HG11 VAL 11 HG11 VAL 11 10.555 1.926 8.444
66 HG12 VAL 11 HG12 VAL 11 9.938 0.481 7.589
67 HG13 VAL 11 HG13 VAL 11 8.895 1.370 8.727
68 HG21 VAL 11 HG21 VAL 11 11.065 1.910 10.830
69 HG22 VAL 11 HG22 VAL 11 9.588 1.119 11.450
70 HG23 VAL 11 HG23 VAL 11 11.181 0.421 11.779
71 H ARG 12 H ARG 12 11.869 -1.869 11.015
72 HA ARG 12 HA ARG 12 10.529 -3.462 13.100
73 HB2 ARG 12 HB2 ARG 12 13.504 -2.767 12.827
74 HB3 ARG 12 HB3 ARG 12 12.747 -3.947 13.927
75 HG2 ARG 12 HG2 ARG 12 11.769 -5.061 11.728
76 HG3 ARG 12 HG3 ARG 12 12.952 -4.066 10.851
77 HD2 ARG 12 HD2 ARG 12 13.538 -6.114 13.064
78 HD3 ARG 12 HD3 ARG 12 13.763 -6.455 11.365
79 HE ARG 12 HE ARG 12 15.519 -4.949 13.190
80 HH11 ARG 12 HH11 ARG 12 14.675 -5.299 9.686
81 HH12 ARG 12 HH12 ARG 12 16.288 -4.811 9.193
82 HH21 ARG 12 HH21 ARG 12 17.532 -4.327 12.432
83 HH22 ARG 12 HH22 ARG 12 17.864 -4.259 10.701
84 H GLY 13 H GLY 13 9.144 -1.383 13.624
85 HA2 GLY 13 HA3 GLY 13 8.625 -0.085 15.478
86 HA3 GLY 13 HA2 GLY 13 10.158 -0.590 16.191
87 H ASP 14 H ASP 14 8.722 1.759 13.745
88 HA ASP 14 HA ASP 14 10.084 3.826 15.133
89 HB2 ASP 14 HB2 ASP 14 11.937 2.686 13.462
90 HB3 ASP 14 HB3 ASP 14 11.236 3.823 12.310
91 H THR 15 H THR 15 9.035 3.351 11.637
92 HA THR 15 HA THR 15 6.627 4.813 12.061
93 HB THR 15 HB THR 15 7.920 6.868 12.169
94 HG1 THR 15 HG1 THR 15 7.324 7.839 10.088
95 HG21 THR 15 HG21 THR 15 10.151 5.982 11.491
96 HG22 THR 15 HG22 THR 15 9.750 7.448 10.567
97 HG23 THR 15 HG23 THR 15 9.598 5.848 9.792
98 HA PRO 16 HA PRO 16 6.316 2.373 8.327
99 HB2 PRO 16 HB2 PRO 16 3.936 3.246 7.170
100 HB3 PRO 16 HB3 PRO 16 3.954 2.451 8.772
101 HG2 PRO 16 HG2 PRO 16 4.080 5.469 8.266
102 HG3 PRO 16 HG3 PRO 16 2.828 4.618 9.225
103 HD2 PRO 16 HD2 PRO 16 4.969 5.723 10.486
104 HD3 PRO 16 HD3 PRO 16 4.500 4.047 10.959
105 H ILE 17 H ILE 17 6.200 2.570 5.802
106 HA ILE 17 HA ILE 17 7.109 5.279 4.885
107 HB ILE 17 HB ILE 17 8.410 2.690 3.914
108 HG12 ILE 17 HG12 ILE 17 9.441 4.363 6.271
109 HG13 ILE 17 HG13 ILE 17 8.839 2.687 6.335
110 HG21 ILE 17 HG21 ILE 17 8.618 5.016 2.631
111 HG22 ILE 17 HG22 ILE 17 9.604 5.530 4.010
112 HG23 ILE 17 HG23 ILE 17 10.121 4.162 2.979
113 HD11 ILE 17 HD11 ILE 17 11.392 3.599 4.861
114 HD12 ILE 17 HD12 ILE 17 11.305 2.614 6.321
115 HD13 ILE 17 HD13 ILE 17 10.699 1.949 4.784
116 H SER 18 H SER 18 4.401 4.186 4.660
117 HA SER 18 HA SER 18 3.960 4.493 1.906
118 HB2 SER 18 HB2 SER 18 3.323 1.973 1.409
119 HB3 SER 18 HB3 SER 18 5.037 2.392 1.300
120 HG SER 18 HG SER 18 4.733 0.528 2.710
121 H PHE 19 H PHE 19 1.653 4.085 1.296
122 HA PHE 19 HA PHE 19 -0.099 3.126 3.456
123 HB2 PHE 19 HB2 PHE 19 -0.334 5.960 2.270
124 HB3 PHE 19 HB3 PHE 19 -1.419 5.275 3.484
125 HD1 PHE 19 HD1 PHE 19 2.101 6.387 2.775
126 HD2 PHE 19 HD2 PHE 19 -0.796 5.510 5.835
127 HE1 PHE 19 HE1 PHE 19 3.684 7.171 4.499
128 HE2 PHE 19 HE2 PHE 19 0.777 6.334 7.553
129 HZ PHE 19 HZ PHE 19 3.001 7.218 6.884
130 H TYR 20 H TYR 20 -2.560 3.413 2.614
131 HA TYR 20 HA TYR 20 -2.659 1.424 0.596
132 HB2 TYR 20 HB2 TYR 20 -4.789 3.430 1.573
133 HB3 TYR 20 HB3 TYR 20 -5.161 2.086 0.482
134 HD1 TYR 20 HD1 TYR 20 -2.712 0.966 2.976
135 HD2 TYR 20 HD2 TYR 20 -6.885 1.794 2.337
136 HE1 TYR 20 HE1 TYR 20 -3.287 -0.652 4.702
137 HE2 TYR 20 HE2 TYR 20 -7.462 0.180 4.112
138 HH TYR 20 HH TYR 20 -5.036 -1.776 5.863
139 H GLY 21 H GLY 21 -4.123 1.727 -1.565
140 HA2 GLY 21 HA3 GLY 21 -4.556 2.992 -3.508
141 HA3 GLY 21 HA2 GLY 21 -3.743 4.393 -2.778
Start of MODEL 11
1 H1 GLY 1 H GLY 1 2.303 0.074 0.660
2 HA2 GLY 1 HA3 GLY 1 2.959 -0.145 -1.555
3 HA3 GLY 1 HA2 GLY 1 1.428 -0.988 -1.863
4 H GLY 2 H GLY 2 1.492 2.396 -0.494
5 HA2 GLY 2 HA3 GLY 2 1.434 3.693 -3.069
6 HA3 GLY 2 HA2 GLY 2 -0.222 3.370 -2.475
7 H ALA 3 H ALA 3 -0.788 5.648 -1.967
8 HA ALA 3 HA ALA 3 0.689 6.744 0.382
9 HB1 ALA 3 HB1 ALA 3 1.035 8.921 -0.761
10 HB2 ALA 3 HB2 ALA 3 1.878 7.615 -1.643
11 HB3 ALA 3 HB3 ALA 3 0.327 8.253 -2.266
12 H GLY 4 H GLY 4 -1.852 5.563 0.477
13 HA2 GLY 4 HA3 GLY 4 -3.836 7.773 0.317
14 HA3 GLY 4 HA2 GLY 4 -4.141 6.058 0.637
15 H HIS 5 H HIS 5 -5.289 6.382 2.669
16 HA HIS 5 HA HIS 5 -4.041 8.140 4.702
17 HB2 HIS 5 HB2 HIS 5 -6.787 6.852 4.389
18 HB3 HIS 5 HB3 HIS 5 -6.187 7.112 6.030
19 HD1 HIS 5 HD1 HIS 5 -6.168 9.284 2.902
20 HD2 HIS 5 HD2 HIS 5 -6.958 9.369 7.031
21 HE1 HIS 5 HE1 HIS 5 -6.882 11.663 3.421
22 H VAL 6 H VAL 6 -4.645 4.543 4.282
23 HA VAL 6 HA VAL 6 -3.923 4.264 7.138
24 HB VAL 6 HB VAL 6 -4.990 2.259 5.122
25 HG11 VAL 6 HG11 VAL 6 -5.494 0.791 7.065
26 HG12 VAL 6 HG12 VAL 6 -3.747 1.120 7.015
27 HG13 VAL 6 HG13 VAL 6 -4.795 1.981 8.182
28 HG21 VAL 6 HG21 VAL 6 -7.176 2.542 6.320
29 HG22 VAL 6 HG22 VAL 6 -6.447 3.812 7.343
30 HG23 VAL 6 HG23 VAL 6 -6.655 4.077 5.593
31 HA PRO 7 HA PRO 7 0.197 3.094 5.650
32 HB2 PRO 7 HB2 PRO 7 1.293 1.778 7.823
33 HB3 PRO 7 HB3 PRO 7 1.039 3.546 7.735
34 HG2 PRO 7 HG2 PRO 7 -0.856 1.509 8.975
35 HG3 PRO 7 HG3 PRO 7 -0.213 3.001 9.743
36 HD2 PRO 7 HD2 PRO 7 -2.674 3.012 8.640
37 HD3 PRO 7 HD3 PRO 7 -1.601 4.419 8.302
38 H GLU 8 H GLU 8 1.090 1.236 4.463
39 HA GLU 8 HA GLU 8 -0.640 -1.169 4.430
40 HB2 GLU 8 HB2 GLU 8 1.872 -0.507 2.826
41 HB3 GLU 8 HB3 GLU 8 0.859 -1.959 2.596
42 HG2 GLU 8 HG2 GLU 8 -1.093 -0.525 2.032
43 HG3 GLU 8 HG3 GLU 8 -0.084 0.932 2.205
44 H TYR 9 H TYR 9 2.881 -0.284 5.067
45 HA TYR 9 HA TYR 9 3.132 -2.848 6.606
46 HB2 TYR 9 HB2 TYR 9 5.165 -1.586 4.660
47 HB3 TYR 9 HB3 TYR 9 5.345 -3.147 5.483
48 HD1 TYR 9 HD2 TYR 9 3.502 -4.953 5.042
49 HD2 TYR 9 HD1 TYR 9 4.152 -1.574 2.460
50 HE1 TYR 9 HE2 TYR 9 2.412 -6.161 3.193
51 HE2 TYR 9 HE1 TYR 9 3.016 -2.767 0.621
52 HH TYR 9 HH TYR 9 1.844 -6.125 0.865
53 H PHE 10 H PHE 10 5.344 -2.735 7.884
54 HA PHE 10 HA PHE 10 5.947 0.078 8.707
55 HB2 PHE 10 HB2 PHE 10 5.174 -2.313 10.492
56 HB3 PHE 10 HB3 PHE 10 6.003 -0.885 11.125
57 HD1 PHE 10 HD1 PHE 10 2.834 -2.033 9.467
58 HD2 PHE 10 HD2 PHE 10 4.862 1.303 11.268
59 HE1 PHE 10 HE1 PHE 10 0.661 -0.903 9.832
60 HE2 PHE 10 HE2 PHE 10 2.679 2.392 11.703
61 HZ PHE 10 HZ PHE 10 0.573 1.205 11.143
62 H VAL 11 H VAL 11 7.985 0.054 10.146
63 HA VAL 11 HA VAL 11 9.970 -1.736 8.765
64 HB VAL 11 HB VAL 11 11.606 -0.034 9.127
65 HG11 VAL 11 HG11 VAL 11 8.982 1.460 8.505
66 HG12 VAL 11 HG12 VAL 11 10.628 2.040 8.198
67 HG13 VAL 11 HG13 VAL 11 10.015 0.597 7.339
68 HG21 VAL 11 HG21 VAL 11 11.342 0.520 11.500
69 HG22 VAL 11 HG22 VAL 11 11.165 2.017 10.574
70 HG23 VAL 11 HG23 VAL 11 9.723 1.181 11.218
71 H ARG 12 H ARG 12 12.032 -1.766 10.717
72 HA ARG 12 HA ARG 12 10.781 -3.390 12.809
73 HB2 ARG 12 HB2 ARG 12 13.685 -2.446 12.630
74 HB3 ARG 12 HB3 ARG 12 13.003 -3.718 13.672
75 HG2 ARG 12 HG2 ARG 12 12.167 -4.666 11.197
76 HG3 ARG 12 HG3 ARG 12 13.618 -3.778 10.682
77 HD2 ARG 12 HD2 ARG 12 13.408 -5.994 12.783
78 HD3 ARG 12 HD3 ARG 12 14.148 -6.154 11.152
79 HE ARG 12 HE ARG 12 15.574 -4.095 12.459
80 HH11 ARG 12 HH11 ARG 12 14.997 -7.628 12.896
81 HH12 ARG 12 HH12 ARG 12 16.513 -7.838 13.759
82 HH21 ARG 12 HH21 ARG 12 17.500 -4.475 13.563
83 HH22 ARG 12 HH22 ARG 12 17.913 -6.100 14.117
84 H GLY 13 H GLY 13 9.253 -1.437 13.404
85 HA2 GLY 13 HA3 GLY 13 8.678 -0.090 15.206
86 HA3 GLY 13 HA2 GLY 13 10.192 -0.607 15.956
87 H ASP 14 H ASP 14 8.817 1.782 13.529
88 HA ASP 14 HA ASP 14 10.189 3.820 14.968
89 HB2 ASP 14 HB2 ASP 14 12.022 2.697 13.269
90 HB3 ASP 14 HB3 ASP 14 11.324 3.857 12.137
91 H THR 15 H THR 15 9.113 3.387 11.479
92 HA THR 15 HA THR 15 6.703 4.829 11.949
93 HB THR 15 HB THR 15 7.953 6.887 12.064
94 HG1 THR 15 HG1 THR 15 7.334 7.876 9.999
95 HG21 THR 15 HG21 THR 15 9.633 5.922 9.655
96 HG22 THR 15 HG22 THR 15 10.201 6.037 11.347
97 HG23 THR 15 HG23 THR 15 9.773 7.511 10.450
98 HA PRO 16 HA PRO 16 6.370 2.413 8.190
99 HB2 PRO 16 HB2 PRO 16 3.959 3.263 7.085
100 HB3 PRO 16 HB3 PRO 16 4.020 2.446 8.677
101 HG2 PRO 16 HG2 PRO 16 4.080 5.469 8.202
102 HG3 PRO 16 HG3 PRO 16 2.861 4.587 9.174
103 HD2 PRO 16 HD2 PRO 16 5.002 5.715 10.409
104 HD3 PRO 16 HD3 PRO 16 4.571 4.026 10.872
105 H ILE 17 H ILE 17 6.210 2.643 5.670
106 HA ILE 17 HA ILE 17 7.030 5.379 4.768
107 HB ILE 17 HB ILE 17 8.413 2.847 3.761
108 HG12 ILE 17 HG12 ILE 17 9.414 4.555 6.108
