NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
577897 |
2mmt   |
19865 | 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 1.220 -0.526 0.638
2 HA2 GLY 1 HA3 GLY 1 2.090 0.188 -1.510
3 HA3 GLY 1 HA2 GLY 1 3.479 0.954 -0.721
4 H GLY 2 H GLY 2 4.370 -0.985 1.122
5 HA2 GLY 2 HA3 GLY 2 5.713 -2.787 -0.740
6 HA3 GLY 2 HA2 GLY 2 5.916 -2.721 1.024
7 H ALA 3 H ALA 3 5.947 -5.157 0.891
8 HA ALA 3 HA ALA 3 3.166 -6.293 0.597
9 HB1 ALA 3 HB1 ALA 3 4.852 -7.120 -1.071
10 HB2 ALA 3 HB2 ALA 3 5.902 -7.658 0.272
11 HB3 ALA 3 HB3 ALA 3 4.298 -8.415 0.033
12 H GLY 4 H GLY 4 3.940 -4.885 3.021
13 HA2 GLY 4 HA3 GLY 4 4.890 -6.912 4.911
14 HA3 GLY 4 HA2 GLY 4 4.367 -5.262 5.268
15 H HIS 5 H HIS 5 3.020 -5.885 7.001
16 HA HIS 5 HA HIS 5 0.869 -7.821 6.476
17 HB2 HIS 5 HB2 HIS 5 2.372 -7.087 8.979
18 HB3 HIS 5 HB3 HIS 5 0.837 -7.948 9.048
19 HD1 HIS 5 HD1 HIS 5 1.302 -10.332 9.462
20 HD2 HIS 5 HD2 HIS 5 4.064 -8.662 6.846
21 HE1 HIS 5 HE1 HIS 5 2.818 -12.222 8.788
22 H VAL 6 H VAL 6 1.433 -4.369 7.317
23 HA VAL 6 HA VAL 6 -1.343 -4.171 8.385
24 HB VAL 6 HB VAL 6 1.097 -2.344 8.676
25 HG11 VAL 6 HG11 VAL 6 -0.227 -1.089 10.329
26 HG12 VAL 6 HG12 VAL 6 -1.092 -1.086 8.772
27 HG13 VAL 6 HG13 VAL 6 -1.626 -2.167 10.099
28 HG21 VAL 6 HG21 VAL 6 1.387 -4.494 9.934
29 HG22 VAL 6 HG22 VAL 6 1.119 -3.137 11.056
30 HG23 VAL 6 HG23 VAL 6 -0.213 -4.272 10.695
31 HA PRO 7 HA PRO 7 -1.857 -2.343 4.313
32 HB2 PRO 7 HB2 PRO 7 -4.226 -0.959 4.505
33 HB3 PRO 7 HB3 PRO 7 -4.086 -2.751 4.584
34 HG2 PRO 7 HG2 PRO 7 -4.109 -0.854 6.980
35 HG3 PRO 7 HG3 PRO 7 -5.272 -2.192 6.683
36 HD2 PRO 7 HD2 PRO 7 -3.130 -2.626 8.270
37 HD3 PRO 7 HD3 PRO 7 -3.485 -3.875 7.014
38 H GLU 8 H GLU 8 -1.398 -0.353 3.143
39 HA GLU 8 HA GLU 8 -0.186 1.762 4.818
40 HB2 GLU 8 HB2 GLU 8 -0.381 1.371 1.764
41 HB3 GLU 8 HB3 GLU 8 0.406 2.762 2.552
42 HG2 GLU 8 HG2 GLU 8 2.032 1.297 3.690
43 HG3 GLU 8 HG3 GLU 8 1.200 -0.159 3.098
44 H TYR 9 H TYR 9 -3.001 1.364 2.505
45 HA TYR 9 HA TYR 9 -4.218 3.783 3.771
46 HB2 TYR 9 HB2 TYR 9 -4.728 4.601 1.355
47 HB3 TYR 9 HB3 TYR 9 -3.030 4.714 1.857
48 HD1 TYR 9 HD1 TYR 9 -5.465 2.496 -0.002
49 HD2 TYR 9 HD2 TYR 9 -1.336 3.567 0.585
50 HE1 TYR 9 HE1 TYR 9 -4.811 0.955 -1.809
51 HE2 TYR 9 HE2 TYR 9 -0.686 2.051 -1.251
52 HH TYR 9 HH TYR 9 -3.006 0.067 -3.100
53 H PHE 10 H PHE 10 -6.590 4.029 2.822
54 HA PHE 10 HA PHE 10 -7.702 1.255 2.496
55 HB2 PHE 10 HB2 PHE 10 -8.774 3.522 4.272
56 HB3 PHE 10 HB3 PHE 10 -9.546 1.943 4.013
57 HD1 PHE 10 HD1 PHE 10 -6.535 3.673 5.448
58 HD2 PHE 10 HD2 PHE 10 -8.599 -0.087 5.095
59 HE1 PHE 10 HE1 PHE 10 -5.248 2.783 7.364
60 HE2 PHE 10 HE2 PHE 10 -7.407 -0.926 7.093
61 HZ PHE 10 HZ PHE 10 -5.760 0.525 8.263
62 H VAL 11 H VAL 11 -9.342 1.175 0.896
63 HA VAL 11 HA VAL 11 -10.149 3.736 -0.298
64 HB VAL 11 HB VAL 11 -10.561 0.973 -1.441
65 HG11 VAL 11 HG11 VAL 11 -10.655 2.463 -3.573
66 HG12 VAL 11 HG12 VAL 11 -12.072 2.341 -2.528
67 HG13 VAL 11 HG13 VAL 11 -11.021 3.755 -2.430
68 HG21 VAL 11 HG21 VAL 11 -8.192 1.340 -1.250
69 HG22 VAL 11 HG22 VAL 11 -8.659 1.537 -2.939
70 HG23 VAL 11 HG23 VAL 11 -8.344 2.956 -1.940
71 H ARG 12 H ARG 12 -12.429 3.839 -1.091
72 HA ARG 12 HA ARG 12 -14.209 3.214 1.070
73 HB2 ARG 12 HB2 ARG 12 -14.952 4.322 -1.637
74 HB3 ARG 12 HB3 ARG 12 -15.851 4.472 -0.133
75 HG2 ARG 12 HG2 ARG 12 -14.183 5.929 0.788
76 HG3 ARG 12 HG3 ARG 12 -13.134 5.673 -0.607
77 HD2 ARG 12 HD2 ARG 12 -14.238 7.795 -0.842
78 HD3 ARG 12 HD3 ARG 12 -14.882 6.680 -2.046
79 HE ARG 12 HE ARG 12 -16.930 6.790 -1.013
80 HH11 ARG 12 HH11 ARG 12 -14.504 8.186 1.058
81 HH12 ARG 12 HH12 ARG 12 -15.651 8.826 2.188
82 HH21 ARG 12 HH21 ARG 12 -18.449 7.629 0.467
83 HH22 ARG 12 HH22 ARG 12 -17.895 8.508 1.851
84 H GLY 13 H GLY 13 -13.039 0.948 -0.384
85 HA2 GLY 13 HA3 GLY 13 -15.430 -0.221 -1.641
86 HA3 GLY 13 HA2 GLY 13 -13.785 -0.804 -1.845
87 H ASP 14 H ASP 14 -13.304 -2.603 -0.792
88 HA ASP 14 HA ASP 14 -14.868 -3.268 1.617
89 HB2 ASP 14 HB2 ASP 14 -15.377 -4.796 -0.205
90 HB3 ASP 14 HB3 ASP 14 -13.663 -5.120 -0.449
91 H PHE 15 H PHE 15 -11.901 -4.629 0.217
92 HA PHE 15 HA PHE 15 -10.555 -4.084 2.781
93 HB2 PHE 15 HB2 PHE 15 -10.398 -6.449 0.929
94 HB3 PHE 15 HB3 PHE 15 -9.090 -6.090 2.052
95 HD1 PHE 15 HD1 PHE 15 -10.166 -5.427 4.514
96 HD2 PHE 15 HD2 PHE 15 -11.774 -8.125 1.642
97 HE1 PHE 15 HE1 PHE 15 -11.378 -6.604 6.303
98 HE2 PHE 15 HE2 PHE 15 -12.989 -9.305 3.426
99 HZ PHE 15 HZ PHE 15 -12.793 -8.545 5.760
100 HA PRO 16 HA PRO 16 -7.568 -1.860 0.331
101 HB2 PRO 16 HB2 PRO 16 -5.339 -1.843 1.956
102 HB3 PRO 16 HB3 PRO 16 -6.891 -1.134 2.501
103 HG2 PRO 16 HG2 PRO 16 -5.897 -3.964 3.094
104 HG3 PRO 16 HG3 PRO 16 -6.407 -2.724 4.298
105 HD2 PRO 16 HD2 PRO 16 -8.149 -4.601 3.492
106 HD3 PRO 16 HD3 PRO 16 -8.707 -2.893 3.677
107 H ILE 17 H ILE 17 -5.124 -2.131 -0.551
108 HA ILE 17 HA ILE 17 -5.069 -4.927 -1.657
109 HB ILE 17 HB ILE 17 -4.064 -2.324 -2.898
110 HG12 ILE 17 HG12 ILE 17 -6.494 -2.157 -2.716
111 HG13 ILE 17 HG13 ILE 17 -5.998 -2.396 -4.403
112 HG21 ILE 17 HG21 ILE 17 -4.312 -5.167 -4.052
113 HG22 ILE 17 HG22 ILE 17 -3.941 -3.700 -5.004
114 HG23 ILE 17 HG23 ILE 17 -2.816 -4.253 -3.741
115 HD11 ILE 17 HD11 ILE 17 -8.024 -3.706 -3.916
116 HD12 ILE 17 HD12 ILE 17 -6.689 -4.836 -4.245
117 HD13 ILE 17 HD13 ILE 17 -7.238 -4.550 -2.565
118 H SER 18 H SER 18 -2.709 -2.184 -0.919
119 HA SER 18 HA SER 18 -0.585 -4.302 -0.892
120 HB2 SER 18 HB2 SER 18 0.973 -2.559 -1.368
121 HB3 SER 18 HB3 SER 18 -0.419 -2.226 -2.425
122 HG SER 18 HG SER 18 -1.020 -0.589 -0.755
123 H PHE 19 H PHE 19 1.328 -3.627 0.791
124 HA PHE 19 HA PHE 19 0.086 -2.679 3.308
125 HB2 PHE 19 HB2 PHE 19 1.598 -5.311 3.165
126 HB3 PHE 19 HB3 PHE 19 0.520 -4.787 4.477
127 HD1 PHE 19 HD1 PHE 19 -2.005 -4.787 4.057
128 HD2 PHE 19 HD2 PHE 19 0.772 -6.439 1.211
129 HE1 PHE 19 HE1 PHE 19 -3.867 -5.923 2.884
130 HE2 PHE 19 HE2 PHE 19 -1.072 -7.654 0.112
131 HZ PHE 19 HZ PHE 19 -3.401 -7.396 0.939
132 H TYR 20 H TYR 20 1.975 -3.055 5.156
133 HA TYR 20 HA TYR 20 3.502 -0.753 4.364
134 HB2 TYR 20 HB2 TYR 20 2.653 -1.720 6.858
135 HB3 TYR 20 HB3 TYR 20 4.352 -2.187 6.895
136 HD1 TYR 20 HD1 TYR 20 1.961 0.608 6.089
137 HD2 TYR 20 HD2 TYR 20 5.831 -0.363 7.692
138 HE1 TYR 20 HE1 TYR 20 2.364 3.000 6.569
139 HE2 TYR 20 HE2 TYR 20 6.218 2.011 8.205
140 HH TYR 20 HH TYR 20 5.341 4.230 8.113
141 H GLY 21 H GLY 21 6.082 -0.795 5.200
142 HA2 GLY 21 HA3 GLY 21 8.177 -1.816 4.975
143 HA3 GLY 21 HA2 GLY 21 7.375 -3.330 4.511
Start of MODEL 2
1 H1 GLY 1 H GLY 1 1.169 -0.522 0.687
2 HA2 GLY 1 HA3 GLY 1 2.017 0.235 -1.451
3 HA3 GLY 1 HA2 GLY 1 3.398 1.019 -0.660
4 H GLY 2 H GLY 2 4.359 -0.891 1.150
5 HA2 GLY 2 HA3 GLY 2 5.714 -2.671 -0.695
6 HA3 GLY 2 HA2 GLY 2 5.867 -2.661 1.077
7 H ALA 3 H ALA 3 5.917 -5.113 0.738
8 HA ALA 3 HA ALA 3 3.109 -6.203 0.484
9 HB1 ALA 3 HB1 ALA 3 4.191 -8.314 -0.211
10 HB2 ALA 3 HB2 ALA 3 4.722 -6.980 -1.278
11 HB3 ALA 3 HB3 ALA 3 5.813 -7.587 0.003
12 H GLY 4 H GLY 4 3.956 -4.903 2.926
13 HA2 GLY 4 HA3 GLY 4 4.938 -7.020 4.710
14 HA3 GLY 4 HA2 GLY 4 4.468 -5.372 5.140
15 H HIS 5 H HIS 5 3.093 -5.976 6.857
16 HA HIS 5 HA HIS 5 0.952 -7.920 6.319
17 HB2 HIS 5 HB2 HIS 5 2.495 -7.241 8.814
18 HB3 HIS 5 HB3 HIS 5 0.971 -8.121 8.885
19 HD1 HIS 5 HD1 HIS 5 4.524 -8.634 8.542
20 HD2 HIS 5 HD2 HIS 5 1.096 -10.619 7.289
21 HE1 HIS 5 HE1 HIS 5 5.271 -10.963 7.960
22 H VAL 6 H VAL 6 1.491 -4.486 7.223
23 HA VAL 6 HA VAL 6 -1.259 -4.343 8.368
24 HB VAL 6 HB VAL 6 1.175 -2.501 8.631
25 HG11 VAL 6 HG11 VAL 6 -1.504 -2.369 10.136
26 HG12 VAL 6 HG12 VAL 6 -0.106 -1.286 10.342
27 HG13 VAL 6 HG13 VAL 6 -1.018 -1.260 8.813
28 HG21 VAL 6 HG21 VAL 6 1.515 -4.672 9.836
29 HG22 VAL 6 HG22 VAL 6 1.268 -3.340 10.993
30 HG23 VAL 6 HG23 VAL 6 -0.066 -4.478 10.646
31 HA PRO 7 HA PRO 7 -1.906 -2.409 4.359
32 HB2 PRO 7 HB2 PRO 7 -4.274 -1.047 4.657
33 HB3 PRO 7 HB3 PRO 7 -4.120 -2.839 4.695
34 HG2 PRO 7 HG2 PRO 7 -4.078 -0.994 7.131
35 HG3 PRO 7 HG3 PRO 7 -5.247 -2.329 6.839
36 HD2 PRO 7 HD2 PRO 7 -3.054 -2.793 8.349
37 HD3 PRO 7 HD3 PRO 7 -3.448 -4.014 7.077
38 H GLU 8 H GLU 8 -1.453 -0.400 3.233
39 HA GLU 8 HA GLU 8 -0.236 1.688 4.932
40 HB2 GLU 8 HB2 GLU 8 -0.492 1.365 1.871
41 HB3 GLU 8 HB3 GLU 8 0.291 2.753 2.670
42 HG2 GLU 8 HG2 GLU 8 1.954 1.290 3.749
43 HG3 GLU 8 HG3 GLU 8 1.131 -0.166 3.140
44 H TYR 9 H TYR 9 -3.116 1.304 2.705
45 HA TYR 9 HA TYR 9 -4.313 3.689 4.048
46 HB2 TYR 9 HB2 TYR 9 -4.886 4.559 1.662
47 HB3 TYR 9 HB3 TYR 9 -3.178 4.672 2.126
48 HD1 TYR 9 HD1 TYR 9 -5.642 2.468 0.284
49 HD2 TYR 9 HD2 TYR 9 -1.510 3.570 0.786
50 HE1 TYR 9 HE1 TYR 9 -5.018 0.969 -1.568
51 HE2 TYR 9 HE2 TYR 9 -0.893 2.099 -1.096
52 HH TYR 9 HH TYR 9 -3.248 0.267 -3.031
53 H PHE 10 H PHE 10 -6.711 3.938 3.144
54 HA PHE 10 HA PHE 10 -7.806 1.161 2.779
55 HB2 PHE 10 HB2 PHE 10 -8.861 3.378 4.627
56 HB3 PHE 10 HB3 PHE 10 -9.626 1.799 4.344
57 HD1 PHE 10 HD1 PHE 10 -6.598 3.516 5.760
58 HD2 PHE 10 HD2 PHE 10 -8.649 -0.247 5.363
59 HE1 PHE 10 HE1 PHE 10 -5.265 2.589 7.626
60 HE2 PHE 10 HE2 PHE 10 -7.409 -1.125 7.315
61 HZ PHE 10 HZ PHE 10 -5.744 0.307 8.481
62 H VAL 11 H VAL 11 -9.457 1.106 1.192
63 HA VAL 11 HA VAL 11 -10.320 3.687 0.082