109 HG13 ILE 17 HG13 ILE 17 8.873 2.859 6.178
110 HG21 ILE 17 HG21 ILE 17 8.505 5.183 2.487
111 HG22 ILE 17 HG22 ILE 17 9.495 5.730 3.850
112 HG23 ILE 17 HG23 ILE 17 10.046 4.386 2.805
113 HD11 ILE 17 HD11 ILE 17 11.346 2.886 6.128
114 HD12 ILE 17 HD12 ILE 17 10.737 2.187 4.607
115 HD13 ILE 17 HD13 ILE 17 11.367 3.863 4.662
116 H SER 18 H SER 18 4.371 4.272 4.564
117 HA SER 18 HA SER 18 3.869 4.649 1.853
118 HB2 SER 18 HB2 SER 18 3.236 2.177 1.206
119 HB3 SER 18 HB3 SER 18 4.944 2.580 1.102
120 HG SER 18 HG SER 18 3.770 1.271 3.366
121 H PHE 19 H PHE 19 1.545 4.224 1.270
122 HA PHE 19 HA PHE 19 -0.126 3.158 3.450
123 HB2 PHE 19 HB2 PHE 19 -0.459 6.008 2.333
124 HB3 PHE 19 HB3 PHE 19 -1.502 5.263 3.550
125 HD1 PHE 19 HD1 PHE 19 1.974 6.484 2.800
126 HD2 PHE 19 HD2 PHE 19 -0.829 5.448 5.895
127 HE1 PHE 19 HE1 PHE 19 3.572 7.267 4.511
128 HE2 PHE 19 HE2 PHE 19 0.751 6.282 7.601
129 HZ PHE 19 HZ PHE 19 2.937 7.242 6.909
130 H TYR 20 H TYR 20 -2.622 3.389 2.658
131 HA TYR 20 HA TYR 20 -2.669 1.426 0.610
132 HB2 TYR 20 HB2 TYR 20 -4.872 3.330 1.612
133 HB3 TYR 20 HB3 TYR 20 -5.171 1.986 0.491
134 HD1 TYR 20 HD1 TYR 20 -2.697 0.938 2.984
135 HD2 TYR 20 HD2 TYR 20 -6.899 1.607 2.355
136 HE1 TYR 20 HE1 TYR 20 -3.218 -0.720 4.704
137 HE2 TYR 20 HE2 TYR 20 -7.417 -0.029 4.114
138 HH TYR 20 HH TYR 20 -6.536 -1.641 5.642
139 H GLY 21 H GLY 21 -4.065 1.711 -1.580
140 HA2 GLY 21 HA3 GLY 21 -2.723 3.585 -3.232
141 HA3 GLY 21 HA2 GLY 21 -4.291 2.832 -3.624
Start of MODEL 12
1 H1 GLY 1 H GLY 1 2.120 0.137 0.540
2 HA2 GLY 1 HA3 GLY 1 2.736 -0.058 -1.689
3 HA3 GLY 1 HA2 GLY 1 1.177 -0.854 -1.988
4 H GLY 2 H GLY 2 1.453 2.504 -0.556
5 HA2 GLY 2 HA3 GLY 2 1.321 3.862 -3.086
6 HA3 GLY 2 HA2 GLY 2 -0.323 3.576 -2.445
7 H ALA 3 H ALA 3 -0.792 5.868 -1.888
8 HA ALA 3 HA ALA 3 0.769 6.849 0.457
9 HB1 ALA 3 HB1 ALA 3 0.432 8.430 -2.153
10 HB2 ALA 3 HB2 ALA 3 1.192 9.033 -0.645
11 HB3 ALA 3 HB3 ALA 3 1.960 7.707 -1.566
12 H GLY 4 H GLY 4 -1.836 5.780 0.555
13 HA2 GLY 4 HA3 GLY 4 -3.706 8.093 0.495
14 HA3 GLY 4 HA2 GLY 4 -4.093 6.385 0.768
15 H HIS 5 H HIS 5 -5.224 6.744 2.816
16 HA HIS 5 HA HIS 5 -3.846 8.339 4.889
17 HB2 HIS 5 HB2 HIS 5 -6.635 7.085 4.676
18 HB3 HIS 5 HB3 HIS 5 -5.946 7.410 6.270
19 HD1 HIS 5 HD1 HIS 5 -6.903 9.318 3.167
20 HD2 HIS 5 HD2 HIS 5 -5.765 9.866 7.177
21 HE1 HIS 5 HE1 HIS 5 -7.322 11.770 3.675
22 H VAL 6 H VAL 6 -4.643 4.788 4.369
23 HA VAL 6 HA VAL 6 -3.879 4.388 7.194
24 HB VAL 6 HB VAL 6 -5.040 2.478 5.138
25 HG11 VAL 6 HG11 VAL 6 -3.816 1.243 6.981
26 HG12 VAL 6 HG12 VAL 6 -4.820 2.103 8.186
27 HG13 VAL 6 HG13 VAL 6 -5.572 0.971 7.042
28 HG21 VAL 6 HG21 VAL 6 -6.635 4.338 5.685
29 HG22 VAL 6 HG22 VAL 6 -7.198 2.801 6.375
30 HG23 VAL 6 HG23 VAL 6 -6.413 4.016 7.424
31 HA PRO 7 HA PRO 7 0.181 3.112 5.638
32 HB2 PRO 7 HB2 PRO 7 1.249 1.697 7.768
33 HB3 PRO 7 HB3 PRO 7 1.060 3.474 7.728
34 HG2 PRO 7 HG2 PRO 7 -0.904 1.480 8.932
35 HG3 PRO 7 HG3 PRO 7 -0.198 2.928 9.730
36 HD2 PRO 7 HD2 PRO 7 -2.663 3.057 8.656
37 HD3 PRO 7 HD3 PRO 7 -1.543 4.433 8.338
38 H GLU 8 H GLU 8 1.015 1.249 4.404
39 HA GLU 8 HA GLU 8 -0.812 -1.085 4.322
40 HB2 GLU 8 HB2 GLU 8 1.705 -0.483 2.697
41 HB3 GLU 8 HB3 GLU 8 0.632 -1.888 2.455
42 HG2 GLU 8 HG2 GLU 8 -1.272 -0.369 1.952
43 HG3 GLU 8 HG3 GLU 8 -0.204 1.045 2.135
44 H TYR 9 H TYR 9 2.775 -0.385 4.864
45 HA TYR 9 HA TYR 9 2.900 -2.955 6.416
46 HB2 TYR 9 HB2 TYR 9 4.961 -1.813 4.430
47 HB3 TYR 9 HB3 TYR 9 5.087 -3.367 5.277
48 HD1 TYR 9 HD2 TYR 9 3.175 -5.111 4.886
49 HD2 TYR 9 HD1 TYR 9 3.889 -1.790 2.252
50 HE1 TYR 9 HE2 TYR 9 1.994 -6.292 3.074
51 HE2 TYR 9 HE1 TYR 9 2.639 -2.933 0.464
52 HH TYR 9 HH TYR 9 1.372 -6.253 0.759
53 H PHE 10 H PHE 10 5.100 -2.976 7.689
54 HA PHE 10 HA PHE 10 5.844 -0.204 8.556
55 HB2 PHE 10 HB2 PHE 10 4.984 -2.604 10.288
56 HB3 PHE 10 HB3 PHE 10 5.868 -1.225 10.954
57 HD1 PHE 10 HD1 PHE 10 2.650 -2.199 9.289
58 HD2 PHE 10 HD2 PHE 10 4.829 1.006 11.151
59 HE1 PHE 10 HE1 PHE 10 0.526 -0.998 9.720
60 HE2 PHE 10 HE2 PHE 10 2.697 2.169 11.641
61 HZ PHE 10 HZ PHE 10 0.538 1.077 11.086
62 H VAL 11 H VAL 11 7.891 -0.373 10.002
63 HA VAL 11 HA VAL 11 9.783 -2.190 8.528
64 HB VAL 11 HB VAL 11 11.485 -0.559 8.906
65 HG11 VAL 11 HG11 VAL 11 10.573 1.575 8.063
66 HG12 VAL 11 HG12 VAL 11 9.889 0.184 7.173
67 HG13 VAL 11 HG13 VAL 11 8.909 1.051 8.382
68 HG21 VAL 11 HG21 VAL 11 11.162 1.450 10.422
69 HG22 VAL 11 HG22 VAL 11 9.688 0.671 11.064
70 HG23 VAL 11 HG23 VAL 11 11.275 -0.077 11.307
71 H ARG 12 H ARG 12 11.870 -2.368 10.386
72 HA ARG 12 HA ARG 12 10.735 -4.031 12.483
73 HB2 ARG 12 HB2 ARG 12 13.017 -4.349 11.437
74 HB3 ARG 12 HB3 ARG 12 13.540 -2.838 12.203
75 HG2 ARG 12 HG2 ARG 12 12.428 -4.390 14.370
76 HG3 ARG 12 HG3 ARG 12 13.266 -5.591 13.370
77 HD2 ARG 12 HD2 ARG 12 14.422 -3.028 14.577
78 HD3 ARG 12 HD3 ARG 12 14.782 -4.710 15.103
79 HE ARG 12 HE ARG 12 15.500 -4.540 12.362
80 HH11 ARG 12 HH11 ARG 12 16.531 -3.092 15.500
81 HH12 ARG 12 HH12 ARG 12 18.156 -2.789 14.904
82 HH21 ARG 12 HH21 ARG 12 17.609 -4.111 11.699
83 HH22 ARG 12 HH22 ARG 12 18.764 -3.364 12.805
84 H GLY 13 H GLY 13 9.133 -2.111 13.184
85 HA2 GLY 13 HA3 GLY 13 8.575 -0.689 14.933
86 HA3 GLY 13 HA2 GLY 13 10.047 -1.280 15.710
87 H ASP 14 H ASP 14 8.798 1.243 13.359
88 HA ASP 14 HA ASP 14 10.269 3.158 14.862
89 HB2 ASP 14 HB2 ASP 14 12.061 2.040 13.137
90 HB3 ASP 14 HB3 ASP 14 11.398 3.244 12.029
91 H THR 15 H THR 15 9.165 2.904 11.363
92 HA THR 15 HA THR 15 6.822 4.432 11.904
93 HB THR 15 HB THR 15 8.175 6.426 12.064
94 HG1 THR 15 HG1 THR 15 7.561 7.506 10.039
95 HG21 THR 15 HG21 THR 15 9.992 7.019 10.441
96 HG22 THR 15 HG22 THR 15 9.762 5.469 9.592
97 HG23 THR 15 HG23 THR 15 10.366 5.495 11.274
98 HA PRO 16 HA PRO 16 6.353 2.145 8.080
99 HB2 PRO 16 HB2 PRO 16 3.959 3.113 7.036
100 HB3 PRO 16 HB3 PRO 16 4.007 2.252 8.603
101 HG2 PRO 16 HG2 PRO 16 4.181 5.283 8.214
102 HG3 PRO 16 HG3 PRO 16 2.942 4.419 9.177
103 HD2 PRO 16 HD2 PRO 16 5.143 5.429 10.414
104 HD3 PRO 16 HD3 PRO 16 4.648 3.748 10.838
105 H ILE 17 H ILE 17 6.173 2.471 5.570
106 HA ILE 17 HA ILE 17 7.104 5.205 4.762
107 HB ILE 17 HB ILE 17 8.342 2.646 3.647
108 HG12 ILE 17 HG12 ILE 17 9.441 4.205 6.052
109 HG13 ILE 17 HG13 ILE 17 8.827 2.533 6.057
110 HG21 ILE 17 HG21 ILE 17 10.060 4.133 2.741
111 HG22 ILE 17 HG22 ILE 17 8.561 5.017 2.457
112 HG23 ILE 17 HG23 ILE 17 9.580 5.464 3.835
113 HD11 ILE 17 HD11 ILE 17 11.288 2.447 5.997
114 HD12 ILE 17 HD12 ILE 17 10.652 1.848 4.445
115 HD13 ILE 17 HD13 ILE 17 11.359 3.488 4.576
116 H SER 18 H SER 18 4.377 4.154 4.562
117 HA SER 18 HA SER 18 3.879 4.590 1.823
118 HB2 SER 18 HB2 SER 18 3.169 2.155 1.210
119 HB3 SER 18 HB3 SER 18 4.918 2.414 1.216
120 HG SER 18 HG SER 18 4.353 0.544 2.536
121 H PHE 19 H PHE 19 1.531 4.259 1.273
122 HA PHE 19 HA PHE 19 -0.169 3.232 3.442
123 HB2 PHE 19 HB2 PHE 19 -0.400 6.118 2.399
124 HB3 PHE 19 HB3 PHE 19 -1.458 5.388 3.612
125 HD1 PHE 19 HD1 PHE 19 2.047 6.509 2.854
126 HD2 PHE 19 HD2 PHE 19 -0.754 5.481 5.952
127 HE1 PHE 19 HE1 PHE 19 3.688 7.193 4.567
128 HE2 PHE 19 HE2 PHE 19 0.867 6.221 7.661
129 HZ PHE 19 HZ PHE 19 3.077 7.123 6.971
130 H TYR 20 H TYR 20 -2.658 3.568 2.692
131 HA TYR 20 HA TYR 20 -2.807 1.680 0.589
132 HB2 TYR 20 HB2 TYR 20 -4.919 3.656 1.656
133 HB3 TYR 20 HB3 TYR 20 -5.295 2.353 0.511
134 HD1 TYR 20 HD1 TYR 20 -2.858 1.105 2.937
135 HD2 TYR 20 HD2 TYR 20 -7.021 2.045 2.395
136 HE1 TYR 20 HE1 TYR 20 -3.444 -0.584 4.592
137 HE2 TYR 20 HE2 TYR 20 -7.606 0.369 4.109
138 HH TYR 20 HH TYR 20 -5.215 -1.768 5.678
139 H GLY 21 H GLY 21 -4.174 2.039 -1.578
140 HA2 GLY 21 HA3 GLY 21 -4.182 4.714 -2.635
141 HA3 GLY 21 HA2 GLY 21 -2.757 3.819 -3.237
Start of MODEL 13
1 H1 GLY 1 H GLY 1 2.299 -0.278 0.654
2 HA2 GLY 1 HA3 GLY 1 2.862 -0.254 -1.590
3 HA3 GLY 1 HA2 GLY 1 1.358 -1.175 -1.837
4 H GLY 2 H GLY 2 1.497 2.248 -0.540
5 HA2 GLY 2 HA3 GLY 2 1.112 3.489 -3.080
6 HA3 GLY 2 HA2 GLY 2 -0.486 3.096 -2.385
7 H ALA 3 H ALA 3 -1.148 5.338 -1.945
8 HA ALA 3 HA ALA 3 0.353 6.608 0.296
9 HB1 ALA 3 HB1 ALA 3 -0.155 7.964 -2.408
10 HB2 ALA 3 HB2 ALA 3 0.590 8.736 -0.971
11 HB3 ALA 3 HB3 ALA 3 1.441 7.411 -1.817
12 H GLY 4 H GLY 4 -2.182 5.352 0.496
13 HA2 GLY 4 HA3 GLY 4 -4.194 7.533 0.372
14 HA3 GLY 4 HA2 GLY 4 -4.460 5.829 0.786
15 H HIS 5 H HIS 5 -5.517 6.235 2.859
16 HA HIS 5 HA HIS 5 -4.127 8.033 4.770
17 HB2 HIS 5 HB2 HIS 5 -6.859 6.630 4.798
18 HB3 HIS 5 HB3 HIS 5 -6.116 7.271 6.278
19 HD1 HIS 5 HD1 HIS 5 -8.154 8.813 6.382
20 HD2 HIS 5 HD2 HIS 5 -5.430 9.574 3.266
21 HE1 HIS 5 HE1 HIS 5 -8.626 11.172 5.624
22 H VAL 6 H VAL 6 -4.778 4.430 4.477
23 HA VAL 6 HA VAL 6 -3.940 4.218 7.309
24 HB VAL 6 HB VAL 6 -5.050 2.146 5.389
25 HG11 VAL 6 HG11 VAL 6 -4.724 1.970 8.451
26 HG12 VAL 6 HG12 VAL 6 -5.454 0.741 7.392
27 HG13 VAL 6 HG13 VAL 6 -3.712 1.095 7.259
28 HG21 VAL 6 HG21 VAL 6 -6.718 3.947 5.864
29 HG22 VAL 6 HG22 VAL 6 -7.189 2.430 6.664
30 HG23 VAL 6 HG23 VAL 6 -6.447 3.747 7.618
31 HA PRO 7 HA PRO 7 0.126 3.119 5.669
32 HB2 PRO 7 HB2 PRO 7 1.339 1.848 7.817
33 HB3 PRO 7 HB3 PRO 7 1.084 3.619 7.698
34 HG2 PRO 7 HG2 PRO 7 -0.718 1.600 9.090
35 HG3 PRO 7 HG3 PRO 7 -0.076 3.138 9.766
36 HD2 PRO 7 HD2 PRO 7 -2.596 3.051 8.777
37 HD3 PRO 7 HD3 PRO 7 -1.561 4.473 8.354
38 H GLU 8 H GLU 8 1.071 1.256 4.516
39 HA GLU 8 HA GLU 8 -0.676 -1.131 4.473
40 HB2 GLU 8 HB2 GLU 8 1.880 -0.538 2.895
41 HB3 GLU 8 HB3 GLU 8 0.834 -1.974 2.683
42 HG2 GLU 8 HG2 GLU 8 -1.099 -0.475 2.135
43 HG3 GLU 8 HG3 GLU 8 -0.020 0.935 2.243
44 H TYR 9 H TYR 9 2.855 -0.361 5.166
45 HA TYR 9 HA TYR 9 2.824 -2.517 7.198
46 HB2 TYR 9 HB2 TYR 9 4.806 -3.653 6.079
47 HB3 TYR 9 HB3 TYR 9 3.324 -3.746 5.111
48 HD1 TYR 9 HD2 TYR 9 6.544 -1.816 5.518
49 HD2 TYR 9 HD1 TYR 9 3.270 -2.774 2.890
50 HE1 TYR 9 HE2 TYR 9 7.713 -0.708 3.641
51 HE2 TYR 9 HE1 TYR 9 4.442 -1.684 1.023
52 HH TYR 9 HH TYR 9 6.388 -0.489 0.333
53 H PHE 10 H PHE 10 5.152 -2.646 8.260
54 HA PHE 10 HA PHE 10 6.189 0.179 8.467
55 HB2 PHE 10 HB2 PHE 10 5.580 -1.877 10.663
56 HB3 PHE 10 HB3 PHE 10 6.459 -0.358 10.926
57 HD1 PHE 10 HD1 PHE 10 3.158 -1.768 9.754
58 HD2 PHE 10 HD2 PHE 10 5.245 1.771 11.047
59 HE1 PHE 10 HE1 PHE 10 0.995 -0.630 10.145
60 HE2 PHE 10 HE2 PHE 10 3.073 2.842 11.587
61 HZ PHE 10 HZ PHE 10 0.956 1.589 11.262
62 H VAL 11 H VAL 11 8.404 0.135 9.641
63 HA VAL 11 HA VAL 11 10.043 -1.925 8.220
64 HB VAL 11 HB VAL 11 11.880 -0.428 8.351
65 HG11 VAL 11 HG11 VAL 11 10.132 0.272 6.708
66 HG12 VAL 11 HG12 VAL 11 9.457 1.404 7.914
67 HG13 VAL 11 HG13 VAL 11 11.124 1.618 7.332
68 HG21 VAL 11 HG21 VAL 11 10.353 1.170 10.484
69 HG22 VAL 11 HG22 VAL 11 11.850 0.263 10.747
70 HG23 VAL 11 HG23 VAL 11 11.872 1.697 9.705
71 H ARG 12 H ARG 12 12.297 -2.039 9.940
72 HA ARG 12 HA ARG 12 11.317 -3.717 12.081
73 HB2 ARG 12 HB2 ARG 12 13.599 -3.823 10.806
74 HB3 ARG 12 HB3 ARG 12 14.097 -2.457 11.809
75 HG2 ARG 12 HG2 ARG 12 14.944 -4.279 13.038
76 HG3 ARG 12 HG3 ARG 12 13.380 -4.078 13.861
77 HD2 ARG 12 HD2 ARG 12 12.458 -5.974 12.320
78 HD3 ARG 12 HD3 ARG 12 14.037 -6.031 11.564
79 HE ARG 12 HE ARG 12 15.002 -7.165 13.288
80 HH11 ARG 12 HH11 ARG 12 11.819 -5.902 14.442
81 HH12 ARG 12 HH12 ARG 12 11.878 -6.904 15.883
82 HH21 ARG 12 HH21 ARG 12 14.992 -8.369 15.165
83 HH22 ARG 12 HH22 ARG 12 13.645 -8.265 16.299
84 H GLY 13 H GLY 13 9.715 -1.790 12.867
85 HA2 GLY 13 HA3 GLY 13 9.232 -0.404 14.668
86 HA3 GLY 13 HA2 GLY 13 10.793 -0.892 15.341
87 H ASP 14 H ASP 14 9.257 1.461 12.973
88 HA ASP 14 HA ASP 14 10.763 3.490 14.334
89 HB2 ASP 14 HB2 ASP 14 12.455 2.499 12.556
90 HB3 ASP 14 HB3 ASP 14 11.545 3.449 11.374
91 H THR 15 H THR 15 9.281 3.161 10.981
92 HA THR 15 HA THR 15 6.948 4.666 11.687
93 HB THR 15 HB THR 15 7.943 6.477 9.752
94 HG1 THR 15 HG1 THR 15 10.079 7.041 10.599
95 HG21 THR 15 HG21 THR 15 6.607 7.144 11.790
96 HG22 THR 15 HG22 THR 15 8.005 8.206 11.501
97 HG23 THR 15 HG23 THR 15 8.072 6.991 12.793
98 HA PRO 16 HA PRO 16 6.240 2.451 7.866
99 HB2 PRO 16 HB2 PRO 16 3.880 3.477 6.906
100 HB3 PRO 16 HB3 PRO 16 3.953 2.733 8.536
101 HG2 PRO 16 HG2 PRO 16 4.265 5.706 7.868
102 HG3 PRO 16 HG3 PRO 16 3.032 4.998 8.963
103 HD2 PRO 16 HD2 PRO 16 5.413 5.998 9.964
104 HD3 PRO 16 HD3 PRO 16 4.746 4.455 10.626
105 H ILE 17 H ILE 17 6.110 2.659 5.393
106 HA ILE 17 HA ILE 17 6.858 5.380 4.386
107 HB ILE 17 HB ILE 17 8.244 2.828 3.418
108 HG12 ILE 17 HG12 ILE 17 9.322 4.746 5.578
109 HG13 ILE 17 HG13 ILE 17 8.838 3.046 5.821
110 HG21 ILE 17 HG21 ILE 17 9.257 5.734 3.252
111 HG22 ILE 17 HG22 ILE 17 9.756 4.328 2.257
112 HG23 ILE 17 HG23 ILE 17 8.176 5.078 2.008
113 HD11 ILE 17 HD11 ILE 17 10.653 2.274 4.286
114 HD12 ILE 17 HD12 ILE 17 11.199 3.965 4.046
115 HD13 ILE 17 HD13 ILE 17 11.302 3.238 5.649
116 H SER 18 H SER 18 4.229 4.252 4.376
117 HA SER 18 HA SER 18 3.579 4.474 1.683
118 HB2 SER 18 HB2 SER 18 2.809 1.844 1.503
119 HB3 SER 18 HB3 SER 18 4.314 2.418 0.770
120 HG SER 18 HG SER 18 5.399 1.541 2.669
121 H PHE 19 H PHE 19 1.249 4.014 1.208
122 HA PHE 19 HA PHE 19 -0.336 3.091 3.492
123 HB2 PHE 19 HB2 PHE 19 -0.731 5.888 2.271
124 HB3 PHE 19 HB3 PHE 19 -1.733 5.182 3.548
125 HD1 PHE 19 HD2 PHE 19 1.703 6.425 2.651
126 HD2 PHE 19 HD1 PHE 19 -0.977 5.433 5.868
127 HE1 PHE 19 HE2 PHE 19 3.337 7.300 4.284
128 HE2 PHE 19 HE1 PHE 19 0.645 6.343 7.497
129 HZ PHE 19 HZ PHE 19 2.788 7.323 6.705
130 H TYR 20 H TYR 20 -2.841 3.236 2.801
131 HA TYR 20 HA TYR 20 -2.977 1.237 0.790
132 HB2 TYR 20 HB2 TYR 20 -5.129 3.146 1.884
133 HB3 TYR 20 HB3 TYR 20 -5.493 1.774 0.815
134 HD1 TYR 20 HD2 TYR 20 -2.860 0.761 3.150
135 HD2 TYR 20 HD1 TYR 20 -7.093 1.468 2.805
136 HE1 TYR 20 HE2 TYR 20 -3.267 -0.862 4.923
137 HE2 TYR 20 HE1 TYR 20 -7.497 -0.157 4.623
138 HH TYR 20 HH TYR 20 -4.907 -2.095 6.137
139 H GLY 21 H GLY 21 -4.552 1.454 -1.286
140 HA2 GLY 21 HA3 GLY 21 -5.164 2.666 -3.210
141 HA3 GLY 21 HA2 GLY 21 -4.456 4.133 -2.499
Start of MODEL 14
1 H1 GLY 1 H GLY 1 2.269 0.189 0.729
2 HA2 GLY 1 HA3 GLY 1 2.976 -0.207 -1.458
3 HA3 GLY 1 HA2 GLY 1 1.456 -1.070 -1.767
4 H GLY 2 H GLY 2 1.500 2.340 -0.497
5 HA2 GLY 2 HA3 GLY 2 1.423 3.572 -3.093
6 HA3 GLY 2 HA2 GLY 2 -0.235 3.258 -2.498
7 H ALA 3 H ALA 3 -0.832 5.524 -2.011
8 HA ALA 3 HA ALA 3 0.651 6.674 0.309
9 HB1 ALA 3 HB1 ALA 3 1.800 7.539 -1.742
10 HB2 ALA 3 HB2 ALA 3 0.230 8.144 -2.352
11 HB3 ALA 3 HB3 ALA 3 0.948 8.845 -0.866
12 H GLY 4 H GLY 4 -1.869 5.444 0.436
13 HA2 GLY 4 HA3 GLY 4 -3.894 7.609 0.273
14 HA3 GLY 4 HA2 GLY 4 -4.157 5.895 0.642
15 H HIS 5 H HIS 5 -5.307 6.260 2.654
16 HA HIS 5 HA HIS 5 -4.053 8.068 4.634
17 HB2 HIS 5 HB2 HIS 5 -6.799 6.797 4.337
18 HB3 HIS 5 HB3 HIS 5 -6.222 7.050 5.988
19 HD1 HIS 5 HD1 HIS 5 -5.282 9.460 6.549
20 HD2 HIS 5 HD2 HIS 5 -7.869 9.071 3.257
21 HE1 HIS 5 HE1 HIS 5 -6.189 11.776 6.126
22 H VAL 6 H VAL 6 -4.611 4.468 4.291
23 HA VAL 6 HA VAL 6 -3.882 4.233 7.158
24 HB VAL 6 HB VAL 6 -4.946 2.193 5.174
25 HG11 VAL 6 HG11 VAL 6 -5.429 0.762 7.137
26 HG12 VAL 6 HG12 VAL 6 -3.682 1.107 7.071
27 HG13 VAL 6 HG13 VAL 6 -4.732 1.972 8.241
28 HG21 VAL 6 HG21 VAL 6 -7.124 2.478 6.377
29 HG22 VAL 6 HG22 VAL 6 -6.408 3.776 7.376
30 HG23 VAL 6 HG23 VAL 6 -6.616 4.005 5.618
31 HA PRO 7 HA PRO 7 0.229 3.090 5.633
32 HB2 PRO 7 HB2 PRO 7 1.366 1.826 7.815
33 HB3 PRO 7 HB3 PRO 7 1.084 3.595 7.706
34 HG2 PRO 7 HG2 PRO 7 -0.760 1.539 8.991
35 HG3 PRO 7 HG3 PRO 7 -0.129 3.052 9.736
36 HD2 PRO 7 HD2 PRO 7 -2.608 3.018 8.658
37 HD3 PRO 7 HD3 PRO 7 -1.547 4.437 8.298
38 H GLU 8 H GLU 8 1.142 1.211 4.488
39 HA GLU 8 HA GLU 8 -0.565 -1.218 4.540
40 HB2 GLU 8 HB2 GLU 8 1.901 -0.585 2.849
41 HB3 GLU 8 HB3 GLU 8 0.880 -2.040 2.691
42 HG2 GLU 8 HG2 GLU 8 -1.081 -0.619 2.139
43 HG3 GLU 8 HG3 GLU 8 -0.069 0.845 2.241
44 H TYR 9 H TYR 9 2.958 -0.278 5.070
45 HA TYR 9 HA TYR 9 3.276 -2.800 6.678
46 HB2 TYR 9 HB2 TYR 9 5.255 -1.582 4.655
47 HB3 TYR 9 HB3 TYR 9 5.442 -3.129 5.508
48 HD1 TYR 9 HD2 TYR 9 3.586 -4.939 5.138
49 HD2 TYR 9 HD1 TYR 9 4.199 -1.610 2.480
50 HE1 TYR 9 HE2 TYR 9 2.463 -6.179 3.330
51 HE2 TYR 9 HE1 TYR 9 3.024 -2.832 0.685
52 HH TYR 9 HH TYR 9 1.868 -6.189 1.011
53 H PHE 10 H PHE 10 5.520 -2.638 7.898
54 HA PHE 10 HA PHE 10 6.124 0.205 8.624
55 HB2 PHE 10 HB2 PHE 10 5.441 -2.122 10.513
56 HB3 PHE 10 HB3 PHE 10 6.249 -0.636 11.051
57 HD1 PHE 10 HD1 PHE 10 3.086 -1.942 9.485
58 HD2 PHE 10 HD2 PHE 10 5.020 1.479 11.244