64 HB VAL 11 HB VAL 11 -10.723 0.949 -1.123
65 HG11 VAL 11 HG11 VAL 11 -12.274 2.324 -2.141
66 HG12 VAL 11 HG12 VAL 11 -11.240 3.750 -2.029
67 HG13 VAL 11 HG13 VAL 11 -10.883 2.491 -3.213
68 HG21 VAL 11 HG21 VAL 11 -8.884 1.904 -2.718
69 HG22 VAL 11 HG22 VAL 11 -8.449 2.874 -1.310
70 HG23 VAL 11 HG23 VAL 11 -8.427 1.113 -1.209
71 H ARG 12 H ARG 12 -12.616 3.784 -0.657
72 HA ARG 12 HA ARG 12 -14.342 3.078 1.524
73 HB2 ARG 12 HB2 ARG 12 -14.851 4.450 -1.117
74 HB3 ARG 12 HB3 ARG 12 -16.103 4.177 0.088
75 HG2 ARG 12 HG2 ARG 12 -14.993 5.584 1.664
76 HG3 ARG 12 HG3 ARG 12 -13.574 5.715 0.623
77 HD2 ARG 12 HD2 ARG 12 -16.277 6.598 -0.325
78 HD3 ARG 12 HD3 ARG 12 -15.272 7.657 0.662
79 HE ARG 12 HE ARG 12 -13.597 6.908 -1.317
80 HH11 ARG 12 HH11 ARG 12 -16.818 8.229 -1.300
81 HH12 ARG 12 HH12 ARG 12 -16.629 9.050 -2.813
82 HH21 ARG 12 HH21 ARG 12 -13.336 7.985 -3.310
83 HH22 ARG 12 HH22 ARG 12 -14.649 8.911 -3.956
84 H GLY 13 H GLY 13 -13.179 0.870 -0.024
85 HA2 GLY 13 HA3 GLY 13 -15.586 -0.290 -1.260
86 HA3 GLY 13 HA2 GLY 13 -13.940 -0.847 -1.518
87 H ASP 14 H ASP 14 -13.413 -2.670 -0.529
88 HA ASP 14 HA ASP 14 -14.917 -3.425 1.891
89 HB2 ASP 14 HB2 ASP 14 -15.444 -4.908 0.040
90 HB3 ASP 14 HB3 ASP 14 -13.732 -5.197 -0.255
91 H PHE 15 H PHE 15 -11.963 -4.707 0.395
92 HA PHE 15 HA PHE 15 -10.571 -4.215 2.946
93 HB2 PHE 15 HB2 PHE 15 -10.423 -6.526 1.027
94 HB3 PHE 15 HB3 PHE 15 -9.097 -6.181 2.132
95 HD1 PHE 15 HD2 PHE 15 -10.265 -5.504 4.613
96 HD2 PHE 15 HD1 PHE 15 -11.630 -8.333 1.741
97 HE1 PHE 15 HE2 PHE 15 -11.426 -6.745 6.392
98 HE2 PHE 15 HE1 PHE 15 -12.794 -9.578 3.516
99 HZ PHE 15 HZ PHE 15 -12.692 -8.785 5.845
100 HA PRO 16 HA PRO 16 -7.687 -1.842 0.562
101 HB2 PRO 16 HB2 PRO 16 -5.404 -1.895 2.113
102 HB3 PRO 16 HB3 PRO 16 -6.942 -1.213 2.729
103 HG2 PRO 16 HG2 PRO 16 -5.929 -4.062 3.177
104 HG3 PRO 16 HG3 PRO 16 -6.425 -2.879 4.443
105 HD2 PRO 16 HD2 PRO 16 -8.178 -4.721 3.608
106 HD3 PRO 16 HD3 PRO 16 -8.732 -3.020 3.846
107 H ILE 17 H ILE 17 -5.327 -1.996 -0.494
108 HA ILE 17 HA ILE 17 -5.281 -4.719 -1.744
109 HB ILE 17 HB ILE 17 -4.319 -2.026 -2.821
110 HG12 ILE 17 HG12 ILE 17 -6.004 -2.442 -4.610
111 HG13 ILE 17 HG13 ILE 17 -6.608 -3.874 -3.742
112 HG21 ILE 17 HG21 ILE 17 -4.159 -4.836 -4.067
113 HG22 ILE 17 HG22 ILE 17 -3.770 -3.310 -4.909
114 HG23 ILE 17 HG23 ILE 17 -2.764 -3.844 -3.552
115 HD11 ILE 17 HD11 ILE 17 -7.506 -2.430 -1.937
116 HD12 ILE 17 HD12 ILE 17 -6.640 -0.999 -2.583
117 HD13 ILE 17 HD13 ILE 17 -7.997 -1.726 -3.485
118 H SER 18 H SER 18 -2.841 -2.069 -0.932
119 HA SER 18 HA SER 18 -0.784 -4.241 -0.953
120 HB2 SER 18 HB2 SER 18 0.814 -2.523 -1.408
121 HB3 SER 18 HB3 SER 18 -0.596 -2.107 -2.409
122 HG SER 18 HG SER 18 -1.102 -0.528 -0.650
123 H PHE 19 H PHE 19 1.200 -3.610 0.703
124 HA PHE 19 HA PHE 19 -0.009 -2.840 3.305
125 HB2 PHE 19 HB2 PHE 19 1.613 -5.386 2.895
126 HB3 PHE 19 HB3 PHE 19 0.644 -4.974 4.333
127 HD1 PHE 19 HD2 PHE 19 -1.918 -4.896 4.090
128 HD2 PHE 19 HD1 PHE 19 0.631 -6.496 1.007
129 HE1 PHE 19 HE2 PHE 19 -3.878 -5.962 3.011
130 HE2 PHE 19 HE1 PHE 19 -1.309 -7.633 -0.010
131 HZ PHE 19 HZ PHE 19 -3.573 -7.361 0.980
132 H TYR 20 H TYR 20 1.928 -3.126 5.083
133 HA TYR 20 HA TYR 20 3.354 -0.755 4.323
134 HB2 TYR 20 HB2 TYR 20 2.556 -1.660 6.754
135 HB3 TYR 20 HB3 TYR 20 4.185 -2.348 6.788
136 HD1 TYR 20 HD1 TYR 20 2.141 0.749 6.157
137 HD2 TYR 20 HD2 TYR 20 5.927 -0.742 7.547
138 HE1 TYR 20 HE1 TYR 20 2.832 3.046 6.700
139 HE2 TYR 20 HE2 TYR 20 6.599 1.560 8.150
140 HH TYR 20 HH TYR 20 4.560 4.435 7.595
141 H GLY 21 H GLY 21 5.930 -0.653 4.887
142 HA2 GLY 21 HA3 GLY 21 8.016 -1.880 4.777
143 HA3 GLY 21 HA2 GLY 21 7.253 -3.100 3.740
Start of MODEL 3
1 H1 GLY 1 H GLY 1 1.692 -0.940 0.912
2 HA2 GLY 1 HA3 GLY 1 2.165 0.010 -1.426
3 HA3 GLY 1 HA2 GLY 1 3.634 0.708 -0.697
4 H GLY 2 H GLY 2 4.531 -1.249 1.088
5 HA2 GLY 2 HA3 GLY 2 5.716 -3.108 -0.845
6 HA3 GLY 2 HA2 GLY 2 6.051 -3.011 0.896
7 H ALA 3 H ALA 3 5.989 -5.447 0.814
8 HA ALA 3 HA ALA 3 3.176 -6.520 0.660
9 HB1 ALA 3 HB1 ALA 3 5.875 -7.969 0.413
10 HB2 ALA 3 HB2 ALA 3 4.249 -8.694 0.223
11 HB3 ALA 3 HB3 ALA 3 4.834 -7.483 -0.958
12 H GLY 4 H GLY 4 3.954 -4.992 3.005
13 HA2 GLY 4 HA3 GLY 4 4.890 -6.907 5.009
14 HA3 GLY 4 HA2 GLY 4 4.329 -5.253 5.281
15 H HIS 5 H HIS 5 3.017 -5.885 7.048
16 HA HIS 5 HA HIS 5 0.861 -7.820 6.540
17 HB2 HIS 5 HB2 HIS 5 2.365 -7.067 9.037
18 HB3 HIS 5 HB3 HIS 5 0.827 -7.921 9.113
19 HD1 HIS 5 HD1 HIS 5 1.132 -10.353 9.334
20 HD2 HIS 5 HD2 HIS 5 4.203 -8.619 7.138
21 HE1 HIS 5 HE1 HIS 5 2.679 -12.242 8.734
22 H VAL 6 H VAL 6 1.430 -4.360 7.321
23 HA VAL 6 HA VAL 6 -1.330 -4.142 8.426
24 HB VAL 6 HB VAL 6 1.113 -2.311 8.645
25 HG11 VAL 6 HG11 VAL 6 -0.190 -1.023 10.290
26 HG12 VAL 6 HG12 VAL 6 -1.074 -1.049 8.744
27 HG13 VAL 6 HG13 VAL 6 -1.592 -2.104 10.097
28 HG21 VAL 6 HG21 VAL 6 -0.171 -4.196 10.721
29 HG22 VAL 6 HG22 VAL 6 1.418 -4.436 9.942
30 HG23 VAL 6 HG23 VAL 6 1.167 -3.056 11.040
31 HA PRO 7 HA PRO 7 -1.889 -2.378 4.326
32 HB2 PRO 7 HB2 PRO 7 -4.268 -1.017 4.516
33 HB3 PRO 7 HB3 PRO 7 -4.111 -2.806 4.624
34 HG2 PRO 7 HG2 PRO 7 -4.139 -0.873 6.989
35 HG3 PRO 7 HG3 PRO 7 -5.288 -2.229 6.718
36 HD2 PRO 7 HD2 PRO 7 -3.126 -2.607 8.298
37 HD3 PRO 7 HD3 PRO 7 -3.485 -3.885 7.071
38 H GLU 8 H GLU 8 -1.368 -0.415 3.149
39 HA GLU 8 HA GLU 8 -0.184 1.726 4.794
40 HB2 GLU 8 HB2 GLU 8 -0.457 1.329 1.751
41 HB3 GLU 8 HB3 GLU 8 0.296 2.761 2.502
42 HG2 GLU 8 HG2 GLU 8 2.046 1.404 3.548
43 HG3 GLU 8 HG3 GLU 8 1.232 -0.105 3.080
44 H TYR 9 H TYR 9 -2.995 1.319 2.472
45 HA TYR 9 HA TYR 9 -4.218 3.767 3.694
46 HB2 TYR 9 HB2 TYR 9 -4.713 4.514 1.258
47 HB3 TYR 9 HB3 TYR 9 -3.012 4.613 1.751
48 HD1 TYR 9 HD1 TYR 9 -5.482 2.344 -0.007
49 HD2 TYR 9 HD2 TYR 9 -1.345 3.437 0.478
50 HE1 TYR 9 HE1 TYR 9 -4.859 0.788 -1.813
51 HE2 TYR 9 HE2 TYR 9 -0.727 1.895 -1.347
52 HH TYR 9 HH TYR 9 -3.096 0.127 -3.316
53 H PHE 10 H PHE 10 -6.580 4.001 2.727
54 HA PHE 10 HA PHE 10 -7.719 1.232 2.465
55 HB2 PHE 10 HB2 PHE 10 -8.770 3.538 4.205
56 HB3 PHE 10 HB3 PHE 10 -9.545 1.954 3.980
57 HD1 PHE 10 HD1 PHE 10 -6.535 3.714 5.373
58 HD2 PHE 10 HD2 PHE 10 -8.583 -0.061 5.085
59 HE1 PHE 10 HE1 PHE 10 -5.231 2.857 7.292
60 HE2 PHE 10 HE2 PHE 10 -7.371 -0.867 7.086
61 HZ PHE 10 HZ PHE 10 -5.725 0.609 8.225
62 H VAL 11 H VAL 11 -9.316 1.147 0.827
63 HA VAL 11 HA VAL 11 -10.118 3.701 -0.385
64 HB VAL 11 HB VAL 11 -10.530 0.931 -1.510
65 HG11 VAL 11 HG11 VAL 11 -12.039 2.293 -2.607
66 HG12 VAL 11 HG12 VAL 11 -10.987 3.707 -2.520
67 HG13 VAL 11 HG13 VAL 11 -10.624 2.404 -3.652
68 HG21 VAL 11 HG21 VAL 11 -8.638 1.984 -3.093
69 HG22 VAL 11 HG22 VAL 11 -8.189 2.734 -1.561
70 HG23 VAL 11 HG23 VAL 11 -8.274 0.977 -1.691
71 H ARG 12 H ARG 12 -12.396 3.805 -1.180
72 HA ARG 12 HA ARG 12 -14.181 3.192 0.981
73 HB2 ARG 12 HB2 ARG 12 -14.621 4.475 -1.718
74 HB3 ARG 12 HB3 ARG 12 -15.892 4.272 -0.519
75 HG2 ARG 12 HG2 ARG 12 -14.763 5.714 1.019
76 HG3 ARG 12 HG3 ARG 12 -13.343 5.792 -0.026
77 HD2 ARG 12 HD2 ARG 12 -14.453 7.790 -0.467
78 HD3 ARG 12 HD3 ARG 12 -14.954 6.739 -1.791
79 HE ARG 12 HE ARG 12 -17.102 6.813 -0.996
80 HH11 ARG 12 HH11 ARG 12 -14.928 8.013 1.445
81 HH12 ARG 12 HH12 ARG 12 -16.197 8.568 2.486
82 HH21 ARG 12 HH21 ARG 12 -18.780 7.541 0.366
83 HH22 ARG 12 HH22 ARG 12 -18.387 8.298 1.872
84 H GLY 13 H GLY 13 -13.017 0.915 -0.449
85 HA2 GLY 13 HA3 GLY 13 -15.406 -0.252 -1.714
86 HA3 GLY 13 HA2 GLY 13 -13.762 -0.842 -1.907
87 H ASP 14 H ASP 14 -13.288 -2.633 -0.837
88 HA ASP 14 HA ASP 14 -14.868 -3.281 1.565
89 HB2 ASP 14 HB2 ASP 14 -15.367 -4.816 -0.256
90 HB3 ASP 14 HB3 ASP 14 -13.652 -5.151 -0.478
91 H PHE 15 H PHE 15 -11.889 -4.636 0.181
92 HA PHE 15 HA PHE 15 -10.555 -4.080 2.749
93 HB2 PHE 15 HB2 PHE 15 -10.405 -6.469 0.930
94 HB3 PHE 15 HB3 PHE 15 -9.098 -6.103 2.051
95 HD1 PHE 15 HD1 PHE 15 -10.271 -5.329 4.483
96 HD2 PHE 15 HD2 PHE 15 -11.697 -8.199 1.682
97 HE1 PHE 15 HE1 PHE 15 -11.493 -6.474 6.285
98 HE2 PHE 15 HE2 PHE 15 -12.922 -9.349 3.479
99 HZ PHE 15 HZ PHE 15 -12.822 -8.487 5.784
100 HA PRO 16 HA PRO 16 -7.588 -1.847 0.340
101 HB2 PRO 16 HB2 PRO 16 -5.348 -1.843 1.952
102 HB3 PRO 16 HB3 PRO 16 -6.900 -1.139 2.504
103 HG2 PRO 16 HG2 PRO 16 -5.907 -3.971 3.077
104 HG3 PRO 16 HG3 PRO 16 -6.421 -2.740 4.289
105 HD2 PRO 16 HD2 PRO 16 -8.167 -4.604 3.481
106 HD3 PRO 16 HD3 PRO 16 -8.717 -2.893 3.649
107 H ILE 17 H ILE 17 -5.209 -2.042 -0.637
108 HA ILE 17 HA ILE 17 -5.122 -4.809 -1.788
109 HB ILE 17 HB ILE 17 -4.171 -2.132 -2.911
110 HG12 ILE 17 HG12 ILE 17 -5.767 -2.623 -4.747
111 HG13 ILE 17 HG13 ILE 17 -6.332 -4.090 -3.910
112 HG21 ILE 17 HG21 ILE 17 -2.519 -3.898 -3.533
113 HG22 ILE 17 HG22 ILE 17 -3.850 -4.968 -4.059
114 HG23 ILE 17 HG23 ILE 17 -3.497 -3.457 -4.943
115 HD11 ILE 17 HD11 ILE 17 -7.846 -2.028 -3.709
116 HD12 ILE 17 HD12 ILE 17 -7.384 -2.714 -2.143
117 HD13 ILE 17 HD13 ILE 17 -6.572 -1.232 -2.745
118 H SER 18 H SER 18 -2.693 -2.125 -1.002
119 HA SER 18 HA SER 18 -0.643 -4.303 -0.893
120 HB2 SER 18 HB2 SER 18 0.932 -2.353 -1.177
121 HB3 SER 18 HB3 SER 18 -0.302 -2.423 -2.457
122 HG SER 18 HG SER 18 -0.512 -0.682 -0.183
123 H PHE 19 H PHE 19 1.268 -3.711 0.788