59 HE1 PHE 10 HE1 PHE 10 0.882 -0.867 9.831
60 HE2 PHE 10 HE2 PHE 10 2.804 2.494 11.694
61 HZ PHE 10 HZ PHE 10 0.734 1.253 11.118
62 H VAL 11 H VAL 11 8.221 0.292 9.925
63 HA VAL 11 HA VAL 11 10.156 -1.621 8.656
64 HB VAL 11 HB VAL 11 11.848 0.018 8.937
65 HG11 VAL 11 HG11 VAL 11 9.331 1.657 8.304
66 HG12 VAL 11 HG12 VAL 11 11.003 2.016 7.807
67 HG13 VAL 11 HG13 VAL 11 10.170 0.578 7.154
68 HG21 VAL 11 HG21 VAL 11 11.457 2.178 10.265
69 HG22 VAL 11 HG22 VAL 11 10.013 1.395 10.971
70 HG23 VAL 11 HG23 VAL 11 11.622 0.722 11.267
71 H ARG 12 H ARG 12 12.215 -1.575 10.664
72 HA ARG 12 HA ARG 12 10.914 -3.249 12.680
73 HB2 ARG 12 HB2 ARG 12 13.826 -2.299 12.619
74 HB3 ARG 12 HB3 ARG 12 13.112 -3.590 13.613
75 HG2 ARG 12 HG2 ARG 12 12.420 -4.679 11.262
76 HG3 ARG 12 HG3 ARG 12 13.589 -3.534 10.569
77 HD2 ARG 12 HD2 ARG 12 14.783 -5.584 10.899
78 HD3 ARG 12 HD3 ARG 12 15.336 -4.458 12.186
79 HE ARG 12 HE ARG 12 13.121 -6.035 13.162
80 HH11 ARG 12 HH11 ARG 12 16.565 -6.461 12.199
81 HH12 ARG 12 HH12 ARG 12 16.756 -7.859 13.249
82 HH21 ARG 12 HH21 ARG 12 13.460 -7.830 14.467
83 HH22 ARG 12 HH22 ARG 12 15.037 -8.624 14.510
84 H GLY 13 H GLY 13 9.359 -1.329 13.290
85 HA2 GLY 13 HA3 GLY 13 8.738 -0.000 15.094
86 HA3 GLY 13 HA2 GLY 13 10.251 -0.493 15.866
87 H ASP 14 H ASP 14 8.888 1.855 13.388
88 HA ASP 14 HA ASP 14 10.245 3.922 14.833
89 HB2 ASP 14 HB2 ASP 14 12.056 2.793 13.146
90 HB3 ASP 14 HB3 ASP 14 11.333 3.912 11.986
91 H THR 15 H THR 15 9.090 3.449 11.366
92 HA THR 15 HA THR 15 6.713 4.960 11.881
93 HB THR 15 HB THR 15 8.006 6.975 11.927
94 HG1 THR 15 HG1 THR 15 7.242 6.771 9.179
95 HG21 THR 15 HG21 THR 15 9.673 5.894 9.568
96 HG22 THR 15 HG22 THR 15 10.224 6.120 11.256
97 HG23 THR 15 HG23 THR 15 9.795 7.538 10.263
98 HA PRO 16 HA PRO 16 6.193 2.532 8.140
99 HB2 PRO 16 HB2 PRO 16 3.749 3.394 7.163
100 HB3 PRO 16 HB3 PRO 16 3.879 2.574 8.750
101 HG2 PRO 16 HG2 PRO 16 3.908 5.594 8.260
102 HG3 PRO 16 HG3 PRO 16 2.758 4.713 9.312
103 HD2 PRO 16 HD2 PRO 16 4.992 5.874 10.384
104 HD3 PRO 16 HD3 PRO 16 4.542 4.213 10.925
105 H ILE 17 H ILE 17 6.324 2.720 5.717
106 HA ILE 17 HA ILE 17 7.117 5.490 4.825
107 HB ILE 17 HB ILE 17 8.280 2.813 3.919
108 HG12 ILE 17 HG12 ILE 17 8.812 3.001 6.305
109 HG13 ILE 17 HG13 ILE 17 10.257 3.162 5.300
110 HG21 ILE 17 HG21 ILE 17 10.273 4.394 3.228
111 HG22 ILE 17 HG22 ILE 17 8.838 4.412 2.209
112 HG23 ILE 17 HG23 ILE 17 9.098 5.726 3.384
113 HD11 ILE 17 HD11 ILE 17 10.121 5.720 5.617
114 HD12 ILE 17 HD12 ILE 17 8.808 5.437 6.791
115 HD13 ILE 17 HD13 ILE 17 10.431 4.785 7.101
116 H SER 18 H SER 18 4.364 3.944 4.615
117 HA SER 18 HA SER 18 3.875 4.669 1.884
118 HB2 SER 18 HB2 SER 18 3.456 2.273 1.039
119 HB3 SER 18 HB3 SER 18 5.170 2.674 1.217
120 HG SER 18 HG SER 18 3.693 1.217 3.188
121 H PHE 19 H PHE 19 1.560 4.181 1.236
122 HA PHE 19 HA PHE 19 -0.107 3.094 3.431
123 HB2 PHE 19 HB2 PHE 19 -0.461 5.917 2.267
124 HB3 PHE 19 HB3 PHE 19 -1.487 5.185 3.512
125 HD1 PHE 19 HD1 PHE 19 1.971 6.413 2.707
126 HD2 PHE 19 HD2 PHE 19 -0.813 5.433 5.844
127 HE1 PHE 19 HE1 PHE 19 3.576 7.242 4.392
128 HE2 PHE 19 HE2 PHE 19 0.769 6.325 7.521
129 HZ PHE 19 HZ PHE 19 2.941 7.293 6.791
130 H TYR 20 H TYR 20 -2.609 3.318 2.645
131 HA TYR 20 HA TYR 20 -2.685 1.325 0.625
132 HB2 TYR 20 HB2 TYR 20 -4.857 3.272 1.615
133 HB3 TYR 20 HB3 TYR 20 -5.188 1.908 0.522
134 HD1 TYR 20 HD2 TYR 20 -2.697 0.873 2.998
135 HD2 TYR 20 HD1 TYR 20 -6.900 1.595 2.417
136 HE1 TYR 20 HE2 TYR 20 -3.205 -0.767 4.727
137 HE2 TYR 20 HE1 TYR 20 -7.411 -0.035 4.203
138 HH TYR 20 HH TYR 20 -4.914 -1.938 5.908
139 H GLY 21 H GLY 21 -4.095 1.570 -1.547
140 HA2 GLY 21 HA3 GLY 21 -2.756 3.586 -3.162
141 HA3 GLY 21 HA2 GLY 21 -4.084 2.532 -3.688
Start of MODEL 15
1 H1 GLY 1 H GLY 1 2.389 -0.060 0.953
2 HA2 GLY 1 HA3 GLY 1 3.157 -0.401 -1.217
3 HA3 GLY 1 HA2 GLY 1 1.701 -1.371 -1.522
4 H GLY 2 H GLY 2 1.433 2.062 -0.376
5 HA2 GLY 2 HA3 GLY 2 1.327 3.164 -3.063
6 HA3 GLY 2 HA2 GLY 2 -0.297 2.833 -2.391
7 H ALA 3 H ALA 3 -0.926 5.126 -2.027
8 HA ALA 3 HA ALA 3 0.580 6.425 0.194
9 HB1 ALA 3 HB1 ALA 3 0.878 8.517 -1.108
10 HB2 ALA 3 HB2 ALA 3 1.723 7.157 -1.905
11 HB3 ALA 3 HB3 ALA 3 0.154 7.730 -2.548
12 H GLY 4 H GLY 4 -1.954 5.223 0.421
13 HA2 GLY 4 HA3 GLY 4 -3.949 7.419 0.174
14 HA3 GLY 4 HA2 GLY 4 -4.241 5.723 0.606
15 H HIS 5 H HIS 5 -5.379 6.230 2.626
16 HA HIS 5 HA HIS 5 -4.018 8.026 4.548
17 HB2 HIS 5 HB2 HIS 5 -6.753 6.624 4.541
18 HB3 HIS 5 HB3 HIS 5 -6.044 7.302 6.020
19 HD1 HIS 5 HD1 HIS 5 -8.053 8.871 6.062
20 HD2 HIS 5 HD2 HIS 5 -5.308 9.500 2.934
21 HE1 HIS 5 HE1 HIS 5 -8.501 11.206 5.216
22 H VAL 6 H VAL 6 -4.681 4.421 4.291
23 HA VAL 6 HA VAL 6 -3.941 4.258 7.151
24 HB VAL 6 HB VAL 6 -4.987 2.145 5.240
25 HG11 VAL 6 HG11 VAL 6 -4.791 2.060 8.318
26 HG12 VAL 6 HG12 VAL 6 -5.487 0.800 7.273
27 HG13 VAL 6 HG13 VAL 6 -3.739 1.139 7.196
28 HG21 VAL 6 HG21 VAL 6 -6.671 3.963 5.596
29 HG22 VAL 6 HG22 VAL 6 -7.176 2.471 6.421
30 HG23 VAL 6 HG23 VAL 6 -6.469 3.816 7.363
31 HA PRO 7 HA PRO 7 0.187 3.076 5.688
32 HB2 PRO 7 HB2 PRO 7 1.308 1.888 7.923
33 HB3 PRO 7 HB3 PRO 7 1.041 3.651 7.745
34 HG2 PRO 7 HG2 PRO 7 -0.814 1.664 9.115
35 HG3 PRO 7 HG3 PRO 7 -0.189 3.211 9.785
36 HD2 PRO 7 HD2 PRO 7 -2.661 3.116 8.702
37 HD3 PRO 7 HD3 PRO 7 -1.609 4.525 8.284
38 H GLU 8 H GLU 8 1.103 1.146 4.615
39 HA GLU 8 HA GLU 8 -0.672 -1.217 4.664
40 HB2 GLU 8 HB2 GLU 8 1.915 -0.750 3.104
41 HB3 GLU 8 HB3 GLU 8 0.850 -2.166 2.942
42 HG2 GLU 8 HG2 GLU 8 -1.033 -0.693 2.242
43 HG3 GLU 8 HG3 GLU 8 0.034 0.728 2.345
44 H TYR 9 H TYR 9 2.852 -0.437 5.377
45 HA TYR 9 HA TYR 9 2.796 -2.539 7.467
46 HB2 TYR 9 HB2 TYR 9 4.822 -3.660 6.417
47 HB3 TYR 9 HB3 TYR 9 3.371 -3.787 5.409
48 HD1 TYR 9 HD2 TYR 9 6.559 -1.830 5.880
49 HD2 TYR 9 HD1 TYR 9 3.368 -2.833 3.175
50 HE1 TYR 9 HE2 TYR 9 7.764 -0.712 4.049
51 HE2 TYR 9 HE1 TYR 9 4.559 -1.678 1.346
52 HH TYR 9 HH TYR 9 7.810 -0.260 1.698
53 H PHE 10 H PHE 10 5.110 -2.583 8.578
54 HA PHE 10 HA PHE 10 6.061 0.268 8.747
55 HB2 PHE 10 HB2 PHE 10 5.459 -1.760 10.974
56 HB3 PHE 10 HB3 PHE 10 6.307 -0.226 11.233
57 HD1 PHE 10 HD1 PHE 10 3.053 -1.675 9.969
58 HD2 PHE 10 HD2 PHE 10 5.058 1.855 11.405
59 HE1 PHE 10 HE1 PHE 10 0.872 -0.544 10.252
60 HE2 PHE 10 HE2 PHE 10 2.859 2.911 11.848
61 HZ PHE 10 HZ PHE 10 0.768 1.672 11.368
62 H VAL 11 H VAL 11 8.257 0.373 9.886
63 HA VAL 11 HA VAL 11 9.980 -1.810 8.777
64 HB VAL 11 HB VAL 11 11.820 -0.334 8.895
65 HG11 VAL 11 HG11 VAL 11 10.115 0.292 7.123
66 HG12 VAL 11 HG12 VAL 11 9.480 1.549 8.221
67 HG13 VAL 11 HG13 VAL 11 11.153 1.653 7.630
68 HG21 VAL 11 HG21 VAL 11 11.739 1.918 10.074
69 HG22 VAL 11 HG22 VAL 11 10.204 1.399 10.829
70 HG23 VAL 11 HG23 VAL 11 11.711 0.539 11.192
71 H ARG 12 H ARG 12 12.065 -1.892 10.716
72 HA ARG 12 HA ARG 12 10.659 -3.242 12.875
73 HB2 ARG 12 HB2 ARG 12 13.648 -2.574 12.698
74 HB3 ARG 12 HB3 ARG 12 12.830 -3.654 13.855
75 HG2 ARG 12 HG2 ARG 12 11.936 -4.895 11.649
76 HG3 ARG 12 HG3 ARG 12 13.255 -4.050 10.828
77 HD2 ARG 12 HD2 ARG 12 14.915 -5.029 12.374
78 HD3 ARG 12 HD3 ARG 12 13.689 -5.904 13.284
79 HE ARG 12 HE ARG 12 14.848 -6.603 10.687
80 HH11 ARG 12 HH11 ARG 12 11.818 -6.974 12.645
81 HH12 ARG 12 HH12 ARG 12 11.341 -8.394 11.732
82 HH21 ARG 12 HH21 ARG 12 14.133 -8.432 9.616
83 HH22 ARG 12 HH22 ARG 12 12.620 -9.214 10.071
84 H GLY 13 H GLY 13 9.247 -1.317 13.496
85 HA2 GLY 13 HA3 GLY 13 8.754 0.132 15.245
86 HA3 GLY 13 HA2 GLY 13 10.281 -0.392 15.970
87 H ASP 14 H ASP 14 8.938 1.876 13.404
88 HA ASP 14 HA ASP 14 10.412 3.973 14.711
89 HB2 ASP 14 HB2 ASP 14 12.149 2.709 13.099
90 HB3 ASP 14 HB3 ASP 14 11.378 3.661 11.826
91 H THR 15 H THR 15 9.052 3.331 11.347
92 HA THR 15 HA THR 15 6.818 5.029 11.810
93 HB THR 15 HB THR 15 8.218 6.982 11.735
94 HG1 THR 15 HG1 THR 15 7.631 7.869 9.621
95 HG21 THR 15 HG21 THR 15 9.747 5.705 9.377
96 HG22 THR 15 HG22 THR 15 10.362 5.913 11.042
97 HG23 THR 15 HG23 THR 15 10.033 7.339 10.035
98 HA PRO 16 HA PRO 16 6.123 2.544 8.134
99 HB2 PRO 16 HB2 PRO 16 3.701 3.472 7.184
100 HB3 PRO 16 HB3 PRO 16 3.829 2.704 8.798
101 HG2 PRO 16 HG2 PRO 16 3.969 5.702 8.199
102 HG3 PRO 16 HG3 PRO 16 2.809 4.905 9.306
103 HD2 PRO 16 HD2 PRO 16 5.123 6.017 10.274
104 HD3 PRO 16 HD3 PRO 16 4.609 4.410 10.906
105 H ILE 17 H ILE 17 6.298 2.650 5.727
106 HA ILE 17 HA ILE 17 7.140 5.375 4.745
107 HB ILE 17 HB ILE 17 8.230 2.643 3.910
108 HG12 ILE 17 HG12 ILE 17 8.774 2.876 6.292
109 HG13 ILE 17 HG13 ILE 17 10.221 2.980 5.282
110 HG21 ILE 17 HG21 ILE 17 9.165 5.516 3.331
111 HG22 ILE 17 HG22 ILE 17 10.253 4.114 3.152
112 HG23 ILE 17 HG23 ILE 17 8.799 4.221 2.164
113 HD11 ILE 17 HD11 ILE 17 10.168 5.536 5.547
114 HD12 ILE 17 HD12 ILE 17 8.819 5.335 6.698
115 HD13 ILE 17 HD13 ILE 17 10.411 4.631 7.062
116 H SER 18 H SER 18 4.348 3.850 4.614
117 HA SER 18 HA SER 18 3.840 4.501 1.864
118 HB2 SER 18 HB2 SER 18 3.409 2.086 1.100
119 HB3 SER 18 HB3 SER 18 5.128 2.458 1.285
120 HG SER 18 HG SER 18 3.615 1.096 3.298
121 H PHE 19 H PHE 19 1.515 3.984 1.243
122 HA PHE 19 HA PHE 19 -0.141 2.988 3.484
123 HB2 PHE 19 HB2 PHE 19 -0.504 5.758 2.199
124 HB3 PHE 19 HB3 PHE 19 -1.543 5.075 3.457
125 HD1 PHE 19 HD1 PHE 19 1.921 6.284 2.647
126 HD2 PHE 19 HD2 PHE 19 -0.887 5.408 5.787
127 HE1 PHE 19 HE1 PHE 19 3.507 7.176 4.316
128 HE2 PHE 19 HE2 PHE 19 0.675 6.361 7.446
129 HZ PHE 19 HZ PHE 19 2.855 7.299 6.706
130 H TYR 20 H TYR 20 -2.642 3.134 2.714
131 HA TYR 20 HA TYR 20 -2.706 1.078 0.759
132 HB2 TYR 20 HB2 TYR 20 -4.908 3.011 1.699
133 HB3 TYR 20 HB3 TYR 20 -5.215 1.604 0.658
134 HD1 TYR 20 HD2 TYR 20 -2.704 0.702 3.166
135 HD2 TYR 20 HD1 TYR 20 -6.917 1.318 2.552
136 HE1 TYR 20 HE2 TYR 20 -3.187 -0.838 4.992
137 HE2 TYR 20 HE1 TYR 20 -7.400 -0.219 4.423
138 HH TYR 20 HH TYR 20 -4.869 -1.911 6.292
139 H GLY 21 H GLY 21 -4.137 1.243 -1.412
140 HA2 GLY 21 HA3 GLY 21 -4.010 3.905 -2.665
141 HA3 GLY 21 HA2 GLY 21 -2.842 2.715 -3.313
Start of MODEL 16
1 H1 GLY 1 H GLY 1 2.425 -0.397 1.076
2 HA2 GLY 1 HA3 GLY 1 3.170 -0.653 -1.105
3 HA3 GLY 1 HA2 GLY 1 1.663 -1.546 -1.415
4 H GLY 2 H GLY 2 1.438 1.886 -0.303
5 HA2 GLY 2 HA3 GLY 2 1.513 2.967 -3.008
6 HA3 GLY 2 HA2 GLY 2 -0.147 2.700 -2.398
7 H ALA 3 H ALA 3 -0.692 5.033 -2.128
8 HA ALA 3 HA ALA 3 0.759 6.322 0.134
9 HB1 ALA 3 HB1 ALA 3 0.492 7.583 -2.654
10 HB2 ALA 3 HB2 ALA 3 1.177 8.378 -1.200
11 HB3 ALA 3 HB3 ALA 3 2.014 6.979 -1.934
12 H GLY 4 H GLY 4 -1.782 5.222 0.335
13 HA2 GLY 4 HA3 GLY 4 -3.728 7.445 -0.056
14 HA3 GLY 4 HA2 GLY 4 -4.067 5.768 0.412
15 H HIS 5 H HIS 5 -5.227 6.340 2.409
16 HA HIS 5 HA HIS 5 -3.859 8.157 4.316
17 HB2 HIS 5 HB2 HIS 5 -6.643 6.846 4.278
18 HB3 HIS 5 HB3 HIS 5 -5.937 7.523 5.760
19 HD1 HIS 5 HD1 HIS 5 -7.804 9.217 5.805
20 HD2 HIS 5 HD2 HIS 5 -5.124 9.590 2.581
21 HE1 HIS 5 HE1 HIS 5 -8.159 11.541 4.886
22 H VAL 6 H VAL 6 -4.652 4.574 4.133
23 HA VAL 6 HA VAL 6 -3.989 4.464 7.009
24 HB VAL 6 HB VAL 6 -5.046 2.339 5.121
25 HG11 VAL 6 HG11 VAL 6 -5.635 1.042 7.162
26 HG12 VAL 6 HG12 VAL 6 -3.877 1.322 7.128
27 HG13 VAL 6 HG13 VAL 6 -4.928 2.298 8.202
28 HG21 VAL 6 HG21 VAL 6 -6.685 4.220 5.411
29 HG22 VAL 6 HG22 VAL 6 -7.254 2.757 6.244
30 HG23 VAL 6 HG23 VAL 6 -6.524 4.090 7.182
31 HA PRO 7 HA PRO 7 0.151 3.127 5.716
32 HB2 PRO 7 HB2 PRO 7 1.157 1.938 8.013
33 HB3 PRO 7 HB3 PRO 7 0.963 3.704 7.796
34 HG2 PRO 7 HG2 PRO 7 -1.018 1.816 9.136
35 HG3 PRO 7 HG3 PRO 7 -0.365 3.359 9.792
36 HD2 PRO 7 HD2 PRO 7 -2.797 3.318 8.623
37 HD3 PRO 7 HD3 PRO 7 -1.683 4.682 8.212
38 H GLU 8 H GLU 8 1.048 1.152 4.713
39 HA GLU 8 HA GLU 8 -0.799 -1.160 4.718
40 HB2 GLU 8 HB2 GLU 8 1.857 -0.781 3.269
41 HB3 GLU 8 HB3 GLU 8 0.762 -2.176 3.077
42 HG2 GLU 8 HG2 GLU 8 -1.064 -0.642 2.297
43 HG3 GLU 8 HG3 GLU 8 0.056 0.735 2.434
44 H TYR 9 H TYR 9 2.717 -0.463 5.587
45 HA TYR 9 HA TYR 9 2.513 -2.542 7.693
46 HB2 TYR 9 HB2 TYR 9 4.545 -3.739 6.722
47 HB3 TYR 9 HB3 TYR 9 3.123 -3.835 5.668
48 HD1 TYR 9 HD2 TYR 9 6.333 -1.926 6.227
49 HD2 TYR 9 HD1 TYR 9 3.245 -2.951 3.409
50 HE1 TYR 9 HE2 TYR 9 7.598 -0.806 4.422
51 HE2 TYR 9 HE1 TYR 9 4.514 -1.855 1.612
52 HH TYR 9 HH TYR 9 6.454 -0.601 1.041
53 H PHE 10 H PHE 10 4.780 -2.656 8.880
54 HA PHE 10 HA PHE 10 5.894 0.139 9.002
55 HB2 PHE 10 HB2 PHE 10 5.087 -1.763 11.290
56 HB3 PHE 10 HB3 PHE 10 5.991 -0.253 11.511
57 HD1 PHE 10 HD1 PHE 10 2.723 -1.647 10.228
58 HD2 PHE 10 HD2 PHE 10 4.825 1.908 11.441
59 HE1 PHE 10 HE1 PHE 10 0.573 -0.439 10.427
60 HE2 PHE 10 HE2 PHE 10 2.655 3.061 11.787
61 HZ PHE 10 HZ PHE 10 0.528 1.842 11.409
62 H VAL 11 H VAL 11 8.037 0.128 10.265
63 HA VAL 11 HA VAL 11 9.649 -2.171 9.235
64 HB VAL 11 HB VAL 11 11.574 -0.800 9.415
65 HG11 VAL 11 HG11 VAL 11 9.996 -0.117 7.551
66 HG12 VAL 11 HG12 VAL 11 9.387 1.198 8.593
67 HG13 VAL 11 HG13 VAL 11 11.099 1.165 8.110
68 HG21 VAL 11 HG21 VAL 11 9.989 1.079 11.248
69 HG22 VAL 11 HG22 VAL 11 11.400 0.118 11.717
70 HG23 VAL 11 HG23 VAL 11 11.598 1.452 10.567
71 H ARG 12 H ARG 12 11.685 -2.355 11.147
72 HA ARG 12 HA ARG 12 10.310 -3.597 13.387
73 HB2 ARG 12 HB2 ARG 12 13.270 -2.897 13.022
74 HB3 ARG 12 HB3 ARG 12 12.591 -3.937 14.289
75 HG2 ARG 12 HG2 ARG 12 12.710 -5.768 12.883
76 HG3 ARG 12 HG3 ARG 12 11.613 -4.980 11.732
77 HD2 ARG 12 HD2 ARG 12 13.554 -3.833 10.657
78 HD3 ARG 12 HD3 ARG 12 14.664 -4.652 11.816
79 HE ARG 12 HE ARG 12 13.098 -6.662 10.532
80 HH11 ARG 12 HH11 ARG 12 15.639 -4.249 9.683
81 HH12 ARG 12 HH12 ARG 12 16.235 -5.243 8.360
82 HH21 ARG 12 HH21 ARG 12 13.940 -7.859 8.824
83 HH22 ARG 12 HH22 ARG 12 15.301 -7.246 7.882
84 H GLY 13 H GLY 13 8.963 -1.514 13.890
85 HA2 GLY 13 HA3 GLY 13 8.556 0.039 15.568
86 HA3 GLY 13 HA2 GLY 13 10.065 -0.505 16.312
87 H ASP 14 H ASP 14 8.799 1.684 13.632
88 HA ASP 14 HA ASP 14 10.300 3.771 14.906
89 HB2 ASP 14 HB2 ASP 14 12.067 2.536 13.358
90 HB3 ASP 14 HB3 ASP 14 11.288 3.402 12.027
91 H THR 15 H THR 15 9.027 3.184 11.482
92 HA THR 15 HA THR 15 6.733 4.742 12.000
93 HB THR 15 HB THR 15 9.079 6.356 11.659
94 HG1 THR 15 HG1 THR 15 7.040 7.075 12.626
95 HG21 THR 15 HG21 THR 15 9.053 5.908 9.175
96 HG22 THR 15 HG22 THR 15 8.799 7.622 9.613
97 HG23 THR 15 HG23 THR 15 7.414 6.634 9.101
98 HA PRO 16 HA PRO 16 5.987 2.403 8.311
99 HB2 PRO 16 HB2 PRO 16 3.737 3.551 7.173
100 HB3 PRO 16 HB3 PRO 16 3.684 2.846 8.819
101 HG2 PRO 16 HG2 PRO 16 4.224 5.779 8.118
102 HG3 PRO 16 HG3 PRO 16 2.894 5.175 9.159
103 HD2 PRO 16 HD2 PRO 16 5.259 6.038 10.288
104 HD3 PRO 16 HD3 PRO 16 4.508 4.519 10.903
105 H ILE 17 H ILE 17 6.080 2.432 5.838
106 HA ILE 17 HA ILE 17 7.002 5.054 4.715
107 HB ILE 17 HB ILE 17 8.423 2.411 4.114
108 HG12 ILE 17 HG12 ILE 17 9.288 4.512 6.188
109 HG13 ILE 17 HG13 ILE 17 8.780 2.835 6.524
110 HG21 ILE 17 HG21 ILE 17 8.532 4.513 2.490
111 HG22 ILE 17 HG22 ILE 17 9.471 5.295 3.774
112 HG23 ILE 17 HG23 ILE 17 10.075 3.809 2.980
113 HD11 ILE 17 HD11 ILE 17 11.225 3.007 6.605
114 HD12 ILE 17 HD12 ILE 17 10.747 1.952 5.239
115 HD13 ILE 17 HD13 ILE 17 11.319 3.625 4.952
116 H SER 18 H SER 18 4.388 4.193 4.502
117 HA SER 18 HA SER 18 3.911 4.261 1.807
118 HB2 SER 18 HB2 SER 18 3.165 1.792 1.353
119 HB3 SER 18 HB3 SER 18 4.889 2.093 1.221
120 HG SER 18 HG SER 18 3.650 1.016 3.582
121 H PHE 19 H PHE 19 1.571 3.880 1.262
122 HA PHE 19 HA PHE 19 -0.139 3.013 3.508
123 HB2 PHE 19 HB2 PHE 19 -0.391 5.764 2.143
124 HB3 PHE 19 HB3 PHE 19 -1.491 5.144 3.383
125 HD1 PHE 19 HD1 PHE 19 2.040 6.232 2.651
126 HD2 PHE 19 HD2 PHE 19 -0.870 5.478 5.730
127 HE1 PHE 19 HE1 PHE 19 3.599 7.125 4.347
128 HE2 PHE 19 HE2 PHE 19 0.670 6.423 7.415
129 HZ PHE 19 HZ PHE 19 2.891 7.297 6.721
130 H TYR 20 H TYR 20 -2.627 3.221 2.639
131 HA TYR 20 HA TYR 20 -2.680 1.119 0.722
132 HB2 TYR 20 HB2 TYR 20 -4.853 3.145 1.544
133 HB3 TYR 20 HB3 TYR 20 -5.167 1.728 0.522
134 HD1 TYR 20 HD1 TYR 20 -2.759 0.785 3.124
135 HD2 TYR 20 HD2 TYR 20 -6.931 1.552 2.389
136 HE1 TYR 20 HE1 TYR 20 -3.347 -0.704 4.958
137 HE2 TYR 20 HE2 TYR 20 -7.519 0.062 4.269
138 HH TYR 20 HH TYR 20 -5.096 -1.722 6.204
139 H GLY 21 H GLY 21 -4.124 1.408 -1.529
140 HA2 GLY 21 HA3 GLY 21 -2.592 2.905 -3.303
141 HA3 GLY 21 HA2 GLY 21 -4.308 2.514 -3.585
Start of MODEL 17
1 H1 GLY 1 H GLY 1 2.615 -0.224 0.989
2 HA2 GLY 1 HA3 GLY 1 3.312 -0.286 -1.220
3 HA3 GLY 1 HA2 GLY 1 1.882 -1.306 -1.500
4 H GLY 2 H GLY 2 1.464 2.114 -0.327
5 HA2 GLY 2 HA3 GLY 2 1.327 3.212 -3.032
6 HA3 GLY 2 HA2 GLY 2 -0.274 2.833 -2.325