124 HA PHE 19 HA PHE 19 0.050 -2.735 3.311
125 HB2 PHE 19 HB2 PHE 19 1.593 -5.349 3.163
126 HB3 PHE 19 HB3 PHE 19 0.521 -4.829 4.481
127 HD1 PHE 19 HD1 PHE 19 -2.012 -4.829 4.063
128 HD2 PHE 19 HD2 PHE 19 0.759 -6.498 1.223
129 HE1 PHE 19 HE1 PHE 19 -3.875 -5.978 2.905
130 HE2 PHE 19 HE2 PHE 19 -1.086 -7.720 0.136
131 HZ PHE 19 HZ PHE 19 -3.412 -7.463 0.970
132 H TYR 20 H TYR 20 1.915 -3.008 5.150
133 HA TYR 20 HA TYR 20 3.448 -0.738 4.290
134 HB2 TYR 20 HB2 TYR 20 2.542 -1.513 6.764
135 HB3 TYR 20 HB3 TYR 20 4.175 -2.180 6.879
136 HD1 TYR 20 HD1 TYR 20 2.147 0.852 5.956
137 HD2 TYR 20 HD2 TYR 20 5.846 -0.518 7.666
138 HE1 TYR 20 HE1 TYR 20 2.796 3.186 6.391
139 HE2 TYR 20 HE2 TYR 20 6.481 1.823 8.143
140 HH TYR 20 HH TYR 20 4.464 4.643 7.296
141 H GLY 21 H GLY 21 6.038 -0.749 5.090
142 HA2 GLY 21 HA3 GLY 21 8.122 -1.799 4.918
143 HA3 GLY 21 HA2 GLY 21 7.318 -3.320 4.486
Start of MODEL 4
1 H1 GLY 1 H GLY 1 1.733 -0.880 0.953
2 HA2 GLY 1 HA3 GLY 1 2.304 0.140 -1.318
3 HA3 GLY 1 HA2 GLY 1 3.774 0.774 -0.530
4 H GLY 2 H GLY 2 4.640 -1.233 1.165
5 HA2 GLY 2 HA3 GLY 2 5.788 -3.064 -0.799
6 HA3 GLY 2 HA2 GLY 2 6.079 -3.057 0.955
7 H ALA 3 H ALA 3 5.943 -5.493 0.710
8 HA ALA 3 HA ALA 3 3.076 -6.436 0.569
9 HB1 ALA 3 HB1 ALA 3 4.636 -7.415 -1.136
10 HB2 ALA 3 HB2 ALA 3 5.697 -7.993 0.183
11 HB3 ALA 3 HB3 ALA 3 4.037 -8.644 0.019
12 H GLY 4 H GLY 4 3.939 -5.028 2.919
13 HA2 GLY 4 HA3 GLY 4 4.886 -7.009 4.851
14 HA3 GLY 4 HA2 GLY 4 4.359 -5.349 5.172
15 H HIS 5 H HIS 5 3.038 -5.985 6.934
16 HA HIS 5 HA HIS 5 0.862 -7.893 6.409
17 HB2 HIS 5 HB2 HIS 5 2.395 -7.203 8.906
18 HB3 HIS 5 HB3 HIS 5 0.848 -8.042 8.980
19 HD1 HIS 5 HD1 HIS 5 3.711 -9.212 9.802
20 HD2 HIS 5 HD2 HIS 5 1.604 -10.014 6.312
21 HE1 HIS 5 HE1 HIS 5 4.575 -11.429 8.989
22 H VAL 6 H VAL 6 1.476 -4.456 7.282
23 HA VAL 6 HA VAL 6 -1.279 -4.240 8.400
24 HB VAL 6 HB VAL 6 1.173 -2.418 8.626
25 HG11 VAL 6 HG11 VAL 6 -1.514 -2.229 10.113
26 HG12 VAL 6 HG12 VAL 6 -0.105 -1.154 10.303
27 HG13 VAL 6 HG13 VAL 6 -1.009 -1.154 8.767
28 HG21 VAL 6 HG21 VAL 6 1.486 -4.567 9.884
29 HG22 VAL 6 HG22 VAL 6 1.249 -3.203 11.006
30 HG23 VAL 6 HG23 VAL 6 -0.095 -4.337 10.683
31 HA PRO 7 HA PRO 7 -1.864 -2.391 4.334
32 HB2 PRO 7 HB2 PRO 7 -4.235 -1.026 4.577
33 HB3 PRO 7 HB3 PRO 7 -4.087 -2.817 4.658
34 HG2 PRO 7 HG2 PRO 7 -4.071 -0.916 7.051
35 HG3 PRO 7 HG3 PRO 7 -5.238 -2.254 6.775
36 HD2 PRO 7 HD2 PRO 7 -3.061 -2.681 8.320
37 HD3 PRO 7 HD3 PRO 7 -3.449 -3.935 7.079
38 H GLU 8 H GLU 8 -1.315 -0.412 3.207
39 HA GLU 8 HA GLU 8 -0.152 1.702 4.902
40 HB2 GLU 8 HB2 GLU 8 -0.393 1.366 1.849
41 HB3 GLU 8 HB3 GLU 8 0.367 2.770 2.642
42 HG2 GLU 8 HG2 GLU 8 2.078 1.352 3.695
43 HG3 GLU 8 HG3 GLU 8 1.256 -0.129 3.153
44 H TYR 9 H TYR 9 -2.994 1.295 2.619
45 HA TYR 9 HA TYR 9 -4.206 3.720 3.888
46 HB2 TYR 9 HB2 TYR 9 -4.742 4.521 1.484
47 HB3 TYR 9 HB3 TYR 9 -3.028 4.598 1.933
48 HD1 TYR 9 HD2 TYR 9 -5.566 2.388 0.193
49 HD2 TYR 9 HD1 TYR 9 -1.404 3.418 0.607
50 HE1 TYR 9 HE2 TYR 9 -5.002 0.861 -1.659
51 HE2 TYR 9 HE1 TYR 9 -0.854 1.940 -1.290
52 HH TYR 9 HH TYR 9 -3.274 0.326 -3.284
53 H PHE 10 H PHE 10 -6.586 3.959 2.952
54 HA PHE 10 HA PHE 10 -7.710 1.188 2.636
55 HB2 PHE 10 HB2 PHE 10 -8.761 3.452 4.430
56 HB3 PHE 10 HB3 PHE 10 -9.546 1.878 4.162
57 HD1 PHE 10 HD1 PHE 10 -6.513 3.574 5.595
58 HD2 PHE 10 HD2 PHE 10 -8.614 -0.166 5.226
59 HE1 PHE 10 HE1 PHE 10 -5.224 2.659 7.498
60 HE2 PHE 10 HE2 PHE 10 -7.413 -1.032 7.209
61 HZ PHE 10 HZ PHE 10 -5.749 0.397 8.381
62 H VAL 11 H VAL 11 -9.337 1.124 1.026
63 HA VAL 11 HA VAL 11 -10.147 3.695 -0.146
64 HB VAL 11 HB VAL 11 -10.564 0.940 -1.308
65 HG11 VAL 11 HG11 VAL 11 -10.669 2.446 -3.428
66 HG12 VAL 11 HG12 VAL 11 -12.081 2.317 -2.377
67 HG13 VAL 11 HG13 VAL 11 -11.030 3.729 -2.274
68 HG21 VAL 11 HG21 VAL 11 -8.671 1.513 -2.809
69 HG22 VAL 11 HG22 VAL 11 -8.351 2.928 -1.806
70 HG23 VAL 11 HG23 VAL 11 -8.193 1.310 -1.123
71 H ARG 12 H ARG 12 -12.429 3.809 -0.926
72 HA ARG 12 HA ARG 12 -14.201 3.162 1.237
73 HB2 ARG 12 HB2 ARG 12 -14.718 4.449 -1.450
74 HB3 ARG 12 HB3 ARG 12 -15.913 4.301 -0.168
75 HG2 ARG 12 HG2 ARG 12 -14.680 5.754 1.257
76 HG3 ARG 12 HG3 ARG 12 -13.296 5.744 0.163
77 HD2 ARG 12 HD2 ARG 12 -14.267 7.739 -0.409
78 HD3 ARG 12 HD3 ARG 12 -15.054 6.657 -1.557
79 HE ARG 12 HE ARG 12 -16.529 6.918 0.874
80 HH11 ARG 12 HH11 ARG 12 -15.851 8.438 -2.184
81 HH12 ARG 12 HH12 ARG 12 -17.354 9.298 -2.237
82 HH21 ARG 12 HH21 ARG 12 -18.511 8.045 0.815
83 HH22 ARG 12 HH22 ARG 12 -18.866 9.074 -0.531
84 H GLY 13 H GLY 13 -13.042 0.915 -0.258
85 HA2 GLY 13 HA3 GLY 13 -15.444 -0.233 -1.513
86 HA3 GLY 13 HA2 GLY 13 -13.801 -0.814 -1.740
87 H ASP 14 H ASP 14 -13.306 -2.624 -0.712
88 HA ASP 14 HA ASP 14 -14.856 -3.328 1.694
89 HB2 ASP 14 HB2 ASP 14 -15.372 -4.834 -0.139
90 HB3 ASP 14 HB3 ASP 14 -13.659 -5.142 -0.410
91 H PHE 15 H PHE 15 -11.887 -4.648 0.257
92 HA PHE 15 HA PHE 15 -10.531 -4.136 2.822
93 HB2 PHE 15 HB2 PHE 15 -10.380 -6.480 0.946
94 HB3 PHE 15 HB3 PHE 15 -9.066 -6.131 2.064
95 HD1 PHE 15 HD1 PHE 15 -10.235 -5.417 4.521
96 HD2 PHE 15 HD2 PHE 15 -11.643 -8.244 1.668
97 HE1 PHE 15 HE1 PHE 15 -11.434 -6.614 6.305
98 HE2 PHE 15 HE2 PHE 15 -12.846 -9.445 3.447
99 HZ PHE 15 HZ PHE 15 -12.743 -8.631 5.768
100 HA PRO 16 HA PRO 16 -7.614 -1.810 0.457
101 HB2 PRO 16 HB2 PRO 16 -5.351 -1.842 2.040
102 HB3 PRO 16 HB3 PRO 16 -6.901 -1.164 2.631
103 HG2 PRO 16 HG2 PRO 16 -5.883 -4.004 3.109
104 HG3 PRO 16 HG3 PRO 16 -6.396 -2.813 4.362
105 HD2 PRO 16 HD2 PRO 16 -8.135 -4.664 3.521
106 HD3 PRO 16 HD3 PRO 16 -8.695 -2.960 3.737
107 H ILE 17 H ILE 17 -5.266 -1.936 -0.569
108 HA ILE 17 HA ILE 17 -5.164 -4.658 -1.822
109 HB ILE 17 HB ILE 17 -4.294 -1.922 -2.855
110 HG12 ILE 17 HG12 ILE 17 -5.903 -2.382 -4.682
111 HG13 ILE 17 HG13 ILE 17 -6.399 -3.909 -3.913
112 HG21 ILE 17 HG21 ILE 17 -3.613 -3.148 -4.950
113 HG22 ILE 17 HG22 ILE 17 -2.595 -3.600 -3.573
114 HG23 ILE 17 HG23 ILE 17 -3.894 -4.701 -4.114
115 HD11 ILE 17 HD11 ILE 17 -7.471 -2.669 -2.062
116 HD12 ILE 17 HD12 ILE 17 -6.734 -1.125 -2.602
117 HD13 ILE 17 HD13 ILE 17 -7.991 -1.927 -3.584
118 H SER 18 H SER 18 -2.747 -1.973 -0.991
119 HA SER 18 HA SER 18 -0.669 -4.121 -1.023
120 HB2 SER 18 HB2 SER 18 0.884 -2.151 -1.171
121 HB3 SER 18 HB3 SER 18 -0.368 -2.116 -2.438
122 HG SER 18 HG SER 18 -0.538 -0.576 -0.018
123 H PHE 19 H PHE 19 1.239 -3.655 0.681
124 HA PHE 19 HA PHE 19 0.035 -2.898 3.294
125 HB2 PHE 19 HB2 PHE 19 1.585 -5.485 2.807
126 HB3 PHE 19 HB3 PHE 19 0.686 -5.055 4.288
127 HD1 PHE 19 HD1 PHE 19 -1.868 -4.909 4.168
128 HD2 PHE 19 HD2 PHE 19 0.479 -6.471 0.908
129 HE1 PHE 19 HE1 PHE 19 -3.910 -5.881 3.153
130 HE2 PHE 19 HE2 PHE 19 -1.544 -7.520 -0.045
131 HZ PHE 19 HZ PHE 19 -3.751 -7.203 1.054
132 H TYR 20 H TYR 20 1.947 -3.194 5.073
133 HA TYR 20 HA TYR 20 3.422 -0.869 4.301
134 HB2 TYR 20 HB2 TYR 20 2.695 -1.863 6.775
135 HB3 TYR 20 HB3 TYR 20 4.378 -2.402 6.740
136 HD1 TYR 20 HD2 TYR 20 2.076 0.512 6.088
137 HD2 TYR 20 HD1 TYR 20 5.962 -0.658 7.513
138 HE1 TYR 20 HE2 TYR 20 2.589 2.866 6.592
139 HE2 TYR 20 HE1 TYR 20 6.460 1.700 8.063
140 HH TYR 20 HH TYR 20 4.209 4.400 7.450
141 H GLY 21 H GLY 21 6.003 -0.808 4.893
142 HA2 GLY 21 HA3 GLY 21 8.109 -1.932 4.624
143 HA3 GLY 21 HA2 GLY 21 7.314 -3.231 3.713
Start of MODEL 5
1 H1 GLY 1 H GLY 1 1.179 -0.374 0.712
2 HA2 GLY 1 HA3 GLY 1 1.916 0.508 -1.443
3 HA3 GLY 1 HA2 GLY 1 3.345 1.226 -0.672
4 H GLY 2 H GLY 2 4.283 -0.803 1.041
5 HA2 GLY 2 HA3 GLY 2 5.525 -2.544 -0.953
6 HA3 GLY 2 HA2 GLY 2 5.808 -2.543 0.801
7 H ALA 3 H ALA 3 5.732 -4.965 0.720
8 HA ALA 3 HA ALA 3 2.900 -6.003 0.490
9 HB1 ALA 3 HB1 ALA 3 3.900 -8.123 -0.291
10 HB2 ALA 3 HB2 ALA 3 4.404 -6.781 -1.362
11 HB3 ALA 3 HB3 ALA 3 5.544 -7.428 -0.144
12 H GLY 4 H GLY 4 3.880 -4.764 2.911
13 HA2 GLY 4 HA3 GLY 4 4.874 -6.933 4.619
14 HA3 GLY 4 HA2 GLY 4 4.437 -5.291 5.104
15 H HIS 5 H HIS 5 3.060 -5.877 6.827
16 HA HIS 5 HA HIS 5 0.905 -7.808 6.300
17 HB2 HIS 5 HB2 HIS 5 2.461 -7.134 8.788
18 HB3 HIS 5 HB3 HIS 5 0.931 -8.001 8.868
19 HD1 HIS 5 HD1 HIS 5 1.449 -10.382 9.255
20 HD2 HIS 5 HD2 HIS 5 4.072 -8.659 6.532
21 HE1 HIS 5 HE1 HIS 5 2.945 -12.252 8.487
22 H VAL 6 H VAL 6 1.476 -4.378 7.191
23 HA VAL 6 HA VAL 6 -1.260 -4.204 8.354
24 HB VAL 6 HB VAL 6 1.191 -2.376 8.578
25 HG11 VAL 6 HG11 VAL 6 -1.477 -2.211 10.099
26 HG12 VAL 6 HG12 VAL 6 -0.069 -1.138 10.290
27 HG13 VAL 6 HG13 VAL 6 -0.989 -1.117 8.765
28 HG21 VAL 6 HG21 VAL 6 1.300 -3.193 10.946
29 HG22 VAL 6 HG22 VAL 6 -0.046 -4.323 10.624
30 HG23 VAL 6 HG23 VAL 6 1.525 -4.539 9.802
31 HA PRO 7 HA PRO 7 -1.867 -2.272 4.328
32 HB2 PRO 7 HB2 PRO 7 -4.266 -0.974 4.586
33 HB3 PRO 7 HB3 PRO 7 -4.072 -2.762 4.649
34 HG2 PRO 7 HG2 PRO 7 -4.123 -0.882 7.063
35 HG3 PRO 7 HG3 PRO 7 -5.243 -2.258 6.767
36 HD2 PRO 7 HD2 PRO 7 -3.049 -2.628 8.316
37 HD3 PRO 7 HD3 PRO 7 -3.425 -3.886 7.076
38 H GLU 8 H GLU 8 -1.445 -0.251 3.221
39 HA GLU 8 HA GLU 8 -0.272 1.840 4.942
40 HB2 GLU 8 HB2 GLU 8 -0.527 1.550 1.880
41 HB3 GLU 8 HB3 GLU 8 0.250 2.930 2.697
42 HG2 GLU 8 HG2 GLU 8 1.929 1.459 3.750
43 HG3 GLU 8 HG3 GLU 8 1.113 0.005 3.126
44 H TYR 9 H TYR 9 -3.165 1.416 2.745
45 HA TYR 9 HA TYR 9 -4.398 3.765 4.119