7 H ALA 3 H ALA 3 -0.935 5.139 -2.012
8 HA ALA 3 HA ALA 3 0.544 6.482 0.199
9 HB1 ALA 3 HB1 ALA 3 0.091 7.757 -2.557
10 HB2 ALA 3 HB2 ALA 3 0.798 8.568 -1.124
11 HB3 ALA 3 HB3 ALA 3 1.669 7.218 -1.909
12 H GLY 4 H GLY 4 -1.978 5.233 0.414
13 HA2 GLY 4 HA3 GLY 4 -4.011 7.388 0.130
14 HA3 GLY 4 HA2 GLY 4 -4.275 5.691 0.562
15 H HIS 5 H HIS 5 -5.431 6.137 2.565
16 HA HIS 5 HA HIS 5 -4.211 8.044 4.475
17 HB2 HIS 5 HB2 HIS 5 -6.927 6.658 4.275
18 HB3 HIS 5 HB3 HIS 5 -6.329 7.113 5.876
19 HD1 HIS 5 HD1 HIS 5 -6.329 8.952 2.538
20 HD2 HIS 5 HD2 HIS 5 -7.226 9.425 6.620
21 HE1 HIS 5 HE1 HIS 5 -7.125 11.349 2.801
22 H VAL 6 H VAL 6 -4.682 4.412 4.268
23 HA VAL 6 HA VAL 6 -3.969 4.330 7.145
24 HB VAL 6 HB VAL 6 -4.994 2.181 5.258
25 HG11 VAL 6 HG11 VAL 6 -5.464 0.825 7.293
26 HG12 VAL 6 HG12 VAL 6 -3.723 1.184 7.208
27 HG13 VAL 6 HG13 VAL 6 -4.780 2.095 8.329
28 HG21 VAL 6 HG21 VAL 6 -7.184 2.493 6.446
29 HG22 VAL 6 HG22 VAL 6 -6.477 3.833 7.392
30 HG23 VAL 6 HG23 VAL 6 -6.696 3.995 5.630
31 HA PRO 7 HA PRO 7 0.182 3.205 5.715
32 HB2 PRO 7 HB2 PRO 7 1.303 2.010 7.956
33 HB3 PRO 7 HB3 PRO 7 1.017 3.769 7.785
34 HG2 PRO 7 HG2 PRO 7 -0.846 1.753 9.116
35 HG3 PRO 7 HG3 PRO 7 -0.234 3.294 9.814
36 HD2 PRO 7 HD2 PRO 7 -2.688 3.207 8.715
37 HD3 PRO 7 HD3 PRO 7 -1.641 4.616 8.293
38 H GLU 8 H GLU 8 1.216 1.289 4.710
39 HA GLU 8 HA GLU 8 -0.518 -1.110 4.680
40 HB2 GLU 8 HB2 GLU 8 2.098 -0.567 3.206
41 HB3 GLU 8 HB3 GLU 8 1.064 -2.003 2.988
42 HG2 GLU 8 HG2 GLU 8 -0.834 -0.535 2.270
43 HG3 GLU 8 HG3 GLU 8 0.227 0.888 2.416
44 H TYR 9 H TYR 9 2.977 -0.258 5.528
45 HA TYR 9 HA TYR 9 2.877 -2.364 7.599
46 HB2 TYR 9 HB2 TYR 9 4.875 -3.549 6.567
47 HB3 TYR 9 HB3 TYR 9 3.443 -3.616 5.533
48 HD1 TYR 9 HD2 TYR 9 6.675 -1.761 6.093
49 HD2 TYR 9 HD1 TYR 9 3.542 -2.675 3.295
50 HE1 TYR 9 HE2 TYR 9 7.947 -0.645 4.312
51 HE2 TYR 9 HE1 TYR 9 4.814 -1.543 1.507
52 HH TYR 9 HH TYR 9 8.024 -0.061 1.999
53 H PHE 10 H PHE 10 5.217 -2.478 8.686
54 HA PHE 10 HA PHE 10 6.239 0.341 8.910
55 HB2 PHE 10 HB2 PHE 10 5.536 -1.692 11.116
56 HB3 PHE 10 HB3 PHE 10 6.287 -0.120 11.419
57 HD1 PHE 10 HD1 PHE 10 3.159 -1.765 10.166
58 HD2 PHE 10 HD2 PHE 10 4.994 1.974 11.245
59 HE1 PHE 10 HE1 PHE 10 0.927 -0.715 10.346
60 HE2 PHE 10 HE2 PHE 10 2.747 2.968 11.587
61 HZ PHE 10 HZ PHE 10 0.717 1.588 11.245
62 H VAL 11 H VAL 11 8.383 0.154 10.433
63 HA VAL 11 HA VAL 11 10.037 -1.966 9.094
64 HB VAL 11 HB VAL 11 11.468 0.322 10.400
65 HG11 VAL 11 HG11 VAL 11 12.872 0.193 8.358
66 HG12 VAL 11 HG12 VAL 11 12.560 -1.483 8.859
67 HG13 VAL 11 HG13 VAL 11 11.634 -0.779 7.516
68 HG21 VAL 11 HG21 VAL 11 11.136 1.948 8.548
69 HG22 VAL 11 HG22 VAL 11 9.774 0.959 7.929
70 HG23 VAL 11 HG23 VAL 11 9.693 1.757 9.526
71 H ARG 12 H ARG 12 12.221 -1.821 11.129
72 HA ARG 12 HA ARG 12 10.851 -3.376 13.209
73 HB2 ARG 12 HB2 ARG 12 13.770 -2.451 12.981
74 HB3 ARG 12 HB3 ARG 12 13.130 -3.585 14.194
75 HG2 ARG 12 HG2 ARG 12 13.242 -4.069 11.142
76 HG3 ARG 12 HG3 ARG 12 14.319 -4.760 12.371
77 HD2 ARG 12 HD2 ARG 12 12.275 -5.813 13.482
78 HD3 ARG 12 HD3 ARG 12 11.316 -5.443 12.056
79 HE ARG 12 HE ARG 12 13.402 -7.492 12.417
80 HH11 ARG 12 HH11 ARG 12 11.811 -5.477 9.865
81 HH12 ARG 12 HH12 ARG 12 12.236 -6.632 8.612
82 HH21 ARG 12 HH21 ARG 12 13.891 -8.879 10.732
83 HH22 ARG 12 HH22 ARG 12 13.383 -8.511 9.083
84 H GLY 13 H GLY 13 9.342 -1.412 13.732
85 HA2 GLY 13 HA3 GLY 13 8.798 0.126 15.401
86 HA3 GLY 13 HA2 GLY 13 10.316 -0.325 16.193
87 H ASP 14 H ASP 14 8.937 1.748 13.499
88 HA ASP 14 HA ASP 14 10.711 3.891 14.425
89 HB2 ASP 14 HB2 ASP 14 12.309 2.746 12.974
90 HB3 ASP 14 HB3 ASP 14 11.129 2.631 11.657
91 H THR 15 H THR 15 8.863 3.180 11.340
92 HA THR 15 HA THR 15 6.666 4.803 11.924
93 HB THR 15 HB THR 15 7.672 6.661 10.004
94 HG1 THR 15 HG1 THR 15 9.862 5.892 10.441
95 HG21 THR 15 HG21 THR 15 7.703 8.362 11.738
96 HG22 THR 15 HG22 THR 15 7.642 7.158 13.039
97 HG23 THR 15 HG23 THR 15 6.259 7.339 11.942
98 HA PRO 16 HA PRO 16 5.998 2.572 8.141
99 HB2 PRO 16 HB2 PRO 16 3.696 3.647 7.053
100 HB3 PRO 16 HB3 PRO 16 3.685 2.907 8.683
101 HG2 PRO 16 HG2 PRO 16 4.091 5.876 8.059
102 HG3 PRO 16 HG3 PRO 16 2.798 5.195 9.095
103 HD2 PRO 16 HD2 PRO 16 5.144 6.128 10.183
104 HD3 PRO 16 HD3 PRO 16 4.457 4.589 10.823
105 H ILE 17 H ILE 17 6.035 2.729 5.661
106 HA ILE 17 HA ILE 17 6.985 5.402 4.691
107 HB ILE 17 HB ILE 17 8.287 2.784 3.803
108 HG12 ILE 17 HG12 ILE 17 9.249 4.486 6.170
109 HG13 ILE 17 HG13 ILE 17 8.657 2.806 6.236
110 HG21 ILE 17 HG21 ILE 17 9.475 5.632 3.882
111 HG22 ILE 17 HG22 ILE 17 10.049 4.243 2.911
112 HG23 ILE 17 HG23 ILE 17 8.546 5.064 2.480
113 HD11 ILE 17 HD11 ILE 17 10.570 2.077 4.735
114 HD12 ILE 17 HD12 ILE 17 11.256 3.729 4.861
115 HD13 ILE 17 HD13 ILE 17 11.095 2.728 6.308
116 H SER 18 H SER 18 4.290 4.296 4.504
117 HA SER 18 HA SER 18 3.784 4.535 1.772
118 HB2 SER 18 HB2 SER 18 3.226 2.009 1.284
119 HB3 SER 18 HB3 SER 18 4.924 2.449 1.157
120 HG SER 18 HG SER 18 3.799 1.253 3.509
121 H PHE 19 H PHE 19 1.459 4.057 1.252
122 HA PHE 19 HA PHE 19 -0.169 3.066 3.511
123 HB2 PHE 19 HB2 PHE 19 -0.566 5.825 2.204
124 HB3 PHE 19 HB3 PHE 19 -1.608 5.137 3.454
125 HD1 PHE 19 HD1 PHE 19 1.865 6.355 2.667
126 HD2 PHE 19 HD2 PHE 19 -0.983 5.524 5.782
127 HE1 PHE 19 HE1 PHE 19 3.426 7.275 4.342
128 HE2 PHE 19 HE2 PHE 19 0.561 6.493 7.447
129 HZ PHE 19 HZ PHE 19 2.744 7.429 6.723
130 H TYR 20 H TYR 20 -2.668 3.138 2.741
131 HA TYR 20 HA TYR 20 -2.663 1.076 0.797
132 HB2 TYR 20 HB2 TYR 20 -4.935 2.948 1.710
133 HB3 TYR 20 HB3 TYR 20 -5.197 1.511 0.701
134 HD1 TYR 20 HD2 TYR 20 -2.653 0.694 3.194
135 HD2 TYR 20 HD1 TYR 20 -6.882 1.251 2.629
136 HE1 TYR 20 HE2 TYR 20 -3.094 -0.843 5.031
137 HE2 TYR 20 HE1 TYR 20 -7.320 -0.270 4.522
138 HH TYR 20 HH TYR 20 -4.746 -1.989 6.306
139 H GLY 21 H GLY 21 -4.081 1.171 -1.384
140 HA2 GLY 21 HA3 GLY 21 -4.311 3.752 -2.618
141 HA3 GLY 21 HA2 GLY 21 -2.809 2.952 -3.166
Start of MODEL 18
1 H1 GLY 1 H GLY 1 2.586 -0.168 0.870
2 HA2 GLY 1 HA3 GLY 1 3.269 -0.144 -1.343
3 HA3 GLY 1 HA2 GLY 1 1.865 -1.198 -1.632
4 H GLY 2 H GLY 2 1.472 2.217 -0.402
5 HA2 GLY 2 HA3 GLY 2 1.215 3.346 -3.074
6 HA3 GLY 2 HA2 GLY 2 -0.362 2.930 -2.336
7 H ALA 3 H ALA 3 -1.053 5.222 -1.971
8 HA ALA 3 HA ALA 3 0.446 6.540 0.240
9 HB1 ALA 3 HB1 ALA 3 0.676 8.651 -1.046
10 HB2 ALA 3 HB2 ALA 3 1.545 7.319 -1.862
11 HB3 ALA 3 HB3 ALA 3 -0.040 7.863 -2.487
12 H GLY 4 H GLY 4 -2.082 5.277 0.451
13 HA2 GLY 4 HA3 GLY 4 -4.113 7.442 0.255
14 HA3 GLY 4 HA2 GLY 4 -4.374 5.739 0.668
15 H HIS 5 H HIS 5 -5.505 6.199 2.705
16 HA HIS 5 HA HIS 5 -4.162 7.999 4.645
17 HB2 HIS 5 HB2 HIS 5 -6.882 6.553 4.634
18 HB3 HIS 5 HB3 HIS 5 -6.187 7.278 6.097
19 HD1 HIS 5 HD1 HIS 5 -8.311 8.738 6.020
20 HD2 HIS 5 HD2 HIS 5 -5.417 9.498 3.058
21 HE1 HIS 5 HE1 HIS 5 -8.803 11.062 5.152
22 H VAL 6 H VAL 6 -4.728 4.386 4.313
23 HA VAL 6 HA VAL 6 -4.000 4.195 7.177
24 HB VAL 6 HB VAL 6 -5.012 2.100 5.226
25 HG11 VAL 6 HG11 VAL 6 -5.475 0.695 7.243
26 HG12 VAL 6 HG12 VAL 6 -3.735 1.057 7.151
27 HG13 VAL 6 HG13 VAL 6 -4.784 1.945 8.297
28 HG21 VAL 6 HG21 VAL 6 -6.505 3.684 7.401
29 HG22 VAL 6 HG22 VAL 6 -6.728 3.886 5.643
30 HG23 VAL 6 HG23 VAL 6 -7.203 2.361 6.423
31 HA PRO 7 HA PRO 7 0.154 3.156 5.681
32 HB2 PRO 7 HB2 PRO 7 1.319 1.949 7.894
33 HB3 PRO 7 HB3 PRO 7 1.003 3.704 7.751
34 HG2 PRO 7 HG2 PRO 7 -0.810 1.642 9.080
35 HG3 PRO 7 HG3 PRO 7 -0.220 3.190 9.782
36 HD2 PRO 7 HD2 PRO 7 -2.687 3.055 8.711
37 HD3 PRO 7 HD3 PRO 7 -1.678 4.496 8.305
38 H GLU 8 H GLU 8 1.184 1.279 4.618
39 HA GLU 8 HA GLU 8 -0.518 -1.137 4.560
40 HB2 GLU 8 HB2 GLU 8 2.083 -0.524 3.082
41 HB3 GLU 8 HB3 GLU 8 1.078 -1.979 2.848
42 HG2 GLU 8 HG2 GLU 8 -0.852 -0.545 2.158
43 HG3 GLU 8 HG3 GLU 8 0.169 0.902 2.335
44 H TYR 9 H TYR 9 2.967 -0.269 5.408
45 HA TYR 9 HA TYR 9 2.886 -2.411 7.444
46 HB2 TYR 9 HB2 TYR 9 4.909 -3.546 6.413
47 HB3 TYR 9 HB3 TYR 9 3.488 -3.621 5.364
48 HD1 TYR 9 HD2 TYR 9 6.701 -1.757 5.971
49 HD2 TYR 9 HD1 TYR 9 3.562 -2.598 3.157
50 HE1 TYR 9 HE2 TYR 9 7.994 -0.641 4.203
51 HE2 TYR 9 HE1 TYR 9 4.845 -1.448 1.388
52 HH TYR 9 HH TYR 9 8.118 -0.126 1.866
53 H PHE 10 H PHE 10 5.194 -2.505 8.562
54 HA PHE 10 HA PHE 10 6.155 0.333 8.863
55 HB2 PHE 10 HB2 PHE 10 5.469 -1.797 10.985
56 HB3 PHE 10 HB3 PHE 10 6.242 -0.253 11.360
57 HD1 PHE 10 HD1 PHE 10 3.090 -1.779 10.002
58 HD2 PHE 10 HD2 PHE 10 4.980 1.850 11.327
59 HE1 PHE 10 HE1 PHE 10 0.873 -0.706 10.240
60 HE2 PHE 10 HE2 PHE 10 2.748 2.868 11.702
61 HZ PHE 10 HZ PHE 10 0.697 1.541 11.280
62 H VAL 11 H VAL 11 8.296 0.199 10.336
63 HA VAL 11 HA VAL 11 9.991 -1.966 9.122
64 HB VAL 11 HB VAL 11 11.429 0.384 10.270
65 HG11 VAL 11 HG11 VAL 11 12.768 0.192 8.187
66 HG12 VAL 11 HG12 VAL 11 12.491 -1.459 8.784
67 HG13 VAL 11 HG13 VAL 11 11.517 -0.834 7.433
68 HG21 VAL 11 HG21 VAL 11 11.042 1.953 8.376
69 HG22 VAL 11 HG22 VAL 11 9.675 0.940 7.815
70 HG23 VAL 11 HG23 VAL 11 9.618 1.782 9.390
71 H ARG 12 H ARG 12 12.136 -1.796 11.066
72 HA ARG 12 HA ARG 12 10.768 -3.180 13.247
73 HB2 ARG 12 HB2 ARG 12 13.698 -2.413 12.783
74 HB3 ARG 12 HB3 ARG 12 13.152 -3.352 14.186
75 HG2 ARG 12 HG2 ARG 12 12.436 -4.318 11.366
76 HG3 ARG 12 HG3 ARG 12 14.050 -4.636 12.026
77 HD2 ARG 12 HD2 ARG 12 13.156 -6.035 13.831
78 HD3 ARG 12 HD3 ARG 12 11.558 -5.353 13.653
79 HE ARG 12 HE ARG 12 10.971 -6.789 11.999
80 HH11 ARG 12 HH11 ARG 12 14.573 -6.919 12.297
81 HH12 ARG 12 HH12 ARG 12 14.667 -8.298 11.213
82 HH21 ARG 12 HH21 ARG 12 11.218 -8.542 10.637
83 HH22 ARG 12 HH22 ARG 12 12.819 -9.200 10.294
84 H GLY 13 H GLY 13 9.317 -1.250 13.793
85 HA2 GLY 13 HA3 GLY 13 8.810 0.334 15.424
86 HA3 GLY 13 HA2 GLY 13 10.328 -0.138 16.205
87 H ASP 14 H ASP 14 9.000 1.908 13.445
88 HA ASP 14 HA ASP 14 10.764 4.060 14.362
89 HB2 ASP 14 HB2 ASP 14 12.366 2.737 13.027
90 HB3 ASP 14 HB3 ASP 14 11.263 2.707 11.643
91 H THR 15 H THR 15 9.035 3.298 11.203
92 HA THR 15 HA THR 15 6.841 4.941 11.770
93 HB THR 15 HB THR 15 8.107 6.983 11.769
94 HG1 THR 15 HG1 THR 15 7.261 6.802 9.047
95 HG21 THR 15 HG21 THR 15 9.710 5.912 9.363
96 HG22 THR 15 HG22 THR 15 10.313 6.176 11.025
97 HG23 THR 15 HG23 THR 15 9.831 7.566 10.028
98 HA PRO 16 HA PRO 16 6.101 2.591 8.048
99 HB2 PRO 16 HB2 PRO 16 3.704 3.611 7.073
100 HB3 PRO 16 HB3 PRO 16 3.788 2.776 8.655
101 HG2 PRO 16 HG2 PRO 16 4.024 5.796 8.203
102 HG3 PRO 16 HG3 PRO 16 2.809 4.980 9.238
103 HD2 PRO 16 HD2 PRO 16 5.100 5.969 10.342
104 HD3 PRO 16 HD3 PRO 16 4.581 4.323 10.844
105 H ILE 17 H ILE 17 6.061 2.807 5.579
106 HA ILE 17 HA ILE 17 6.883 5.540 4.655
107 HB ILE 17 HB ILE 17 8.294 2.993 3.720
108 HG12 ILE 17 HG12 ILE 17 9.175 4.693 6.121
109 HG13 ILE 17 HG13 ILE 17 8.664 2.985 6.155
110 HG21 ILE 17 HG21 ILE 17 9.996 4.540 2.861
111 HG22 ILE 17 HG22 ILE 17 8.457 5.293 2.431
112 HG23 ILE 17 HG23 ILE 17 9.352 5.889 3.845
113 HD11 ILE 17 HD11 ILE 17 10.613 2.375 4.652
114 HD12 ILE 17 HD12 ILE 17 11.220 4.054 4.812
115 HD13 ILE 17 HD13 ILE 17 11.095 3.021 6.242
116 H SER 18 H SER 18 4.238 4.332 4.470
117 HA SER 18 HA SER 18 3.721 4.590 1.732
118 HB2 SER 18 HB2 SER 18 3.214 2.054 1.243
119 HB3 SER 18 HB3 SER 18 4.906 2.524 1.129
120 HG SER 18 HG SER 18 3.784 1.305 3.470
121 H PHE 19 H PHE 19 1.400 4.116 1.230
122 HA PHE 19 HA PHE 19 -0.208 3.062 3.473
123 HB2 PHE 19 HB2 PHE 19 -0.638 5.849 2.238
124 HB3 PHE 19 HB3 PHE 19 -1.664 5.120 3.479
125 HD1 PHE 19 HD1 PHE 19 1.793 6.392 2.699
126 HD2 PHE 19 HD2 PHE 19 -1.025 5.459 5.811
127 HE1 PHE 19 HE1 PHE 19 3.366 7.267 4.388
128 HE2 PHE 19 HE2 PHE 19 0.526 6.391 7.491
129 HZ PHE 19 HZ PHE 19 2.711 7.335 6.780
130 H TYR 20 H TYR 20 -2.715 3.133 2.716
131 HA TYR 20 HA TYR 20 -2.671 1.102 0.743
132 HB2 TYR 20 HB2 TYR 20 -4.987 2.908 1.682
133 HB3 TYR 20 HB3 TYR 20 -5.214 1.482 0.651
134 HD1 TYR 20 HD1 TYR 20 -2.652 0.686 3.129
135 HD2 TYR 20 HD2 TYR 20 -6.894 1.147 2.570
136 HE1 TYR 20 HE1 TYR 20 -3.054 -0.867 4.961
137 HE2 TYR 20 HE2 TYR 20 -7.293 -0.395 4.455
138 HH TYR 20 HH TYR 20 -4.682 -1.967 6.313
139 H GLY 21 H GLY 21 -4.034 1.158 -1.428
140 HA2 GLY 21 HA3 GLY 21 -3.007 3.343 -3.063
141 HA3 GLY 21 HA2 GLY 21 -4.146 2.080 -3.576
Start of MODEL 19
1 H1 GLY 1 H GLY 1 2.406 -0.217 0.826
2 HA2 GLY 1 HA3 GLY 1 3.071 -0.351 -1.391
3 HA3 GLY 1 HA2 GLY 1 1.607 -1.326 -1.660
4 H GLY 2 H GLY 2 1.448 2.106 -0.467
5 HA2 GLY 2 HA3 GLY 2 1.192 3.237 -3.111
6 HA3 GLY 2 HA2 GLY 2 -0.410 2.886 -2.395
7 H ALA 3 H ALA 3 -1.006 5.192 -2.058
8 HA ALA 3 HA ALA 3 0.477 6.458 0.194
9 HB1 ALA 3 HB1 ALA 3 0.805 8.564 -1.092
10 HB2 ALA 3 HB2 ALA 3 1.653 7.210 -1.894
11 HB3 ALA 3 HB3 ALA 3 0.091 7.793 -2.544
12 H GLY 4 H GLY 4 -2.049 5.269 0.393
13 HA2 GLY 4 HA3 GLY 4 -4.036 7.472 0.150
14 HA3 GLY 4 HA2 GLY 4 -4.337 5.776 0.569
15 H HIS 5 H HIS 5 -5.443 6.202 2.614
16 HA HIS 5 HA HIS 5 -4.094 8.012 4.540
17 HB2 HIS 5 HB2 HIS 5 -6.820 6.589 4.540
18 HB3 HIS 5 HB3 HIS 5 -6.108 7.277 6.015
19 HD1 HIS 5 HD1 HIS 5 -8.113 8.843 6.083
20 HD2 HIS 5 HD2 HIS 5 -5.424 9.464 2.906
21 HE1 HIS 5 HE1 HIS 5 -8.590 11.168 5.230
22 H VAL 6 H VAL 6 -4.789 4.414 4.294
23 HA VAL 6 HA VAL 6 -4.029 4.245 7.142
24 HB VAL 6 HB VAL 6 -5.067 2.126 5.231
25 HG11 VAL 6 HG11 VAL 6 -5.541 0.772 7.256
26 HG12 VAL 6 HG12 VAL 6 -3.795 1.127 7.176
27 HG13 VAL 6 HG13 VAL 6 -4.852 2.030 8.309
28 HG21 VAL 6 HG21 VAL 6 -7.246 2.428 6.424
29 HG22 VAL 6 HG22 VAL 6 -6.546 3.776 7.369
30 HG23 VAL 6 HG23 VAL 6 -6.758 3.929 5.602
31 HA PRO 7 HA PRO 7 0.107 3.116 5.678
32 HB2 PRO 7 HB2 PRO 7 1.231 1.885 7.899
33 HB3 PRO 7 HB3 PRO 7 0.978 3.652 7.737
34 HG2 PRO 7 HG2 PRO 7 -0.885 1.663 9.092
35 HG3 PRO 7 HG3 PRO 7 -0.263 3.211 9.767
36 HD2 PRO 7 HD2 PRO 7 -2.738 3.113 8.682
37 HD3 PRO 7 HD3 PRO 7 -1.685 4.526 8.272
38 H GLU 8 H GLU 8 1.061 1.223 4.581
39 HA GLU 8 HA GLU 8 -0.695 -1.156 4.544
40 HB2 GLU 8 HB2 GLU 8 1.911 -0.608 3.031
41 HB3 GLU 8 HB3 GLU 8 0.879 -2.053 2.832
42 HG2 GLU 8 HG2 GLU 8 -1.038 -0.580 2.179
43 HG3 GLU 8 HG3 GLU 8 0.033 0.839 2.281
44 H TYR 9 H TYR 9 2.814 -0.379 5.327
45 HA TYR 9 HA TYR 9 2.722 -2.509 7.392
46 HB2 TYR 9 HB2 TYR 9 4.764 -3.621 6.365
47 HB3 TYR 9 HB3 TYR 9 3.324 -3.745 5.338
48 HD1 TYR 9 HD2 TYR 9 6.490 -1.759 5.852
49 HD2 TYR 9 HD1 TYR 9 3.340 -2.796 3.105
50 HE1 TYR 9 HE2 TYR 9 7.712 -0.640 4.031
51 HE2 TYR 9 HE1 TYR 9 4.568 -1.672 1.280
52 HH TYR 9 HH TYR 9 7.761 -0.133 1.698
53 H PHE 10 H PHE 10 4.990 -2.583 8.551
54 HA PHE 10 HA PHE 10 5.953 0.268 8.790
55 HB2 PHE 10 HB2 PHE 10 5.291 -1.817 10.947
56 HB3 PHE 10 HB3 PHE 10 6.157 -0.300 11.261
57 HD1 PHE 10 HD1 PHE 10 2.903 -1.682 9.942
58 HD2 PHE 10 HD2 PHE 10 4.958 1.820 11.378
59 HE1 PHE 10 HE1 PHE 10 0.735 -0.528 10.244
60 HE2 PHE 10 HE2 PHE 10 2.775 2.919 11.799
61 HZ PHE 10 HZ PHE 10 0.665 1.690 11.363
62 H VAL 11 H VAL 11 8.119 0.303 10.016
63 HA VAL 11 HA VAL 11 9.878 -1.803 8.806
64 HB VAL 11 HB VAL 11 11.689 -0.287 9.017
65 HG11 VAL 11 HG11 VAL 11 9.286 1.529 8.339
66 HG12 VAL 11 HG12 VAL 11 10.991 1.750 7.892
67 HG13 VAL 11 HG13 VAL 11 10.070 0.372 7.228
68 HG21 VAL 11 HG21 VAL 11 11.525 1.912 10.295
69 HG22 VAL 11 HG22 VAL 11 10.005 1.306 11.018
70 HG23 VAL 11 HG23 VAL 11 11.542 0.485 11.347
71 H ARG 12 H ARG 12 11.971 -1.935 10.709
72 HA ARG 12 HA ARG 12 10.659 -3.281 12.930
73 HB2 ARG 12 HB2 ARG 12 13.614 -2.492 12.643
74 HB3 ARG 12 HB3 ARG 12 12.884 -3.572 13.852
75 HG2 ARG 12 HG2 ARG 12 11.957 -4.760 11.481
76 HG3 ARG 12 HG3 ARG 12 13.494 -4.072 10.911
77 HD2 ARG 12 HD2 ARG 12 14.675 -5.300 12.800
78 HD3 ARG 12 HD3 ARG 12 13.063 -5.935 13.308
79 HE ARG 12 HE ARG 12 13.541 -6.574 10.534
80 HH11 ARG 12 HH11 ARG 12 14.636 -7.510 13.841
81 HH12 ARG 12 HH12 ARG 12 14.976 -9.159 13.334
82 HH21 ARG 12 HH21 ARG 12 14.033 -8.697 9.983
83 HH22 ARG 12 HH22 ARG 12 14.659 -9.820 11.193
84 H GLY 13 H GLY 13 9.205 -1.346 13.509
85 HA2 GLY 13 HA3 GLY 13 8.706 0.154 15.206
86 HA3 GLY 13 HA2 GLY 13 10.218 -0.374 15.958
87 H ASP 14 H ASP 14 8.902 1.918 13.405
88 HA ASP 14 HA ASP 14 10.374 3.984 14.747
89 HB2 ASP 14 HB2 ASP 14 12.133 2.768 13.126
90 HB3 ASP 14 HB3 ASP 14 11.383 3.764 11.872
91 H THR 15 H THR 15 9.115 3.421 11.332
92 HA THR 15 HA THR 15 6.809 5.041 11.789
93 HB THR 15 HB THR 15 8.199 7.006 11.812
94 HG1 THR 15 HG1 THR 15 7.556 7.972 9.748
95 HG21 THR 15 HG21 THR 15 9.979 7.480 10.123
96 HG22 THR 15 HG22 THR 15 9.704 5.891 9.356
97 HG23 THR 15 HG23 THR 15 10.351 5.990 11.024