46 HB2 TYR 9 HB2 TYR 9 -4.999 4.678 1.782
47 HB3 TYR 9 HB3 TYR 9 -3.265 4.735 2.153
48 HD1 TYR 9 HD1 TYR 9 -5.903 2.640 0.424
49 HD2 TYR 9 HD2 TYR 9 -1.713 3.591 0.698
50 HE1 TYR 9 HE1 TYR 9 -5.423 1.098 -1.447
51 HE2 TYR 9 HE2 TYR 9 -1.254 2.144 -1.233
52 HH TYR 9 HH TYR 9 -2.168 0.613 -2.826
53 H PHE 10 H PHE 10 -6.831 3.950 3.216
54 HA PHE 10 HA PHE 10 -7.798 1.159 2.698
55 HB2 PHE 10 HB2 PHE 10 -8.963 3.237 4.628
56 HB3 PHE 10 HB3 PHE 10 -9.790 1.743 4.135
57 HD1 PHE 10 HD1 PHE 10 -6.830 3.089 5.994
58 HD2 PHE 10 HD2 PHE 10 -8.947 -0.479 4.855
59 HE1 PHE 10 HE1 PHE 10 -5.760 1.855 7.857
60 HE2 PHE 10 HE2 PHE 10 -7.896 -1.703 6.732
61 HZ PHE 10 HZ PHE 10 -6.389 -0.505 8.306
62 H VAL 11 H VAL 11 -9.545 1.014 1.281
63 HA VAL 11 HA VAL 11 -10.335 3.493 -0.086
64 HB VAL 11 HB VAL 11 -10.746 0.662 -1.048
65 HG11 VAL 11 HG11 VAL 11 -10.816 2.010 -3.274
66 HG12 VAL 11 HG12 VAL 11 -12.242 1.959 -2.236
67 HG13 VAL 11 HG13 VAL 11 -11.189 3.374 -2.221
68 HG21 VAL 11 HG21 VAL 11 -8.821 1.840 -2.648
69 HG22 VAL 11 HG22 VAL 11 -8.358 2.311 -1.013
70 HG23 VAL 11 HG23 VAL 11 -8.546 0.606 -1.419
71 H ARG 12 H ARG 12 -12.608 3.547 -0.903
72 HA ARG 12 HA ARG 12 -14.407 3.064 1.280
73 HB2 ARG 12 HB2 ARG 12 -14.869 4.165 -1.496
74 HB3 ARG 12 HB3 ARG 12 -16.102 4.088 -0.245
75 HG2 ARG 12 HG2 ARG 12 -14.781 5.570 1.166
76 HG3 ARG 12 HG3 ARG 12 -13.524 5.633 -0.071
77 HD2 ARG 12 HD2 ARG 12 -15.587 6.371 -1.574
78 HD3 ARG 12 HD3 ARG 12 -16.206 6.902 -0.011
79 HE ARG 12 HE ARG 12 -14.653 8.589 -0.004
80 HH11 ARG 12 HH11 ARG 12 -13.820 6.264 -2.458
81 HH12 ARG 12 HH12 ARG 12 -12.569 7.245 -3.146
82 HH21 ARG 12 HH21 ARG 12 -13.008 9.889 -0.901
83 HH22 ARG 12 HH22 ARG 12 -12.107 9.306 -2.259
84 H GLY 13 H GLY 13 -13.203 0.748 -0.176
85 HA2 GLY 13 HA3 GLY 13 -15.630 -0.502 -1.274
86 HA3 GLY 13 HA2 GLY 13 -13.986 -1.065 -1.534
87 H ASP 14 H ASP 14 -13.432 -2.825 -0.452
88 HA ASP 14 HA ASP 14 -14.872 -3.435 2.047
89 HB2 ASP 14 HB2 ASP 14 -15.446 -5.030 0.310
90 HB3 ASP 14 HB3 ASP 14 -13.742 -5.328 -0.024
91 H PHE 15 H PHE 15 -11.956 -4.810 0.558
92 HA PHE 15 HA PHE 15 -10.515 -4.214 3.057
93 HB2 PHE 15 HB2 PHE 15 -10.341 -6.535 1.153
94 HB3 PHE 15 HB3 PHE 15 -9.006 -6.147 2.233
95 HD1 PHE 15 HD1 PHE 15 -10.115 -5.503 4.734
96 HD2 PHE 15 HD2 PHE 15 -11.521 -8.347 1.896
97 HE1 PHE 15 HE1 PHE 15 -11.212 -6.759 6.542
98 HE2 PHE 15 HE2 PHE 15 -12.621 -9.607 3.700
99 HZ PHE 15 HZ PHE 15 -12.468 -8.814 6.026
100 HA PRO 16 HA PRO 16 -7.749 -1.773 0.614
101 HB2 PRO 16 HB2 PRO 16 -5.432 -1.765 2.116
102 HB3 PRO 16 HB3 PRO 16 -6.974 -1.128 2.767
103 HG2 PRO 16 HG2 PRO 16 -5.879 -3.944 3.194
104 HG3 PRO 16 HG3 PRO 16 -6.383 -2.772 4.468
105 HD2 PRO 16 HD2 PRO 16 -8.092 -4.659 3.675
106 HD3 PRO 16 HD3 PRO 16 -8.693 -2.976 3.919
107 H ILE 17 H ILE 17 -5.432 -1.859 -0.512
108 HA ILE 17 HA ILE 17 -5.300 -4.592 -1.729
109 HB ILE 17 HB ILE 17 -4.450 -1.879 -2.858
110 HG12 ILE 17 HG12 ILE 17 -6.142 -2.398 -4.618
111 HG13 ILE 17 HG13 ILE 17 -6.680 -3.832 -3.711
112 HG21 ILE 17 HG21 ILE 17 -4.198 -4.705 -4.056
113 HG22 ILE 17 HG22 ILE 17 -3.878 -3.180 -4.929
114 HG23 ILE 17 HG23 ILE 17 -2.836 -3.652 -3.576
115 HD11 ILE 17 HD11 ILE 17 -7.598 -2.380 -1.917
116 HD12 ILE 17 HD12 ILE 17 -6.794 -0.938 -2.618
117 HD13 ILE 17 HD13 ILE 17 -8.145 -1.733 -3.472
118 H SER 18 H SER 18 -2.951 -1.844 -0.982
119 HA SER 18 HA SER 18 -0.809 -3.890 -1.133
120 HB2 SER 18 HB2 SER 18 0.699 -2.052 -1.375
121 HB3 SER 18 HB3 SER 18 -0.739 -1.564 -2.296
122 HG SER 18 HG SER 18 -1.298 -0.298 -0.290
123 H PHE 19 H PHE 19 1.143 -3.405 0.574
124 HA PHE 19 HA PHE 19 -0.015 -2.838 3.247
125 HB2 PHE 19 HB2 PHE 19 1.560 -5.367 2.570
126 HB3 PHE 19 HB3 PHE 19 0.802 -4.991 4.140
127 HD1 PHE 19 HD1 PHE 19 -1.740 -4.826 4.275
128 HD2 PHE 19 HD2 PHE 19 0.267 -6.348 0.779
129 HE1 PHE 19 HE1 PHE 19 -3.880 -5.757 3.443
130 HE2 PHE 19 HE2 PHE 19 -1.846 -7.371 0.013
131 HZ PHE 19 HZ PHE 19 -3.939 -7.030 1.309
132 H TYR 20 H TYR 20 1.957 -3.101 4.966
133 HA TYR 20 HA TYR 20 3.290 -0.677 4.200
134 HB2 TYR 20 HB2 TYR 20 2.542 -1.586 6.632
135 HB3 TYR 20 HB3 TYR 20 4.179 -2.256 6.659
136 HD1 TYR 20 HD1 TYR 20 2.071 0.806 6.165
137 HD2 TYR 20 HD2 TYR 20 5.992 -0.624 7.211
138 HE1 TYR 20 HE1 TYR 20 2.752 3.106 6.708
139 HE2 TYR 20 HE2 TYR 20 6.666 1.685 7.796
140 HH TYR 20 HH TYR 20 4.513 4.516 7.497
141 H GLY 21 H GLY 21 5.807 -0.359 4.537
142 HA2 GLY 21 HA3 GLY 21 7.478 -2.671 4.413
143 HA3 GLY 21 HA2 GLY 21 7.232 -2.055 2.753
Start of MODEL 6
1 H1 GLY 1 H GLY 1 1.173 -0.503 0.667
2 HA2 GLY 1 HA3 GLY 1 2.033 0.255 -1.477
3 HA3 GLY 1 HA2 GLY 1 3.439 0.980 -0.680
4 H GLY 2 H GLY 2 4.355 -0.988 1.095
5 HA2 GLY 2 HA3 GLY 2 5.615 -2.791 -0.824
6 HA3 GLY 2 HA2 GLY 2 5.873 -2.743 0.933
7 H ALA 3 H ALA 3 5.829 -5.172 0.846
8 HA ALA 3 HA ALA 3 3.007 -6.238 0.630
9 HB1 ALA 3 HB1 ALA 3 4.567 -7.073 -1.153
10 HB2 ALA 3 HB2 ALA 3 5.677 -7.663 0.119
11 HB3 ALA 3 HB3 ALA 3 4.042 -8.376 -0.045
12 H GLY 4 H GLY 4 3.925 -4.899 3.022
13 HA2 GLY 4 HA3 GLY 4 4.891 -6.991 4.839
14 HA3 GLY 4 HA2 GLY 4 4.431 -5.333 5.244
15 H HIS 5 H HIS 5 3.044 -5.891 6.970
16 HA HIS 5 HA HIS 5 0.884 -7.822 6.465
17 HB2 HIS 5 HB2 HIS 5 2.414 -7.094 8.954
18 HB3 HIS 5 HB3 HIS 5 0.877 -7.949 9.037
19 HD1 HIS 5 HD1 HIS 5 4.188 -8.394 7.202
20 HD2 HIS 5 HD2 HIS 5 1.216 -10.624 9.061
21 HE1 HIS 5 HE1 HIS 5 4.966 -10.783 7.084
22 H VAL 6 H VAL 6 1.470 -4.375 7.299
23 HA VAL 6 HA VAL 6 -1.283 -4.162 8.424
24 HB VAL 6 HB VAL 6 1.174 -2.344 8.645
25 HG11 VAL 6 HG11 VAL 6 -1.508 -2.145 10.138
26 HG12 VAL 6 HG12 VAL 6 -0.096 -1.075 10.325
27 HG13 VAL 6 HG13 VAL 6 -1.002 -1.073 8.791
28 HG21 VAL 6 HG21 VAL 6 1.252 -3.127 11.028
29 HG22 VAL 6 HG22 VAL 6 -0.095 -4.258 10.707
30 HG23 VAL 6 HG23 VAL 6 1.485 -4.492 9.906
31 HA PRO 7 HA PRO 7 -1.856 -2.306 4.363
32 HB2 PRO 7 HB2 PRO 7 -4.235 -0.957 4.590
33 HB3 PRO 7 HB3 PRO 7 -4.073 -2.748 4.682
34 HG2 PRO 7 HG2 PRO 7 -4.099 -0.834 7.067
35 HG3 PRO 7 HG3 PRO 7 -5.239 -2.197 6.783
36 HD2 PRO 7 HD2 PRO 7 -3.062 -2.579 8.348
37 HD3 PRO 7 HD3 PRO 7 -3.442 -3.847 7.119
38 H GLU 8 H GLU 8 -1.424 -0.320 3.205
39 HA GLU 8 HA GLU 8 -0.197 1.793 4.874
40 HB2 GLU 8 HB2 GLU 8 -0.418 1.408 1.821
41 HB3 GLU 8 HB3 GLU 8 0.399 2.782 2.611
42 HG2 GLU 8 HG2 GLU 8 1.996 1.276 3.739
43 HG3 GLU 8 HG3 GLU 8 1.143 -0.160 3.121
44 H TYR 9 H TYR 9 -3.028 1.392 2.589
45 HA TYR 9 HA TYR 9 -4.256 3.797 3.870
46 HB2 TYR 9 HB2 TYR 9 -4.761 4.645 1.469
47 HB3 TYR 9 HB3 TYR 9 -3.053 4.732 1.945
48 HD1 TYR 9 HD1 TYR 9 -5.550 2.573 0.096
49 HD2 TYR 9 HD2 TYR 9 -1.395 3.555 0.651
50 HE1 TYR 9 HE1 TYR 9 -4.943 1.019 -1.716
51 HE2 TYR 9 HE2 TYR 9 -0.793 2.036 -1.199
52 HH TYR 9 HH TYR 9 -3.172 0.246 -3.143
53 H PHE 10 H PHE 10 -6.645 4.018 2.897
54 HA PHE 10 HA PHE 10 -7.660 1.240 2.409
55 HB2 PHE 10 HB2 PHE 10 -8.823 3.379 4.272
56 HB3 PHE 10 HB3 PHE 10 -9.669 1.891 3.791
57 HD1 PHE 10 HD1 PHE 10 -6.721 3.217 5.683
58 HD2 PHE 10 HD2 PHE 10 -8.881 -0.333 4.572
59 HE1 PHE 10 HE1 PHE 10 -5.721 2.005 7.600
60 HE2 PHE 10 HE2 PHE 10 -7.897 -1.536 6.498
61 HZ PHE 10 HZ PHE 10 -6.417 -0.328 8.091
62 H VAL 11 H VAL 11 -9.375 1.100 0.958
63 HA VAL 11 HA VAL 11 -10.094 3.565 -0.473
64 HB VAL 11 HB VAL 11 -10.547 0.722 -1.382
65 HG11 VAL 11 HG11 VAL 11 -12.000 2.022 -2.619
66 HG12 VAL 11 HG12 VAL 11 -10.919 3.417 -2.619
67 HG13 VAL 11 HG13 VAL 11 -10.559 2.022 -3.637
68 HG21 VAL 11 HG21 VAL 11 -8.339 0.623 -1.695
69 HG22 VAL 11 HG22 VAL 11 -8.577 1.803 -2.983
70 HG23 VAL 11 HG23 VAL 11 -8.132 2.343 -1.364
71 H ARG 12 H ARG 12 -12.353 3.645 -1.327
72 HA ARG 12 HA ARG 12 -14.195 3.250 0.837
73 HB2 ARG 12 HB2 ARG 12 -14.695 4.223 -1.982
74 HB3 ARG 12 HB3 ARG 12 -15.829 4.330 -0.642
75 HG2 ARG 12 HG2 ARG 12 -14.371 5.850 0.529
76 HG3 ARG 12 HG3 ARG 12 -13.135 5.671 -0.718
77 HD2 ARG 12 HD2 ARG 12 -14.119 7.619 -1.403
78 HD3 ARG 12 HD3 ARG 12 -15.089 6.449 -2.297
79 HE ARG 12 HE ARG 12 -16.904 7.064 -1.050
80 HH11 ARG 12 HH11 ARG 12 -14.011 8.160 0.546
81 HH12 ARG 12 HH12 ARG 12 -14.863 9.068 1.750
82 HH21 ARG 12 HH21 ARG 12 -18.037 8.256 0.530
83 HH22 ARG 12 HH22 ARG 12 -17.153 9.121 1.741
84 H GLY 13 H GLY 13 -13.021 0.865 -0.499
85 HA2 GLY 13 HA3 GLY 13 -15.445 -0.364 -1.628
86 HA3 GLY 13 HA2 GLY 13 -13.808 -0.972 -1.825
87 H ASP 14 H ASP 14 -13.331 -2.712 -0.676
88 HA ASP 14 HA ASP 14 -14.843 -3.201 1.807
89 HB2 ASP 14 HB2 ASP 14 -15.421 -4.833 0.103
90 HB3 ASP 14 HB3 ASP 14 -13.719 -5.195 -0.171
91 H PHE 15 H PHE 15 -11.932 -4.694 0.423
92 HA PHE 15 HA PHE 15 -10.530 -4.059 2.935
93 HB2 PHE 15 HB2 PHE 15 -10.386 -6.450 1.118
94 HB3 PHE 15 HB3 PHE 15 -9.061 -6.063 2.210
95 HD1 PHE 15 HD1 PHE 15 -9.856 -5.576 4.706
96 HD2 PHE 15 HD2 PHE 15 -11.977 -7.921 1.857
97 HE1 PHE 15 HE1 PHE 15 -11.025 -6.735 6.535
98 HE2 PHE 15 HE2 PHE 15 -13.149 -9.083 3.681
99 HZ PHE 15 HZ PHE 15 -12.675 -8.490 6.024
100 HA PRO 16 HA PRO 16 -7.656 -1.792 0.434
101 HB2 PRO 16 HB2 PRO 16 -5.377 -1.735 1.979
102 HB3 PRO 16 HB3 PRO 16 -6.928 -1.066 2.575
103 HG2 PRO 16 HG2 PRO 16 -5.844 -3.860 3.139
104 HG3 PRO 16 HG3 PRO 16 -6.371 -2.634 4.352
105 HD2 PRO 16 HD2 PRO 16 -8.054 -4.569 3.580
106 HD3 PRO 16 HD3 PRO 16 -8.673 -2.886 3.794