98 HA PRO 16 HA PRO 16 6.288 2.534 8.101
99 HB2 PRO 16 HB2 PRO 16 3.879 3.427 7.057
100 HB3 PRO 16 HB3 PRO 16 3.966 2.665 8.678
101 HG2 PRO 16 HG2 PRO 16 4.100 5.663 8.068
102 HG3 PRO 16 HG3 PRO 16 2.889 4.858 9.120
103 HD2 PRO 16 HD2 PRO 16 5.124 5.979 10.224
104 HD3 PRO 16 HD3 PRO 16 4.622 4.343 10.795
105 H ILE 17 H ILE 17 6.126 2.707 5.600
106 HA ILE 17 HA ILE 17 6.896 5.423 4.587
107 HB ILE 17 HB ILE 17 8.305 2.882 3.652
108 HG12 ILE 17 HG12 ILE 17 9.297 4.707 5.929
109 HG13 ILE 17 HG13 ILE 17 8.802 2.999 6.069
110 HG21 ILE 17 HG21 ILE 17 9.894 4.405 2.623
111 HG22 ILE 17 HG22 ILE 17 8.331 5.159 2.296
112 HG23 ILE 17 HG23 ILE 17 9.336 5.788 3.616
113 HD11 ILE 17 HD11 ILE 17 10.680 2.323 4.531
114 HD12 ILE 17 HD12 ILE 17 11.250 4.023 4.483
115 HD13 ILE 17 HD13 ILE 17 11.267 3.139 6.009
116 H SER 18 H SER 18 4.257 4.236 4.485
117 HA SER 18 HA SER 18 3.723 4.442 1.742
118 HB2 SER 18 HB2 SER 18 3.111 2.004 1.233
119 HB3 SER 18 HB3 SER 18 4.844 2.300 1.195
120 HG SER 18 HG SER 18 4.893 1.393 3.406
121 H PHE 19 H PHE 19 1.389 4.004 1.221
122 HA PHE 19 HA PHE 19 -0.247 3.048 3.480
123 HB2 PHE 19 HB2 PHE 19 -0.624 5.819 2.197
124 HB3 PHE 19 HB3 PHE 19 -1.664 5.126 3.451
125 HD1 PHE 19 HD1 PHE 19 1.798 6.363 2.649
126 HD2 PHE 19 HD2 PHE 19 -0.989 5.422 5.789
127 HE1 PHE 19 HE1 PHE 19 3.386 7.244 4.324
128 HE2 PHE 19 HE2 PHE 19 0.579 6.351 7.458
129 HZ PHE 19 HZ PHE 19 2.760 7.294 6.727
130 H TYR 20 H TYR 20 -2.743 3.146 2.716
131 HA TYR 20 HA TYR 20 -2.777 1.100 0.753
132 HB2 TYR 20 HB2 TYR 20 -5.008 3.006 1.679
133 HB3 TYR 20 HB3 TYR 20 -5.287 1.596 0.632
134 HD1 TYR 20 HD2 TYR 20 -2.778 0.696 3.140
135 HD2 TYR 20 HD1 TYR 20 -6.994 1.326 2.547
136 HE1 TYR 20 HE2 TYR 20 -3.258 -0.859 4.954
137 HE2 TYR 20 HE1 TYR 20 -7.474 -0.223 4.410
138 HH TYR 20 HH TYR 20 -4.931 -1.974 6.217
139 H GLY 21 H GLY 21 -4.180 1.239 -1.432
140 HA2 GLY 21 HA3 GLY 21 -2.944 3.101 -3.179
141 HA3 GLY 21 HA2 GLY 21 -4.488 2.270 -3.515
Start of MODEL 20
1 H1 GLY 1 H GLY 1 2.345 -0.217 0.859
2 HA2 GLY 1 HA3 GLY 1 3.042 -0.356 -1.346
3 HA3 GLY 1 HA2 GLY 1 1.553 -1.282 -1.651
4 H GLY 2 H GLY 2 1.387 2.129 -0.397
5 HA2 GLY 2 HA3 GLY 2 1.252 3.301 -3.047
6 HA3 GLY 2 HA2 GLY 2 -0.363 2.948 -2.369
7 H ALA 3 H ALA 3 -1.005 5.231 -1.987
8 HA ALA 3 HA ALA 3 0.485 6.513 0.254
9 HB1 ALA 3 HB1 ALA 3 0.072 7.841 -2.481
10 HB2 ALA 3 HB2 ALA 3 0.787 8.617 -1.031
11 HB3 ALA 3 HB3 ALA 3 1.639 7.265 -1.836
12 H GLY 4 H GLY 4 -2.049 5.317 0.460
13 HA2 GLY 4 HA3 GLY 4 -4.039 7.516 0.216
14 HA3 GLY 4 HA2 GLY 4 -4.339 5.817 0.617
15 H HIS 5 H HIS 5 -5.469 6.220 2.638
16 HA HIS 5 HA HIS 5 -4.204 8.068 4.573
17 HB2 HIS 5 HB2 HIS 5 -6.935 6.721 4.384
18 HB3 HIS 5 HB3 HIS 5 -6.306 7.104 5.991
19 HD1 HIS 5 HD1 HIS 5 -6.537 9.024 2.709
20 HD2 HIS 5 HD2 HIS 5 -6.947 9.453 6.872
21 HE1 HIS 5 HE1 HIS 5 -7.235 11.430 3.085
22 H VAL 6 H VAL 6 -4.761 4.451 4.325
23 HA VAL 6 HA VAL 6 -4.003 4.304 7.187
24 HB VAL 6 HB VAL 6 -5.074 2.195 5.281
25 HG11 VAL 6 HG11 VAL 6 -3.802 1.176 7.211
26 HG12 VAL 6 HG12 VAL 6 -4.846 2.082 8.352
27 HG13 VAL 6 HG13 VAL 6 -5.549 0.834 7.297
28 HG21 VAL 6 HG21 VAL 6 -6.528 3.852 7.433
29 HG22 VAL 6 HG22 VAL 6 -6.747 4.019 5.670
30 HG23 VAL 6 HG23 VAL 6 -7.249 2.519 6.484
31 HA PRO 7 HA PRO 7 0.106 3.121 5.689
32 HB2 PRO 7 HB2 PRO 7 1.232 1.879 7.900
33 HB3 PRO 7 HB3 PRO 7 0.995 3.649 7.743
34 HG2 PRO 7 HG2 PRO 7 -0.877 1.674 9.109
35 HG3 PRO 7 HG3 PRO 7 -0.234 3.213 9.784
36 HD2 PRO 7 HD2 PRO 7 -2.718 3.143 8.718
37 HD3 PRO 7 HD3 PRO 7 -1.657 4.547 8.305
38 H GLU 8 H GLU 8 1.017 1.214 4.577
39 HA GLU 8 HA GLU 8 -0.773 -1.139 4.560
40 HB2 GLU 8 HB2 GLU 8 1.833 -0.634 3.042
41 HB3 GLU 8 HB3 GLU 8 0.775 -2.058 2.833
42 HG2 GLU 8 HG2 GLU 8 -1.112 -0.569 2.161
43 HG3 GLU 8 HG3 GLU 8 -0.041 0.849 2.296
44 H TYR 9 H TYR 9 2.752 -0.412 5.310
45 HA TYR 9 HA TYR 9 2.665 -2.564 7.350
46 HB2 TYR 9 HB2 TYR 9 4.689 -3.676 6.291
47 HB3 TYR 9 HB3 TYR 9 3.242 -3.774 5.270
48 HD1 TYR 9 HD2 TYR 9 6.437 -1.833 5.800
49 HD2 TYR 9 HD1 TYR 9 3.259 -2.782 3.055
50 HE1 TYR 9 HE2 TYR 9 7.674 -0.723 3.969
51 HE2 TYR 9 HE1 TYR 9 4.487 -1.669 1.237
52 HH TYR 9 HH TYR 9 6.541 -0.624 0.590
53 H PHE 10 H PHE 10 4.950 -2.652 8.486
54 HA PHE 10 HA PHE 10 5.914 0.197 8.730
55 HB2 PHE 10 HB2 PHE 10 5.270 -1.899 10.883
56 HB3 PHE 10 HB3 PHE 10 6.156 -0.398 11.205
57 HD1 PHE 10 HD1 PHE 10 2.873 -1.724 9.899
58 HD2 PHE 10 HD2 PHE 10 4.987 1.739 11.343
59 HE1 PHE 10 HE1 PHE 10 0.723 -0.541 10.225
60 HE2 PHE 10 HE2 PHE 10 2.822 2.865 11.789
61 HZ PHE 10 HZ PHE 10 0.692 1.669 11.359
62 H VAL 11 H VAL 11 8.081 0.229 9.936
63 HA VAL 11 HA VAL 11 9.854 -1.785 8.606
64 HB VAL 11 HB VAL 11 11.642 -0.228 8.873
65 HG11 VAL 11 HG11 VAL 11 9.154 1.481 8.250
66 HG12 VAL 11 HG12 VAL 11 10.846 1.847 7.864
67 HG13 VAL 11 HG13 VAL 11 10.044 0.442 7.109
68 HG21 VAL 11 HG21 VAL 11 9.927 1.185 10.977
69 HG22 VAL 11 HG22 VAL 11 11.520 0.459 11.224
70 HG23 VAL 11 HG23 VAL 11 11.378 1.923 10.238
71 H ARG 12 H ARG 12 12.001 -1.831 10.540
72 HA ARG 12 HA ARG 12 10.723 -3.450 12.617
73 HB2 ARG 12 HB2 ARG 12 13.667 -2.617 12.428
74 HB3 ARG 12 HB3 ARG 12 12.947 -3.913 13.410
75 HG2 ARG 12 HG2 ARG 12 12.092 -4.829 10.997
76 HG3 ARG 12 HG3 ARG 12 13.380 -3.775 10.370
77 HD2 ARG 12 HD2 ARG 12 14.325 -5.967 10.616
78 HD3 ARG 12 HD3 ARG 12 15.009 -4.958 11.941
79 HE ARG 12 HE ARG 12 12.617 -6.299 12.863
80 HH11 ARG 12 HH11 ARG 12 16.007 -7.068 11.922
81 HH12 ARG 12 HH12 ARG 12 16.044 -8.487 12.960
82 HH21 ARG 12 HH21 ARG 12 12.756 -8.125 14.152
83 HH22 ARG 12 HH22 ARG 12 14.239 -9.081 14.201
84 H GLY 13 H GLY 13 9.286 -1.417 13.238
85 HA2 GLY 13 HA3 GLY 13 8.791 -0.077 15.071
86 HA3 GLY 13 HA2 GLY 13 10.313 -0.622 15.787
87 H ASP 14 H ASP 14 8.943 1.767 13.354
88 HA ASP 14 HA ASP 14 10.422 3.792 14.731
89 HB2 ASP 14 HB2 ASP 14 12.161 2.592 13.024
90 HB3 ASP 14 HB3 ASP 14 11.447 3.713 11.862
91 H THR 15 H THR 15 9.186 3.330 11.298
92 HA THR 15 HA THR 15 6.875 4.942 11.797
93 HB THR 15 HB THR 15 8.263 6.910 11.817
94 HG1 THR 15 HG1 THR 15 7.656 7.872 9.737
95 HG21 THR 15 HG21 THR 15 9.805 5.754 9.401
96 HG22 THR 15 HG22 THR 15 10.424 5.901 11.074
97 HG23 THR 15 HG23 THR 15 10.064 7.363 10.128
98 HA PRO 16 HA PRO 16 6.299 2.474 8.094
99 HB2 PRO 16 HB2 PRO 16 3.906 3.417 7.057
100 HB3 PRO 16 HB3 PRO 16 3.979 2.646 8.674
101 HG2 PRO 16 HG2 PRO 16 4.175 5.644 8.083
102 HG3 PRO 16 HG3 PRO 16 2.944 4.859 9.126
103 HD2 PRO 16 HD2 PRO 16 5.197 5.923 10.241
104 HD3 PRO 16 HD3 PRO 16 4.670 4.292 10.800
105 H ILE 17 H ILE 17 6.121 2.661 5.588
106 HA ILE 17 HA ILE 17 6.913 5.372 4.589
107 HB ILE 17 HB ILE 17 8.293 2.829 3.612
108 HG12 ILE 17 HG12 ILE 17 9.342 4.619 5.884
109 HG13 ILE 17 HG13 ILE 17 8.828 2.916 6.018
110 HG21 ILE 17 HG21 ILE 17 9.356 5.723 3.592
111 HG22 ILE 17 HG22 ILE 17 9.871 4.352 2.561
112 HG23 ILE 17 HG23 ILE 17 8.313 5.135 2.284
113 HD11 ILE 17 HD11 ILE 17 10.663 2.226 4.435
114 HD12 ILE 17 HD12 ILE 17 11.255 3.917 4.384
115 HD13 ILE 17 HD13 ILE 17 11.301 3.021 5.900
116 H SER 18 H SER 18 4.261 4.220 4.493
117 HA SER 18 HA SER 18 3.706 4.459 1.755
118 HB2 SER 18 HB2 SER 18 3.083 1.956 1.292
119 HB3 SER 18 HB3 SER 18 4.788 2.356 1.137
120 HG SER 18 HG SER 18 3.650 1.186 3.498
121 H PHE 19 H PHE 19 1.372 4.030 1.240
122 HA PHE 19 HA PHE 19 -0.267 3.060 3.492
123 HB2 PHE 19 HB2 PHE 19 -0.618 5.857 2.250
124 HB3 PHE 19 HB3 PHE 19 -1.655 5.156 3.504
125 HD1 PHE 19 HD2 PHE 19 1.816 6.354 2.687
126 HD2 PHE 19 HD1 PHE 19 -0.984 5.463 5.833
127 HE1 PHE 19 HE2 PHE 19 3.426 7.197 4.361
128 HE2 PHE 19 HE1 PHE 19 0.610 6.352 7.500
129 HZ PHE 19 HZ PHE 19 2.805 7.256 6.765
130 H TYR 20 H TYR 20 -2.766 3.221 2.742
131 HA TYR 20 HA TYR 20 -2.854 1.197 0.745
132 HB2 TYR 20 HB2 TYR 20 -5.037 3.103 1.786
133 HB3 TYR 20 HB3 TYR 20 -5.372 1.715 0.728
134 HD1 TYR 20 HD1 TYR 20 -2.789 0.778 3.153
135 HD2 TYR 20 HD2 TYR 20 -7.023 1.379 2.640
136 HE1 TYR 20 HE1 TYR 20 -3.240 -0.802 4.972
137 HE2 TYR 20 HE2 TYR 20 -7.465 -0.193 4.478
138 HH TYR 20 HH TYR 20 -6.514 -1.734 6.035
139 H GLY 21 H GLY 21 -4.421 1.446 -1.375
140 HA2 GLY 21 HA3 GLY 21 -4.962 2.631 -3.316
141 HA3 GLY 21 HA2 GLY 21 -4.536 4.124 -2.457