107 H ILE 17 H ILE 17 -5.302 -1.965 -0.608
108 HA ILE 17 HA ILE 17 -5.257 -4.712 -1.792
109 HB ILE 17 HB ILE 17 -4.271 -2.036 -2.875
110 HG12 ILE 17 HG12 ILE 17 -5.893 -2.478 -4.705
111 HG13 ILE 17 HG13 ILE 17 -6.467 -3.950 -3.886
112 HG21 ILE 17 HG21 ILE 17 -3.993 -4.858 -4.076
113 HG22 ILE 17 HG22 ILE 17 -3.633 -3.336 -4.937
114 HG23 ILE 17 HG23 ILE 17 -2.647 -3.810 -3.544
115 HD11 ILE 17 HD11 ILE 17 -7.950 -1.871 -3.628
116 HD12 ILE 17 HD12 ILE 17 -7.472 -2.584 -2.078
117 HD13 ILE 17 HD13 ILE 17 -6.646 -1.108 -2.676
118 H SER 18 H SER 18 -2.800 -2.091 -0.961
119 HA SER 18 HA SER 18 -0.764 -4.281 -0.947
120 HB2 SER 18 HB2 SER 18 0.848 -2.590 -1.395
121 HB3 SER 18 HB3 SER 18 -0.541 -2.167 -2.421
122 HG SER 18 HG SER 18 -1.060 -0.560 -0.689
123 H PHE 19 H PHE 19 1.201 -3.699 0.704
124 HA PHE 19 HA PHE 19 0.011 -2.884 3.305
125 HB2 PHE 19 HB2 PHE 19 1.588 -5.457 2.876
126 HB3 PHE 19 HB3 PHE 19 0.668 -5.015 4.340
127 HD1 PHE 19 HD2 PHE 19 -1.900 -4.808 4.141
128 HD2 PHE 19 HD1 PHE 19 0.518 -6.612 1.065
129 HE1 PHE 19 HE2 PHE 19 -3.928 -5.796 3.114
130 HE2 PHE 19 HE1 PHE 19 -1.494 -7.666 0.099
131 HZ PHE 19 HZ PHE 19 -3.728 -7.244 1.104
132 H TYR 20 H TYR 20 1.986 -3.184 5.070
133 HA TYR 20 HA TYR 20 3.339 -0.788 4.271
134 HB2 TYR 20 HB2 TYR 20 2.626 -1.710 6.731
135 HB3 TYR 20 HB3 TYR 20 4.283 -2.327 6.735
136 HD1 TYR 20 HD2 TYR 20 2.090 0.674 6.180
137 HD2 TYR 20 HD1 TYR 20 6.022 -0.643 7.325
138 HE1 TYR 20 HE2 TYR 20 2.707 2.999 6.697
139 HE2 TYR 20 HE1 TYR 20 6.634 1.690 7.875
140 HH TYR 20 HH TYR 20 4.415 4.464 7.503
141 H GLY 21 H GLY 21 5.867 -0.487 4.646
142 HA2 GLY 21 HA3 GLY 21 7.461 -2.903 4.192
143 HA3 GLY 21 HA2 GLY 21 7.314 -1.855 2.745
Start of MODEL 7
1 H1 GLY 1 H GLY 1 1.607 -0.819 0.902
2 HA2 GLY 1 HA3 GLY 1 2.067 0.090 -1.404
3 HA3 GLY 1 HA2 GLY 1 3.552 0.827 -0.748
4 H GLY 2 H GLY 2 4.486 -1.101 1.087
5 HA2 GLY 2 HA3 GLY 2 5.744 -2.900 -0.837
6 HA3 GLY 2 HA2 GLY 2 6.037 -2.830 0.913
7 H ALA 3 H ALA 3 6.063 -5.281 0.663
8 HA ALA 3 HA ALA 3 3.294 -6.444 0.430
9 HB1 ALA 3 HB1 ALA 3 6.040 -7.791 0.230
10 HB2 ALA 3 HB2 ALA 3 4.442 -8.562 -0.017
11 HB3 ALA 3 HB3 ALA 3 5.011 -7.298 -1.149
12 H GLY 4 H GLY 4 3.822 -4.987 2.844
13 HA2 GLY 4 HA3 GLY 4 4.900 -6.897 4.816
14 HA3 GLY 4 HA2 GLY 4 4.310 -5.257 5.109
15 H HIS 5 H HIS 5 3.069 -5.961 6.908
16 HA HIS 5 HA HIS 5 0.890 -7.868 6.392
17 HB2 HIS 5 HB2 HIS 5 2.437 -7.182 8.882
18 HB3 HIS 5 HB3 HIS 5 0.893 -8.025 8.962
19 HD1 HIS 5 HD1 HIS 5 3.564 -9.321 9.894
20 HD2 HIS 5 HD2 HIS 5 1.839 -9.855 6.152
21 HE1 HIS 5 HE1 HIS 5 4.480 -11.500 9.036
22 H VAL 6 H VAL 6 1.506 -4.430 7.266
23 HA VAL 6 HA VAL 6 -1.240 -4.219 8.416
24 HB VAL 6 HB VAL 6 1.232 -2.444 8.704
25 HG11 VAL 6 HG11 VAL 6 -0.057 -1.211 10.402
26 HG12 VAL 6 HG12 VAL 6 -0.931 -1.142 8.851
27 HG13 VAL 6 HG13 VAL 6 -1.483 -2.251 10.146
28 HG21 VAL 6 HG21 VAL 6 1.488 -4.635 9.909
29 HG22 VAL 6 HG22 VAL 6 1.270 -3.294 11.061
30 HG23 VAL 6 HG23 VAL 6 -0.093 -4.391 10.701
31 HA PRO 7 HA PRO 7 -1.778 -2.371 4.382
32 HB2 PRO 7 HB2 PRO 7 -4.172 -1.015 4.576
33 HB3 PRO 7 HB3 PRO 7 -3.996 -2.804 4.631
34 HG2 PRO 7 HG2 PRO 7 -4.088 -0.939 7.052
35 HG3 PRO 7 HG3 PRO 7 -5.197 -2.320 6.725
36 HD2 PRO 7 HD2 PRO 7 -3.050 -2.685 8.325
37 HD3 PRO 7 HD3 PRO 7 -3.375 -3.942 7.064
38 H GLU 8 H GLU 8 -1.416 -0.350 3.197
39 HA GLU 8 HA GLU 8 -0.158 1.763 4.849
40 HB2 GLU 8 HB2 GLU 8 -0.469 1.385 1.810
41 HB3 GLU 8 HB3 GLU 8 0.284 2.815 2.567
42 HG2 GLU 8 HG2 GLU 8 2.066 1.472 3.577
43 HG3 GLU 8 HG3 GLU 8 1.237 -0.037 3.143
44 H TYR 9 H TYR 9 -2.970 1.419 2.509
45 HA TYR 9 HA TYR 9 -4.237 3.767 3.870
46 HB2 TYR 9 HB2 TYR 9 -4.789 4.630 1.493
47 HB3 TYR 9 HB3 TYR 9 -3.080 4.764 1.961
48 HD1 TYR 9 HD2 TYR 9 -5.515 2.620 0.033
49 HD2 TYR 9 HD1 TYR 9 -1.378 3.616 0.684
50 HE1 TYR 9 HE2 TYR 9 -4.868 1.148 -1.831
51 HE2 TYR 9 HE1 TYR 9 -0.729 2.127 -1.175
52 HH TYR 9 HH TYR 9 -3.066 0.282 -3.145
53 H PHE 10 H PHE 10 -6.620 3.964 3.110
54 HA PHE 10 HA PHE 10 -7.649 1.200 2.544
55 HB2 PHE 10 HB2 PHE 10 -8.765 3.331 4.444
56 HB3 PHE 10 HB3 PHE 10 -9.658 1.883 3.931
57 HD1 PHE 10 HD1 PHE 10 -6.701 3.067 5.889
58 HD2 PHE 10 HD2 PHE 10 -8.909 -0.392 4.600
59 HE1 PHE 10 HE1 PHE 10 -5.739 1.752 7.757
60 HE2 PHE 10 HE2 PHE 10 -7.947 -1.703 6.467
61 HZ PHE 10 HZ PHE 10 -6.460 -0.595 8.124
62 H VAL 11 H VAL 11 -9.368 1.084 1.101
63 HA VAL 11 HA VAL 11 -10.090 3.561 -0.308
64 HB VAL 11 HB VAL 11 -10.547 0.726 -1.238
65 HG11 VAL 11 HG11 VAL 11 -10.566 2.045 -3.482
66 HG12 VAL 11 HG12 VAL 11 -12.005 2.037 -2.460
67 HG13 VAL 11 HG13 VAL 11 -10.923 3.430 -2.452
68 HG21 VAL 11 HG21 VAL 11 -8.263 2.610 -1.794
69 HG22 VAL 11 HG22 VAL 11 -8.183 1.010 -1.057
70 HG23 VAL 11 HG23 VAL 11 -8.608 1.175 -2.760
71 H ARG 12 H ARG 12 -12.351 3.652 -1.152
72 HA ARG 12 HA ARG 12 -14.186 3.235 1.015
73 HB2 ARG 12 HB2 ARG 12 -14.593 4.307 -1.782
74 HB3 ARG 12 HB3 ARG 12 -15.842 4.271 -0.544
75 HG2 ARG 12 HG2 ARG 12 -14.540 5.761 0.854
76 HG3 ARG 12 HG3 ARG 12 -13.229 5.752 -0.328
77 HD2 ARG 12 HD2 ARG 12 -14.248 7.646 -1.026
78 HD3 ARG 12 HD3 ARG 12 -15.247 6.500 -1.920
79 HE ARG 12 HE ARG 12 -16.563 6.734 0.420
80 HH11 ARG 12 HH11 ARG 12 -15.322 9.074 -1.839
81 HH12 ARG 12 HH12 ARG 12 -16.539 10.256 -1.485
82 HH21 ARG 12 HH21 ARG 12 -18.171 8.281 0.895
83 HH22 ARG 12 HH22 ARG 12 -18.158 9.804 0.071
84 H GLY 13 H GLY 13 -13.017 0.869 -0.373
85 HA2 GLY 13 HA3 GLY 13 -15.452 -0.344 -1.496
86 HA3 GLY 13 HA2 GLY 13 -13.817 -0.947 -1.719
87 H ASP 14 H ASP 14 -13.322 -2.702 -0.600
88 HA ASP 14 HA ASP 14 -14.813 -3.235 1.887
89 HB2 ASP 14 HB2 ASP 14 -15.401 -4.844 0.166
90 HB3 ASP 14 HB3 ASP 14 -13.700 -5.191 -0.134
91 H PHE 15 H PHE 15 -11.908 -4.698 0.459
92 HA PHE 15 HA PHE 15 -10.489 -4.097 2.970
93 HB2 PHE 15 HB2 PHE 15 -10.347 -6.455 1.109
94 HB3 PHE 15 HB3 PHE 15 -9.017 -6.082 2.199
95 HD1 PHE 15 HD1 PHE 15 -10.137 -5.369 4.674
96 HD2 PHE 15 HD2 PHE 15 -11.585 -8.221 1.866
97 HE1 PHE 15 HE1 PHE 15 -11.288 -6.566 6.489
98 HE2 PHE 15 HE2 PHE 15 -12.740 -9.422 3.677
99 HZ PHE 15 HZ PHE 15 -12.593 -8.595 5.992
100 HA PRO 16 HA PRO 16 -7.621 -1.778 0.503
101 HB2 PRO 16 HB2 PRO 16 -5.319 -1.808 2.049
102 HB3 PRO 16 HB3 PRO 16 -6.853 -1.120 2.661
103 HG2 PRO 16 HG2 PRO 16 -5.837 -3.960 3.141
104 HG3 PRO 16 HG3 PRO 16 -6.313 -2.754 4.394
105 HD2 PRO 16 HD2 PRO 16 -8.079 -4.598 3.613
106 HD3 PRO 16 HD3 PRO 16 -8.627 -2.892 3.830
107 H ILE 17 H ILE 17 -5.095 -2.021 -0.397
108 HA ILE 17 HA ILE 17 -5.118 -4.753 -1.655
109 HB ILE 17 HB ILE 17 -4.084 -2.138 -2.860
110 HG12 ILE 17 HG12 ILE 17 -6.095 -2.870 -4.537
111 HG13 ILE 17 HG13 ILE 17 -6.779 -3.557 -3.050
112 HG21 ILE 17 HG21 ILE 17 -4.367 -4.957 -4.055
113 HG22 ILE 17 HG22 ILE 17 -3.794 -3.499 -4.916
114 HG23 ILE 17 HG23 ILE 17 -2.822 -4.180 -3.597
115 HD11 ILE 17 HD11 ILE 17 -5.928 -0.613 -3.525
116 HD12 ILE 17 HD12 ILE 17 -7.600 -1.234 -3.501
117 HD13 ILE 17 HD13 ILE 17 -6.645 -1.212 -2.000
118 H SER 18 H SER 18 -2.670 -2.063 -0.945
119 HA SER 18 HA SER 18 -0.623 -4.260 -0.840
120 HB2 SER 18 HB2 SER 18 0.936 -2.306 -1.186
121 HB3 SER 18 HB3 SER 18 -0.283 -2.429 -2.479
122 HG SER 18 HG SER 18 -0.526 -0.598 -0.287
123 H PHE 19 H PHE 19 1.299 -3.611 0.825
124 HA PHE 19 HA PHE 19 0.121 -2.448 3.263
125 HB2 PHE 19 HB2 PHE 19 1.528 -5.102 3.553
126 HB3 PHE 19 HB3 PHE 19 0.212 -4.481 4.555
127 HD1 PHE 19 HD2 PHE 19 1.131 -6.339 1.507
128 HD2 PHE 19 HD1 PHE 19 -2.182 -4.755 3.749
129 HE1 PHE 19 HE2 PHE 19 -0.419 -7.755 0.206
130 HE2 PHE 19 HE1 PHE 19 -3.738 -6.148 2.419
131 HZ PHE 19 HZ PHE 19 -2.859 -7.680 0.672
132 H TYR 20 H TYR 20 1.962 -2.927 5.160
133 HA TYR 20 HA TYR 20 3.596 -0.715 4.338
134 HB2 TYR 20 HB2 TYR 20 2.726 -1.629 6.845
135 HB3 TYR 20 HB3 TYR 20 4.405 -2.169 6.874
136 HD1 TYR 20 HD1 TYR 20 2.148 0.721 5.983
137 HD2 TYR 20 HD2 TYR 20 5.926 -0.404 7.709
138 HE1 TYR 20 HE1 TYR 20 2.616 3.087 6.477
139 HE2 TYR 20 HE2 TYR 20 6.378 1.967 8.242
140 HH TYR 20 HH TYR 20 4.136 4.638 7.486
141 H GLY 21 H GLY 21 6.195 -0.956 5.239
142 HA2 GLY 21 HA3 GLY 21 8.225 -2.107 4.940
143 HA3 GLY 21 HA2 GLY 21 7.326 -3.533 4.367
Start of MODEL 8
1 H1 GLY 1 H GLY 1 1.771 -0.886 0.927
2 HA2 GLY 1 HA3 GLY 1 2.270 0.139 -1.375
3 HA3 GLY 1 HA2 GLY 1 3.754 0.775 -0.613
4 H GLY 2 H GLY 2 4.602 -1.251 1.087
5 HA2 GLY 2 HA3 GLY 2 5.705 -3.098 -0.908
6 HA3 GLY 2 HA2 GLY 2 6.084 -3.035 0.826
7 H ALA 3 H ALA 3 5.916 -5.459 0.834
8 HA ALA 3 HA ALA 3 3.062 -6.426 0.656
9 HB1 ALA 3 HB1 ALA 3 4.649 -7.409 -1.027
10 HB2 ALA 3 HB2 ALA 3 5.701 -7.968 0.306
11 HB3 ALA 3 HB3 ALA 3 4.049 -8.633 0.131
12 H GLY 4 H GLY 4 3.928 -4.997 3.010
13 HA2 GLY 4 HA3 GLY 4 4.815 -6.999 4.957
14 HA3 GLY 4 HA2 GLY 4 4.332 -5.328 5.271
15 H HIS 5 H HIS 5 2.974 -5.894 7.015
16 HA HIS 5 HA HIS 5 0.785 -7.794 6.522
17 HB2 HIS 5 HB2 HIS 5 2.311 -7.057 9.010
18 HB3 HIS 5 HB3 HIS 5 0.761 -7.888 9.095
19 HD1 HIS 5 HD1 HIS 5 4.346 -8.437 8.451
20 HD2 HIS 5 HD2 HIS 5 0.790 -10.534 7.985
21 HE1 HIS 5 HE1 HIS 5 5.021 -10.830 8.072
22 H VAL 6 H VAL 6 1.419 -4.346 7.299
23 HA VAL 6 HA VAL 6 -1.331 -4.077 8.419
24 HB VAL 6 HB VAL 6 1.158 -2.301 8.639
25 HG11 VAL 6 HG11 VAL 6 -1.534 -2.047 10.109
26 HG12 VAL 6 HG12 VAL 6 -0.107 -0.999 10.305
27 HG13 VAL 6 HG13 VAL 6 -0.997 -0.992 8.761
28 HG21 VAL 6 HG21 VAL 6 1.424 -4.442 9.917
29 HG22 VAL 6 HG22 VAL 6 1.210 -3.066 11.028
30 HG23 VAL 6 HG23 VAL 6 -0.155 -4.175 10.708
31 HA PRO 7 HA PRO 7 -1.826 -2.264 4.337
32 HB2 PRO 7 HB2 PRO 7 -4.209 -0.904 4.506
33 HB3 PRO 7 HB3 PRO 7 -4.052 -2.693 4.623
34 HG2 PRO 7 HG2 PRO 7 -4.112 -0.750 6.982
35 HG3 PRO 7 HG3 PRO 7 -5.246 -2.119 6.700
36 HD2 PRO 7 HD2 PRO 7 -3.091 -2.476 8.304
37 HD3 PRO 7 HD3 PRO 7 -3.463 -3.764 7.092
38 H GLU 8 H GLU 8 -1.343 -0.293 3.169
39 HA GLU 8 HA GLU 8 -0.143 1.836 4.822
40 HB2 GLU 8 HB2 GLU 8 -0.418 1.454 1.778
41 HB3 GLU 8 HB3 GLU 8 0.376 2.856 2.542
42 HG2 GLU 8 HG2 GLU 8 2.070 1.412 3.597
43 HG3 GLU 8 HG3 GLU 8 1.220 -0.059 3.072
44 H TYR 9 H TYR 9 -3.003 1.402 2.563
45 HA TYR 9 HA TYR 9 -4.212 3.852 3.793
46 HB2 TYR 9 HB2 TYR 9 -4.753 4.603 1.377
47 HB3 TYR 9 HB3 TYR 9 -3.031 4.668 1.795
48 HD1 TYR 9 HD1 TYR 9 -5.630 2.459 0.144
49 HD2 TYR 9 HD2 TYR 9 -1.451 3.447 0.452
50 HE1 TYR 9 HE1 TYR 9 -5.102 0.808 -1.619
51 HE2 TYR 9 HE2 TYR 9 -0.940 1.875 -1.363
52 HH TYR 9 HH TYR 9 -1.793 0.143 -2.777
53 H PHE 10 H PHE 10 -6.611 4.040 2.847
54 HA PHE 10 HA PHE 10 -7.649 1.260 2.431
55 HB2 PHE 10 HB2 PHE 10 -8.778 3.435 4.274
56 HB3 PHE 10 HB3 PHE 10 -9.652 1.958 3.808
57 HD1 PHE 10 HD1 PHE 10 -6.689 3.248 5.697
58 HD2 PHE 10 HD2 PHE 10 -8.891 -0.277 4.583
59 HE1 PHE 10 HE1 PHE 10 -5.707 2.024 7.616
60 HE2 PHE 10 HE2 PHE 10 -7.921 -1.493 6.510
61 HZ PHE 10 HZ PHE 10 -6.425 -0.303 8.103
62 H VAL 11 H VAL 11 -9.357 1.110 0.977
63 HA VAL 11 HA VAL 11 -10.057 3.557 -0.492
64 HB VAL 11 HB VAL 11 -10.527 0.703 -1.359
65 HG11 VAL 11 HG11 VAL 11 -10.879 3.381 -2.636
66 HG12 VAL 11 HG12 VAL 11 -10.527 1.968 -3.633
67 HG13 VAL 11 HG13 VAL 11 -11.969 1.995 -2.618
68 HG21 VAL 11 HG21 VAL 11 -8.348 0.554 -1.771
69 HG22 VAL 11 HG22 VAL 11 -8.532 1.857 -2.946
70 HG23 VAL 11 HG23 VAL 11 -8.088 2.228 -1.280
71 H ARG 12 H ARG 12 -12.313 3.642 -1.350
72 HA ARG 12 HA ARG 12 -14.162 3.283 0.816
73 HB2 ARG 12 HB2 ARG 12 -14.473 4.350 -1.990
74 HB3 ARG 12 HB3 ARG 12 -15.808 4.251 -0.849
75 HG2 ARG 12 HG2 ARG 12 -14.639 5.744 0.674
76 HG3 ARG 12 HG3 ARG 12 -13.270 5.819 -0.437
77 HD2 ARG 12 HD2 ARG 12 -14.341 7.697 -1.119
78 HD3 ARG 12 HD3 ARG 12 -15.211 6.536 -2.121
79 HE ARG 12 HE ARG 12 -17.100 7.024 -0.943
80 HH11 ARG 12 HH11 ARG 12 -14.336 7.977 0.947
81 HH12 ARG 12 HH12 ARG 12 -15.282 8.714 2.198
82 HH21 ARG 12 HH21 ARG 12 -18.356 7.991 0.697
83 HH22 ARG 12 HH22 ARG 12 -17.569 8.721 2.055
84 H GLY 13 H GLY 13 -12.998 0.886 -0.535
85 HA2 GLY 13 HA3 GLY 13 -15.438 -0.335 -1.635
86 HA3 GLY 13 HA2 GLY 13 -13.806 -0.951 -1.845
87 H ASP 14 H ASP 14 -13.318 -2.684 -0.690
88 HA ASP 14 HA ASP 14 -14.820 -3.168 1.800
89 HB2 ASP 14 HB2 ASP 14 -15.408 -4.811 0.118
90 HB3 ASP 14 HB3 ASP 14 -13.708 -5.158 -0.188
91 H PHE 15 H PHE 15 -11.916 -4.674 0.420
92 HA PHE 15 HA PHE 15 -10.506 -4.024 2.923
93 HB2 PHE 15 HB2 PHE 15 -10.362 -6.419 1.110
94 HB3 PHE 15 HB3 PHE 15 -9.035 -6.027 2.199
95 HD1 PHE 15 HD2 PHE 15 -10.011 -5.377 4.680
96 HD2 PHE 15 HD1 PHE 15 -11.764 -8.050 1.870
97 HE1 PHE 15 HE2 PHE 15 -11.175 -6.534 6.513
98 HE2 PHE 15 HE1 PHE 15 -12.931 -9.212 3.698
99 HZ PHE 15 HZ PHE 15 -12.636 -8.455 6.023
100 HA PRO 16 HA PRO 16 -7.647 -1.734 0.448
101 HB2 PRO 16 HB2 PRO 16 -5.364 -1.697 2.012
102 HB3 PRO 16 HB3 PRO 16 -6.919 -1.039 2.606
103 HG2 PRO 16 HG2 PRO 16 -5.847 -3.848 3.124
104 HG3 PRO 16 HG3 PRO 16 -6.360 -2.636 4.359
105 HD2 PRO 16 HD2 PRO 16 -8.070 -4.531 3.583
106 HD3 PRO 16 HD3 PRO 16 -8.664 -2.837 3.783
107 H ILE 17 H ILE 17 -5.174 -1.892 -0.455
108 HA ILE 17 HA ILE 17 -5.163 -4.584 -1.783
109 HB ILE 17 HB ILE 17 -4.224 -1.857 -2.781
110 HG12 ILE 17 HG12 ILE 17 -6.663 -3.557 -3.577
111 HG13 ILE 17 HG13 ILE 17 -6.720 -2.107 -2.546
112 HG21 ILE 17 HG21 ILE 17 -3.812 -3.008 -4.948
113 HG22 ILE 17 HG22 ILE 17 -2.843 -3.777 -3.685
114 HG23 ILE 17 HG23 ILE 17 -4.344 -4.564 -4.247
115 HD11 ILE 17 HD11 ILE 17 -5.762 -0.725 -4.446
116 HD12 ILE 17 HD12 ILE 17 -5.927 -2.151 -5.519
117 HD13 ILE 17 HD13 ILE 17 -7.371 -1.429 -4.775
118 H SER 18 H SER 18 -2.684 -1.944 -0.957
119 HA SER 18 HA SER 18 -0.640 -4.143 -0.983
120 HB2 SER 18 HB2 SER 18 0.942 -2.216 -1.199
121 HB3 SER 18 HB3 SER 18 -0.297 -2.213 -2.480
122 HG SER 18 HG SER 18 -0.454 -0.562 -0.134
123 H PHE 19 H PHE 19 1.264 -3.665 0.710
124 HA PHE 19 HA PHE 19 0.062 -2.768 3.276
125 HB2 PHE 19 HB2 PHE 19 1.565 -5.401 2.964
126 HB3 PHE 19 HB3 PHE 19 0.591 -4.900 4.371
127 HD1 PHE 19 HD2 PHE 19 -1.962 -4.742 4.085
128 HD2 PHE 19 HD1 PHE 19 0.568 -6.476 1.059
129 HE1 PHE 19 HE2 PHE 19 -3.947 -5.737 2.982
130 HE2 PHE 19 HE1 PHE 19 -1.402 -7.538 0.018
131 HZ PHE 19 HZ PHE 19 -3.670 -7.156 0.961
132 H TYR 20 H TYR 20 1.927 -3.038 5.096
133 HA TYR 20 HA TYR 20 3.429 -0.764 4.250
134 HB2 TYR 20 HB2 TYR 20 2.668 -1.627 6.748
135 HB3 TYR 20 HB3 TYR 20 4.328 -2.231 6.763
136 HD1 TYR 20 HD2 TYR 20 2.129 0.736 6.053
137 HD2 TYR 20 HD1 TYR 20 6.037 -0.518 7.345
138 HE1 TYR 20 HE2 TYR 20 2.716 3.080 6.518
139 HE2 TYR 20 HE1 TYR 20 6.616 1.835 7.843
140 HH TYR 20 HH TYR 20 4.388 4.578 7.338
141 H GLY 21 H GLY 21 5.982 -0.598 4.697
142 HA2 GLY 21 HA3 GLY 21 7.571 -2.907 4.621
143 HA3 GLY 21 HA2 GLY 21 7.258 -2.478 2.914
Start of MODEL 9
1 H1 GLY 1 H GLY 1 1.363 -0.552 0.748
2 HA2 GLY 1 HA3 GLY 1 2.200 0.211 -1.417
3 HA3 GLY 1 HA2 GLY 1 3.599 0.958 -0.625
4 H GLY 2 H GLY 2 4.494 -0.983 1.204
5 HA2 GLY 2 HA3 GLY 2 5.817 -2.802 -0.639
6 HA3 GLY 2 HA2 GLY 2 5.965 -2.788 1.133
7 H ALA 3 H ALA 3 5.934 -5.239 0.814
8 HA ALA 3 HA ALA 3 3.093 -6.247 0.554
9 HB1 ALA 3 HB1 ALA 3 4.104 -8.390 -0.127
10 HB2 ALA 3 HB2 ALA 3 4.681 -7.082 -1.203
11 HB3 ALA 3 HB3 ALA 3 5.748 -7.714 0.087
12 H GLY 4 H GLY 4 3.981 -4.958 2.990
13 HA2 GLY 4 HA3 GLY 4 4.881 -7.093 4.789
14 HA3 GLY 4 HA2 GLY 4 4.451 -5.432 5.212
15 H HIS 5 H HIS 5 3.034 -5.983 6.911
16 HA HIS 5 HA HIS 5 0.859 -7.886 6.365
17 HB2 HIS 5 HB2 HIS 5 2.387 -7.215 8.872
18 HB3 HIS 5 HB3 HIS 5 0.844 -8.062 8.933
19 HD1 HIS 5 HD1 HIS 5 4.204 -8.485 7.190
20 HD2 HIS 5 HD2 HIS 5 1.121 -10.746 8.816
21 HE1 HIS 5 HE1 HIS 5 4.956 -10.877 7.006
22 H VAL 6 H VAL 6 1.472 -4.462 7.277
23 HA VAL 6 HA VAL 6 -1.289 -4.244 8.379
24 HB VAL 6 HB VAL 6 1.194 -2.473 8.681
25 HG11 VAL 6 HG11 VAL 6 -0.073 -1.226 10.377
26 HG12 VAL 6 HG12 VAL 6 -0.962 -1.168 8.834
27 HG13 VAL 6 HG13 VAL 6 -1.501 -2.265 10.148
28 HG21 VAL 6 HG21 VAL 6 1.229 -3.321 11.041
29 HG22 VAL 6 HG22 VAL 6 -0.132 -4.418 10.674
30 HG23 VAL 6 HG23 VAL 6 1.452 -4.658 9.886
31 HA PRO 7 HA PRO 7 -1.808 -2.309 4.362
32 HB2 PRO 7 HB2 PRO 7 -4.156 -0.908 4.597
33 HB3 PRO 7 HB3 PRO 7 -4.028 -2.702 4.660
34 HG2 PRO 7 HG2 PRO 7 -4.023 -0.827 7.077
35 HG3 PRO 7 HG3 PRO 7 -5.194 -2.158 6.769
36 HD2 PRO 7 HD2 PRO 7 -3.036 -2.622 8.332
37 HD3 PRO 7 HD3 PRO 7 -3.433 -3.854 7.073
38 H GLU 8 H GLU 8 -1.329 -0.318 3.220
39 HA GLU 8 HA GLU 8 -0.101 1.780 4.902
40 HB2 GLU 8 HB2 GLU 8 -0.323 1.412 1.849
41 HB3 GLU 8 HB3 GLU 8 0.468 2.802 2.638
42 HG2 GLU 8 HG2 GLU 8 2.100 1.335 3.763
43 HG3 GLU 8 HG3 GLU 8 1.272 -0.119 3.164
44 H TYR 9 H TYR 9 -2.974 1.388 2.660
45 HA TYR 9 HA TYR 9 -4.163 3.797 3.970
46 HB2 TYR 9 HB2 TYR 9 -4.710 4.662 1.592
47 HB3 TYR 9 HB3 TYR 9 -2.988 4.717 2.018
48 HD1 TYR 9 HD2 TYR 9 -5.574 2.587 0.252
49 HD2 TYR 9 HD1 TYR 9 -1.394 3.546 0.642
50 HE1 TYR 9 HE2 TYR 9 -5.035 1.026 -1.588
51 HE2 TYR 9 HE1 TYR 9 -0.874 2.074 -1.255
52 HH TYR 9 HH TYR 9 -1.743 0.548 -2.879
53 H PHE 10 H PHE 10 -6.567 4.040 3.054
54 HA PHE 10 HA PHE 10 -7.624 1.272 2.584
55 HB2 PHE 10 HB2 PHE 10 -8.728 3.428 4.465
56 HB3 PHE 10 HB3 PHE 10 -9.596 1.945 4.006
57 HD1 PHE 10 HD1 PHE 10 -6.612 3.257 5.848
58 HD2 PHE 10 HD2 PHE 10 -8.802 -0.285 4.766
59 HE1 PHE 10 HE1 PHE 10 -5.585 2.038 7.746
60 HE2 PHE 10 HE2 PHE 10 -7.797 -1.492 6.679
61 HZ PHE 10 HZ PHE 10 -6.274 -0.296 8.242
62 H VAL 11 H VAL 11 -9.352 1.158 1.141
63 HA VAL 11 HA VAL 11 -10.078 3.644 -0.247
64 HB VAL 11 HB VAL 11 -10.536 0.816 -1.198
65 HG11 VAL 11 HG11 VAL 11 -11.995 2.139 -2.406
66 HG12 VAL 11 HG12 VAL 11 -10.910 3.530 -2.394
67 HG13 VAL 11 HG13 VAL 11 -10.561 2.147 -3.432
68 HG21 VAL 11 HG21 VAL 11 -8.271 0.812 -1.320
69 HG22 VAL 11 HG22 VAL 11 -8.594 1.694 -2.812
70 HG23 VAL 11 HG23 VAL 11 -8.158 2.572 -1.346
71 H ARG 12 H ARG 12 -12.341 3.742 -1.087
72 HA ARG 12 HA ARG 12 -14.172 3.304 1.079
73 HB2 ARG 12 HB2 ARG 12 -14.533 4.438 -1.696
74 HB3 ARG 12 HB3 ARG 12 -15.834 4.326 -0.519
75 HG2 ARG 12 HG2 ARG 12 -14.653 5.802 0.985
76 HG3 ARG 12 HG3 ARG 12 -13.271 5.852 -0.112
77 HD2 ARG 12 HD2 ARG 12 -14.247 7.714 -0.900
78 HD3 ARG 12 HD3 ARG 12 -15.287 6.589 -1.772
79 HE ARG 12 HE ARG 12 -16.303 7.146 0.826
80 HH11 ARG 12 HH11 ARG 12 -16.021 8.449 -2.390
81 HH12 ARG 12 HH12 ARG 12 -17.439 9.436 -2.255
82 HH21 ARG 12 HH21 ARG 12 -18.171 8.440 1.016
83 HH22 ARG 12 HH22 ARG 12 -18.661 9.431 -0.317
84 H GLY 13 H GLY 13 -13.003 0.955 -0.346
85 HA2 GLY 13 HA3 GLY 13 -15.441 -0.246 -1.473
86 HA3 GLY 13 HA2 GLY 13 -13.806 -0.848 -1.705
87 H ASP 14 H ASP 14 -13.300 -2.607 -0.599
88 HA ASP 14 HA ASP 14 -14.794 -3.173 1.878
89 HB2 ASP 14 HB2 ASP 14 -15.383 -4.776 0.168
90 HB3 ASP 14 HB3 ASP 14 -13.685 -5.088 -0.182
91 H PHE 15 H PHE 15 -11.879 -4.608 0.444
92 HA PHE 15 HA PHE 15 -10.467 -4.016 2.960
93 HB2 PHE 15 HB2 PHE 15 -10.321 -6.372 1.098
94 HB3 PHE 15 HB3 PHE 15 -8.992 -5.999 2.190
95 HD1 PHE 15 HD2 PHE 15 -10.091 -5.306 4.669
96 HD2 PHE 15 HD1 PHE 15 -11.584 -8.122 1.848
97 HE1 PHE 15 HE2 PHE 15 -11.243 -6.505 6.482
98 HE2 PHE 15 HE1 PHE 15 -12.740 -9.325 3.657
99 HZ PHE 15 HZ PHE 15 -12.569 -8.518 5.977
100 HA PRO 16 HA PRO 16 -7.581 -1.720 0.487
101 HB2 PRO 16 HB2 PRO 16 -5.304 -1.719 2.054
102 HB3 PRO 16 HB3 PRO 16 -6.848 -1.029 2.645
103 HG2 PRO 16 HG2 PRO 16 -5.824 -3.853 3.181
104 HG3 PRO 16 HG3 PRO 16 -6.328 -2.631 4.408
105 HD2 PRO 16 HD2 PRO 16 -8.062 -4.508 3.621
106 HD3 PRO 16 HD3 PRO 16 -8.629 -2.807 3.824
107 H ILE 17 H ILE 17 -5.165 -1.929 -0.472
108 HA ILE 17 HA ILE 17 -5.117 -4.686 -1.664
109 HB ILE 17 HB ILE 17 -4.114 -2.047 -2.836
110 HG12 ILE 17 HG12 ILE 17 -6.531 -1.846 -2.606
111 HG13 ILE 17 HG13 ILE 17 -6.078 -2.061 -4.307
112 HG21 ILE 17 HG21 ILE 17 -4.043 -3.354 -4.983
113 HG22 ILE 17 HG22 ILE 17 -2.911 -3.975 -3.758
114 HG23 ILE 17 HG23 ILE 17 -4.429 -4.847 -4.079
115 HD11 ILE 17 HD11 ILE 17 -8.116 -3.346 -3.797
116 HD12 ILE 17 HD12 ILE 17 -6.808 -4.494 -4.173
117 HD13 ILE 17 HD13 ILE 17 -7.315 -4.225 -2.476
118 H SER 18 H SER 18 -2.739 -1.974 -0.868
119 HA SER 18 HA SER 18 -0.621 -4.081 -0.992
120 HB2 SER 18 HB2 SER 18 0.926 -2.295 -1.342
121 HB3 SER 18 HB3 SER 18 -0.494 -1.838 -2.311
122 HG SER 18 HG SER 18 -1.037 -0.420 -0.412
123 H PHE 19 H PHE 19 1.311 -3.527 0.727
124 HA PHE 19 HA PHE 19 0.085 -2.813 3.336
125 HB2 PHE 19 HB2 PHE 19 1.634 -5.401 2.859
126 HB3 PHE 19 HB3 PHE 19 0.724 -4.975 4.334
127 HD1 PHE 19 HD1 PHE 19 -1.831 -4.820 4.191
128 HD2 PHE 19 HD2 PHE 19 0.548 -6.419 0.972
129 HE1 PHE 19 HE1 PHE 19 -3.869 -5.769 3.144
130 HE2 PHE 19 HE2 PHE 19 -1.469 -7.453 -0.006
131 HZ PHE 19 HZ PHE 19 -3.692 -7.098 1.051
132 H TYR 20 H TYR 20 1.989 -3.135 5.129
133 HA TYR 20 HA TYR 20 3.491 -0.803 4.375
134 HB2 TYR 20 HB2 TYR 20 2.654 -1.729 6.821
135 HB3 TYR 20 HB3 TYR 20 4.305 -2.360 6.859
136 HD1 TYR 20 HD1 TYR 20 2.167 0.662 6.149
137 HD2 TYR 20 HD2 TYR 20 5.961 -0.690 7.655
138 HE1 TYR 20 HE1 TYR 20 2.792 2.996 6.669
139 HE2 TYR 20 HE2 TYR 20 6.562 1.628 8.226
140 HH TYR 20 HH TYR 20 5.893 3.922 8.178
141 H GLY 21 H GLY 21 6.070 -0.818 5.048
142 HA2 GLY 21 HA3 GLY 21 8.122 -2.104 4.928
143 HA3 GLY 21 HA2 GLY 21 7.321 -3.290 3.876
Start of MODEL 10
1 H1 GLY 1 H GLY 1 1.251 -0.510 0.674
2 HA2 GLY 1 HA3 GLY 1 2.083 0.283 -1.470
3 HA3 GLY 1 HA2 GLY 1 3.496 1.008 -0.677
4 H GLY 2 H GLY 2 4.384 -0.961 1.113
5 HA2 GLY 2 HA3 GLY 2 5.658 -2.779 -0.780
6 HA3 GLY 2 HA2 GLY 2 5.877 -2.737 0.982
7 H ALA 3 H ALA 3 5.799 -5.170 0.870
8 HA ALA 3 HA ALA 3 2.954 -6.182 0.645
9 HB1 ALA 3 HB1 ALA 3 4.481 -7.040 -1.151
10 HB2 ALA 3 HB2 ALA 3 5.588 -7.655 0.113
11 HB3 ALA 3 HB3 ALA 3 3.938 -8.335 -0.042
12 H GLY 4 H GLY 4 3.896 -4.865 3.034
13 HA2 GLY 4 HA3 GLY 4 4.842 -6.972 4.844
14 HA3 GLY 4 HA2 GLY 4 4.403 -5.309 5.253
15 H HIS 5 H HIS 5 2.991 -5.832 6.968
16 HA HIS 5 HA HIS 5 0.826 -7.758 6.466
17 HB2 HIS 5 HB2 HIS 5 2.349 -7.020 8.956
18 HB3 HIS 5 HB3 HIS 5 0.809 -7.871 9.039
19 HD1 HIS 5 HD1 HIS 5 3.855 -8.884 9.728
20 HD2 HIS 5 HD2 HIS 5 1.412 -9.994 6.556
21 HE1 HIS 5 HE1 HIS 5 4.696 -11.136 8.987
22 H VAL 6 H VAL 6 1.420 -4.310 7.292
23 HA VAL 6 HA VAL 6 -1.337 -4.085 8.395
24 HB VAL 6 HB VAL 6 1.116 -2.264 8.614
25 HG11 VAL 6 HG11 VAL 6 -0.168 -0.977 10.272
26 HG12 VAL 6 HG12 VAL 6 -1.061 -0.992 8.730
27 HG13 VAL 6 HG13 VAL 6 -1.577 -2.050 10.083
28 HG21 VAL 6 HG21 VAL 6 -0.164 -4.154 10.687
29 HG22 VAL 6 HG22 VAL 6 1.419 -4.397 9.898
30 HG23 VAL 6 HG23 VAL 6 1.181 -3.021 11.004
31 HA PRO 7 HA PRO 7 -1.871 -2.278 4.303
32 HB2 PRO 7 HB2 PRO 7 -4.265 -0.947 4.490
33 HB3 PRO 7 HB3 PRO 7 -4.088 -2.735 4.604
34 HG2 PRO 7 HG2 PRO 7 -4.156 -0.787 6.964
35 HG3 PRO 7 HG3 PRO 7 -5.283 -2.163 6.690
36 HD2 PRO 7 HD2 PRO 7 -3.120 -2.509 8.282
37 HD3 PRO 7 HD3 PRO 7 -3.480 -3.797 7.069
38 H GLU 8 H GLU 8 -1.422 -0.297 3.136
39 HA GLU 8 HA GLU 8 -0.256 1.841 4.810
40 HB2 GLU 8 HB2 GLU 8 -0.433 1.441 1.753
41 HB3 GLU 8 HB3 GLU 8 0.345 2.833 2.549
42 HG2 GLU 8 HG2 GLU 8 1.964 1.364 3.702
43 HG3 GLU 8 HG3 GLU 8 1.141 -0.092 3.094
44 H TYR 9 H TYR 9 -3.091 1.371 2.544
45 HA TYR 9 HA TYR 9 -4.318 3.795 3.794
46 HB2 TYR 9 HB2 TYR 9 -4.905 4.576 1.406
47 HB3 TYR 9 HB3 TYR 9 -3.175 4.651 1.789
48 HD1 TYR 9 HD1 TYR 9 -5.798 2.456 0.153
49 HD2 TYR 9 HD2 TYR 9 -1.610 3.422 0.426
50 HE1 TYR 9 HE1 TYR 9 -5.303 0.863 -1.671
51 HE2 TYR 9 HE2 TYR 9 -1.140 1.938 -1.473
52 HH TYR 9 HH TYR 9 -2.032 0.332 -3.003
53 H PHE 10 H PHE 10 -6.736 3.963 2.904
54 HA PHE 10 HA PHE 10 -7.745 1.171 2.491
55 HB2 PHE 10 HB2 PHE 10 -8.881 3.341 4.335
56 HB3 PHE 10 HB3 PHE 10 -9.741 1.851 3.886
57 HD1 PHE 10 HD1 PHE 10 -6.779 3.192 5.741
58 HD2 PHE 10 HD2 PHE 10 -8.938 -0.370 4.665
59 HE1 PHE 10 HE1 PHE 10 -5.759 1.991 7.654
60 HE2 PHE 10 HE2 PHE 10 -7.934 -1.562 6.588
61 HZ PHE 10 HZ PHE 10 -6.433 -0.346 8.155
62 H VAL 11 H VAL 11 -9.464 1.003 1.048
63 HA VAL 11 HA VAL 11 -10.212 3.446 -0.405
64 HB VAL 11 HB VAL 11 -10.633 0.590 -1.286
65 HG11 VAL 11 HG11 VAL 11 -11.040 3.268 -2.548
66 HG12 VAL 11 HG12 VAL 11 -10.668 1.866 -3.553
67 HG13 VAL 11 HG13 VAL 11 -12.105 1.863 -2.530
68 HG21 VAL 11 HG21 VAL 11 -8.341 2.475 -1.747
69 HG22 VAL 11 HG22 VAL 11 -8.298 0.805 -1.181
70 HG23 VAL 11 HG23 VAL 11 -8.702 1.156 -2.861
71 H ARG 12 H ARG 12 -12.471 3.502 -1.252
72 HA ARG 12 HA ARG 12 -14.306 3.091 0.918
73 HB2 ARG 12 HB2 ARG 12 -14.686 4.154 -1.884
74 HB3 ARG 12 HB3 ARG 12 -15.971 4.077 -0.687
75 HG2 ARG 12 HG2 ARG 12 -14.769 5.596 0.757
76 HG3 ARG 12 HG3 ARG 12 -13.404 5.615 -0.361
77 HD2 ARG 12 HD2 ARG 12 -14.383 7.121 -1.690
78 HD3 ARG 12 HD3 ARG 12 -15.927 6.271 -1.650
79 HE ARG 12 HE ARG 12 -16.637 7.741 -0.057
80 HH11 ARG 12 HH11 ARG 12 -13.160 7.831 -0.190
81 HH12 ARG 12 HH12 ARG 12 -13.021 9.156 0.917
82 HH21 ARG 12 HH21 ARG 12 -16.468 9.487 1.402
83 HH22 ARG 12 HH22 ARG 12 -14.904 10.097 1.823
84 H GLY 13 H GLY 13 -13.108 0.728 -0.465
85 HA2 GLY 13 HA3 GLY 13 -15.533 -0.520 -1.571
86 HA3 GLY 13 HA2 GLY 13 -13.891 -1.107 -1.793
87 H ASP 14 H ASP 14 -13.366 -2.842 -0.656
88 HA ASP 14 HA ASP 14 -14.855 -3.381 1.830
89 HB2 ASP 14 HB2 ASP 14 -15.421 -5.019 0.143
90 HB3 ASP 14 HB3 ASP 14 -13.718 -5.322 -0.191
91 H PHE 15 H PHE 15 -11.921 -4.804 0.421
92 HA PHE 15 HA PHE 15 -10.520 -4.159 2.931
93 HB2 PHE 15 HB2 PHE 15 -10.336 -6.533 1.094
94 HB3 PHE 15 HB3 PHE 15 -9.015 -6.128 2.185
95 HD1 PHE 15 HD1 PHE 15 -10.188 -5.385 4.642
96 HD2 PHE 15 HD2 PHE 15 -11.513 -8.333 1.873
97 HE1 PHE 15 HE1 PHE 15 -11.326 -6.581 6.466
98 HE2 PHE 15 HE2 PHE 15 -12.654 -9.534 3.693
99 HZ PHE 15 HZ PHE 15 -12.562 -8.658 5.993
100 HA PRO 16 HA PRO 16 -7.698 -1.796 0.487
101 HB2 PRO 16 HB2 PRO 16 -5.400 -1.789 2.035
102 HB3 PRO 16 HB3 PRO 16 -6.946 -1.121 2.642
103 HG2 PRO 16 HG2 PRO 16 -5.893 -3.944 3.139
104 HG3 PRO 16 HG3 PRO 16 -6.399 -2.740 4.384
105 HD2 PRO 16 HD2 PRO 16 -8.121 -4.614 3.609
106 HD3 PRO 16 HD3 PRO 16 -8.704 -2.915 3.794
107 H ILE 17 H ILE 17 -5.282 -1.922 -0.474
108 HA ILE 17 HA ILE 17 -5.253 -4.597 -1.830
109 HB ILE 17 HB ILE 17 -4.259 -1.875 -2.772
110 HG12 ILE 17 HG12 ILE 17 -6.742 -3.493 -3.606
111 HG13 ILE 17 HG13 ILE 17 -6.761 -2.055 -2.556
112 HG21 ILE 17 HG21 ILE 17 -3.869 -3.003 -4.963
113 HG22 ILE 17 HG22 ILE 17 -2.931 -3.822 -3.710
114 HG23 ILE 17 HG23 ILE 17 -4.450 -4.555 -4.295
115 HD11 ILE 17 HD11 ILE 17 -5.752 -0.681 -4.432
116 HD12 ILE 17 HD12 ILE 17 -5.961 -2.085 -5.526
117 HD13 ILE 17 HD13 ILE 17 -7.382 -1.325 -4.776
118 H SER 18 H SER 18 -2.824 -1.989 -0.865
119 HA SER 18 HA SER 18 -0.740 -4.137 -1.014
120 HB2 SER 18 HB2 SER 18 0.823 -2.402 -1.398
121 HB3 SER 18 HB3 SER 18 -0.590 -1.923 -2.366
122 HG SER 18 HG SER 18 -1.096 -0.456 -0.491
123 H PHE 19 H PHE 19 1.212 -3.581 0.669
124 HA PHE 19 HA PHE 19 0.019 -2.869 3.294
125 HB2 PHE 19 HB2 PHE 19 1.565 -5.448 2.757
126 HB3 PHE 19 HB3 PHE 19 0.736 -5.016 4.277
127 HD1 PHE 19 HD2 PHE 19 -1.810 -4.835 4.285
128 HD2 PHE 19 HD1 PHE 19 0.348 -6.445 0.921
129 HE1 PHE 19 HE2 PHE 19 -3.925 -5.710 3.336
130 HE2 PHE 19 HE1 PHE 19 -1.752 -7.389 0.026
131 HZ PHE 19 HZ PHE 19 -3.905 -6.975 1.197
132 H TYR 20 H TYR 20 1.970 -3.148 5.056
133 HA TYR 20 HA TYR 20 3.309 -0.744 4.270
134 HB2 TYR 20 HB2 TYR 20 2.595 -1.661 6.722
135 HB3 TYR 20 HB3 TYR 20 4.253 -2.284 6.730
136 HD1 TYR 20 HD2 TYR 20 2.070 0.719 6.151
137 HD2 TYR 20 HD1 TYR 20 5.988 -0.600 7.340
138 HE1 TYR 20 HE2 TYR 20 2.689 3.046 6.652
139 HE2 TYR 20 HE1 TYR 20 6.604 1.739 7.867
140 HH TYR 20 HH TYR 20 4.400 4.514 7.445
141 H GLY 21 H GLY 21 5.828 -0.418 4.616
142 HA2 GLY 21 HA3 GLY 21 7.403 -2.847 3.977
143 HA3 GLY 21 HA2 GLY 21 7.306 -1.592 2.702
Start of MODEL 11
1 H1 GLY 1 H GLY 1 1.250 -0.615 0.605
2 HA2 GLY 1 HA3 GLY 1 2.242 0.107 -1.493
3 HA3 GLY 1 HA2 GLY 1 3.610 0.818 -0.627
4 H GLY 2 H GLY 2 4.490 -1.115 1.154
5 HA2 GLY 2 HA3 GLY 2 5.778 -2.956 -0.693
6 HA3 GLY 2 HA2 GLY 2 5.960 -2.918 1.075
7 H ALA 3 H ALA 3 5.907 -5.366 0.874
8 HA ALA 3 HA ALA 3 3.062 -6.367 0.642
9 HB1 ALA 3 HB1 ALA 3 4.621 -7.232 -1.130
10 HB2 ALA 3 HB2 ALA 3 5.710 -7.849 0.148
11 HB3 ALA 3 HB3 ALA 3 4.063 -8.527 -0.028
12 H GLY 4 H GLY 4 3.978 -5.049 3.038
13 HA2 GLY 4 HA3 GLY 4 4.909 -7.159 4.858
14 HA3 GLY 4 HA2 GLY 4 4.501 -5.487 5.255
15 H HIS 5 H HIS 5 3.082 -5.957 6.971
16 HA HIS 5 HA HIS 5 0.914 -7.894 6.522
17 HB2 HIS 5 HB2 HIS 5 2.484 -7.139 8.978
18 HB3 HIS 5 HB3 HIS 5 0.948 -7.992 9.096
19 HD1 HIS 5 HD1 HIS 5 4.513 -8.456 8.115
20 HD2 HIS 5 HD2 HIS 5 1.000 -10.671 8.235
21 HE1 HIS 5 HE1 HIS 5 5.214 -10.848 7.782
22 H VAL 6 H VAL 6 1.507 -4.436 7.307
23 HA VAL 6 HA VAL 6 -1.244 -4.210 8.435
24 HB VAL 6 HB VAL 6 1.200 -2.379 8.621
25 HG11 VAL 6 HG11 VAL 6 -0.082 -1.090 10.284
26 HG12 VAL 6 HG12 VAL 6 -0.986 -1.124 8.749
27 HG13 VAL 6 HG13 VAL 6 -1.485 -2.175 10.114
28 HG21 VAL 6 HG21 VAL 6 -0.051 -4.265 10.717
29 HG22 VAL 6 HG22 VAL 6 1.529 -4.497 9.917
30 HG23 VAL 6 HG23 VAL 6 1.287 -3.118 11.019
31 HA PRO 7 HA PRO 7 -1.836 -2.443 4.332
32 HB2 PRO 7 HB2 PRO 7 -4.204 -1.070 4.553
33 HB3 PRO 7 HB3 PRO 7 -4.062 -2.861 4.665
34 HG2 PRO 7 HG2 PRO 7 -4.032 -0.915 7.023
35 HG3 PRO 7 HG3 PRO 7 -5.206 -2.252 6.776
36 HD2 PRO 7 HD2 PRO 7 -3.028 -2.662 8.323
37 HD3 PRO 7 HD3 PRO 7 -3.420 -3.935 7.103
38 H GLU 8 H GLU 8 -1.388 -0.453 3.155
39 HA GLU 8 HA GLU 8 -0.153 1.657 4.822
40 HB2 GLU 8 HB2 GLU 8 -0.347 1.263 1.771
41 HB3 GLU 8 HB3 GLU 8 0.477 2.631 2.565
42 HG2 GLU 8 HG2 GLU 8 2.026 1.101 3.738
43 HG3 GLU 8 HG3 GLU 8 1.182 -0.321 3.085
44 H TYR 9 H TYR 9 -3.028 1.248 2.591
45 HA TYR 9 HA TYR 9 -4.178 3.700 3.844
46 HB2 TYR 9 HB2 TYR 9 -4.729 4.500 1.425
47 HB3 TYR 9 HB3 TYR 9 -3.025 4.609 1.901
48 HD1 TYR 9 HD2 TYR 9 -5.490 2.349 0.121
49 HD2 TYR 9 HD1 TYR 9 -1.357 3.451 0.615
50 HE1 TYR 9 HE2 TYR 9 -4.864 0.816 -1.704
51 HE2 TYR 9 HE1 TYR 9 -0.747 1.997 -1.275
52 HH TYR 9 HH TYR 9 -3.103 0.212 -3.240
53 H PHE 10 H PHE 10 -6.564 3.973 2.926
54 HA PHE 10 HA PHE 10 -7.714 1.216 2.598
55 HB2 PHE 10 HB2 PHE 10 -8.734 3.482 4.406
56 HB3 PHE 10 HB3 PHE 10 -9.538 1.920 4.132
57 HD1 PHE 10 HD1 PHE 10 -6.494 3.574 5.578
58 HD2 PHE 10 HD2 PHE 10 -8.610 -0.150 5.156
59 HE1 PHE 10 HE1 PHE 10 -5.217 2.630 7.475
60 HE2 PHE 10 HE2 PHE 10 -7.413 -1.051 7.124
61 HZ PHE 10 HZ PHE 10 -5.754 0.358 8.326
62 H VAL 11 H VAL 11 -9.331 1.172 0.980
63 HA VAL 11 HA VAL 11 -10.137 3.753 -0.170
64 HB VAL 11 HB VAL 11 -10.562 1.009 -1.354
65 HG11 VAL 11 HG11 VAL 11 -10.662 2.533 -3.462
66 HG12 VAL 11 HG12 VAL 11 -12.074 2.399 -2.412
67 HG13 VAL 11 HG13 VAL 11 -11.019 3.808 -2.297
68 HG21 VAL 11 HG21 VAL 11 -8.674 1.668 -2.880
69 HG22 VAL 11 HG22 VAL 11 -8.320 2.981 -1.756
70 HG23 VAL 11 HG23 VAL 11 -8.206 1.305 -1.218
71 H ARG 12 H ARG 12 -12.420 3.875 -0.950
72 HA ARG 12 HA ARG 12 -14.192 3.225 1.209
73 HB2 ARG 12 HB2 ARG 12 -14.634 4.563 -1.461
74 HB3 ARG 12 HB3 ARG 12 -15.913 4.321 -0.279
75 HG2 ARG 12 HG2 ARG 12 -14.737 5.699 1.325
76 HG3 ARG 12 HG3 ARG 12 -13.386 5.884 0.205
77 HD2 ARG 12 HD2 ARG 12 -14.784 7.855 0.136
78 HD3 ARG 12 HD3 ARG 12 -14.895 6.989 -1.396
79 HE ARG 12 HE ARG 12 -16.985 6.045 0.094
80 HH11 ARG 12 HH11 ARG 12 -15.919 9.182 -0.975
81 HH12 ARG 12 HH12 ARG 12 -17.519 9.845 -1.048
82 HH21 ARG 12 HH21 ARG 12 -19.095 6.906 0.003
83 HH22 ARG 12 HH22 ARG 12 -19.324 8.550 -0.490
84 H GLY 13 H GLY 13 -13.035 0.975 -0.277
85 HA2 GLY 13 HA3 GLY 13 -15.434 -0.172 -1.539
86 HA3 GLY 13 HA2 GLY 13 -13.791 -0.757 -1.757
87 H ASP 14 H ASP 14 -13.303 -2.565 -0.721
88 HA ASP 14 HA ASP 14 -14.867 -3.259 1.679
89 HB2 ASP 14 HB2 ASP 14 -15.368 -4.764 -0.168
90 HB3 ASP 14 HB3 ASP 14 -13.652 -5.091 -0.399
91 H PHE 15 H PHE 15 -11.890 -4.581 0.258
92 HA PHE 15 HA PHE 15 -10.542 -4.049 2.824
93 HB2 PHE 15 HB2 PHE 15 -10.409 -6.431 0.993
94 HB3 PHE 15 HB3 PHE 15 -9.094 -6.072 2.107
95 HD1 PHE 15 HD2 PHE 15 -10.297 -5.275 4.539
96 HD2 PHE 15 HD1 PHE 15 -11.653 -8.194 1.754
97 HE1 PHE 15 HE2 PHE 15 -11.511 -6.426 6.343
98 HE2 PHE 15 HE1 PHE 15 -12.870 -9.350 3.553
99 HZ PHE 15 HZ PHE 15 -12.799 -8.467 5.851
100 HA PRO 16 HA PRO 16 -7.578 -1.816 0.416
101 HB2 PRO 16 HB2 PRO 16 -5.317 -1.860 2.011
102 HB3 PRO 16 HB3 PRO 16 -6.856 -1.141 2.577
103 HG2 PRO 16 HG2 PRO 16 -5.901 -3.994 3.116
104 HG3 PRO 16 HG3 PRO 16 -6.379 -2.767 4.345
105 HD2 PRO 16 HD2 PRO 16 -8.172 -4.587 3.541
106 HD3 PRO 16 HD3 PRO 16 -8.687 -2.866 3.718
107 H ILE 17 H ILE 17 -5.134 -2.051 -0.484
108 HA ILE 17 HA ILE 17 -5.169 -4.755 -1.789
109 HB ILE 17 HB ILE 17 -4.102 -2.072 -2.776
110 HG12 ILE 17 HG12 ILE 17 -6.599 -3.671 -3.619
111 HG13 ILE 17 HG13 ILE 17 -6.610 -2.214 -2.596
112 HG21 ILE 17 HG21 ILE 17 -4.311 -4.776 -4.240
113 HG22 ILE 17 HG22 ILE 17 -3.700 -3.246 -4.934
114 HG23 ILE 17 HG23 ILE 17 -2.790 -4.050 -3.650
115 HD11 ILE 17 HD11 ILE 17 -7.189 -1.523 -4.848
116 HD12 ILE 17 HD12 ILE 17 -5.558 -0.890 -4.490
117 HD13 ILE 17 HD13 ILE 17 -5.766 -2.317 -5.555
118 H SER 18 H SER 18 -2.675 -2.179 -0.842
119 HA SER 18 HA SER 18 -0.658 -4.414 -0.864
120 HB2 SER 18 HB2 SER 18 0.926 -2.520 -1.264
121 HB3 SER 18 HB3 SER 18 -0.381 -2.574 -2.487
122 HG SER 18 HG SER 18 -0.173 -0.395 -1.603
123 H PHE 19 H PHE 19 1.303 -3.798 0.755
124 HA PHE 19 HA PHE 19 0.102 -2.931 3.338
125 HB2 PHE 19 HB2 PHE 19 1.627 -5.544 2.906
126 HB3 PHE 19 HB3 PHE 19 0.752 -5.068 4.385
127 HD1 PHE 19 HD1 PHE 19 -1.792 -4.936 4.318
128 HD2 PHE 19 HD2 PHE 19 0.486 -6.542 1.032
129 HE1 PHE 19 HE1 PHE 19 -3.867 -5.844 3.312
130 HE2 PHE 19 HE2 PHE 19 -1.569 -7.534 0.091
131 HZ PHE 19 HZ PHE 19 -3.761 -7.147 1.199
132 H TYR 20 H TYR 20 2.037 -3.217 5.119
133 HA TYR 20 HA TYR 20 3.478 -0.890 4.312
134 HB2 TYR 20 HB2 TYR 20 2.779 -1.843 6.801
135 HB3 TYR 20 HB3 TYR 20 4.462 -2.384 6.764
136 HD1 TYR 20 HD1 TYR 20 2.127 0.510 6.175
137 HD2 TYR 20 HD2 TYR 20 6.092 -0.622 7.399
138 HE1 TYR 20 HE1 TYR 20 2.648 2.871 6.633
139 HE2 TYR 20 HE2 TYR 20 6.609 1.748 7.885
140 HH TYR 20 HH TYR 20 4.301 4.424 7.388
141 H GLY 21 H GLY 21 6.041 -0.725 4.747
142 HA2 GLY 21 HA3 GLY 21 7.426 -3.220 3.884
143 HA3 GLY 21 HA2 GLY 21 7.490 -1.801 2.796
Start of MODEL 12
1 H1 GLY 1 H GLY 1 1.168 -0.554 0.610
2 HA2 GLY 1 HA3 GLY 1 2.111 0.173 -1.526
3 HA3 GLY 1 HA2 GLY 1 3.481 0.905 -0.684
4 H GLY 2 H GLY 2 4.385 -1.000 1.121
5 HA2 GLY 2 HA3 GLY 2 5.696 -2.837 -0.722
6 HA3 GLY 2 HA2 GLY 2 5.892 -2.771 1.042
7 H ALA 3 H ALA 3 5.919 -5.219 0.805
8 HA ALA 3 HA ALA 3 3.119 -6.333 0.586
9 HB1 ALA 3 HB1 ALA 3 4.213 -8.461 0.032
10 HB2 ALA 3 HB2 ALA 3 4.775 -7.190 -1.095
11 HB3 ALA 3 HB3 ALA 3 5.833 -7.726 0.244
12 H GLY 4 H GLY 4 3.966 -4.898 2.997
13 HA2 GLY 4 HA3 GLY 4 4.910 -6.932 4.879
14 HA3 GLY 4 HA2 GLY 4 4.420 -5.273 5.238
15 H HIS 5 H HIS 5 3.070 -5.841 6.980
16 HA HIS 5 HA HIS 5 0.928 -7.802 6.523
17 HB2 HIS 5 HB2 HIS 5 2.478 -7.025 8.985
18 HB3 HIS 5 HB3 HIS 5 0.955 -7.902 9.096
19 HD1 HIS 5 HD1 HIS 5 4.199 -8.727 9.528
20 HD2 HIS 5 HD2 HIS 5 1.385 -10.159 6.828
21 HE1 HIS 5 HE1 HIS 5 5.024 -11.001 8.840
22 H VAL 6 H VAL 6 1.472 -4.336 7.315
23 HA VAL 6 HA VAL 6 -1.288 -4.153 8.435
24 HB VAL 6 HB VAL 6 1.147 -2.313 8.680
25 HG11 VAL 6 HG11 VAL 6 -1.555 -2.145 10.143
26 HG12 VAL 6 HG12 VAL 6 -0.157 -1.060 10.349
27 HG13 VAL 6 HG13 VAL 6 -1.044 -1.066 8.804
28 HG21 VAL 6 HG21 VAL 6 1.468 -4.456 9.939
29 HG22 VAL 6 HG22 VAL 6 1.211 -3.097 11.062
30 HG23 VAL 6 HG23 VAL 6 -0.121 -4.240 10.727
31 HA PRO 7 HA PRO 7 -1.868 -2.348 4.368
32 HB2 PRO 7 HB2 PRO 7 -4.258 -1.005 4.570
33 HB3 PRO 7 HB3 PRO 7 -4.083 -2.794 4.659
34 HG2 PRO 7 HG2 PRO 7 -4.150 -0.885 7.045
35 HG3 PRO 7 HG3 PRO 7 -5.263 -2.268 6.752
36 HD2 PRO 7 HD2 PRO 7 -3.092 -2.609 8.336
37 HD3 PRO 7 HD3 PRO 7 -3.440 -3.885 7.106
38 H GLU 8 H GLU 8 -1.482 -0.360 3.171
39 HA GLU 8 HA GLU 8 -0.242 1.772 4.805
40 HB2 GLU 8 HB2 GLU 8 -0.482 1.352 1.761
41 HB3 GLU 8 HB3 GLU 8 0.324 2.748 2.527
42 HG2 GLU 8 HG2 GLU 8 1.934 1.271 3.678
43 HG3 GLU 8 HG3 GLU 8 1.104 -0.177 3.068
44 H TYR 9 H TYR 9 -3.104 1.345 2.553
45 HA TYR 9 HA TYR 9 -4.325 3.742 3.850
46 HB2 TYR 9 HB2 TYR 9 -4.876 4.579 1.448
47 HB3 TYR 9 HB3 TYR 9 -3.171 4.711 1.922
48 HD1 TYR 9 HD2 TYR 9 -5.602 2.491 0.060
49 HD2 TYR 9 HD1 TYR 9 -1.475 3.566 0.651
50 HE1 TYR 9 HE2 TYR 9 -4.946 0.975 -1.768
51 HE2 TYR 9 HE1 TYR 9 -0.828 2.100 -1.219
52 HH TYR 9 HH TYR 9 -3.153 0.304 -3.224
53 H PHE 10 H PHE 10 -6.715 3.960 2.976
54 HA PHE 10 HA PHE 10 -7.750 1.192 2.463
55 HB2 PHE 10 HB2 PHE 10 -8.868 3.330 4.350
56 HB3 PHE 10 HB3 PHE 10 -9.748 1.868 3.854
57 HD1 PHE 10 HD1 PHE 10 -6.777 3.100 5.765
58 HD2 PHE 10 HD2 PHE 10 -8.995 -0.386 4.573
59 HE1 PHE 10 HE1 PHE 10 -5.797 1.827 7.653
60 HE2 PHE 10 HE2 PHE 10 -8.019 -1.655 6.462
61 HZ PHE 10 HZ PHE 10 -6.523 -0.507 8.085
62 H VAL 11 H VAL 11 -9.444 1.071 0.993
63 HA VAL 11 HA VAL 11 -10.185 3.553 -0.397
64 HB VAL 11 HB VAL 11 -10.608 0.721 -1.355
65 HG11 VAL 11 HG11 VAL 11 -10.627 2.061 -3.587
66 HG12 VAL 11 HG12 VAL 11 -12.071 2.029 -2.574
67 HG13 VAL 11 HG13 VAL 11 -11.004 3.433 -2.546
68 HG21 VAL 11 HG21 VAL 11 -8.336 2.631 -1.868
69 HG22 VAL 11 HG22 VAL 11 -8.251 1.016 -1.165
70 HG23 VAL 11 HG23 VAL 11 -8.666 1.216 -2.868
71 H ARG 12 H ARG 12 -12.443 3.627 -1.253
72 HA ARG 12 HA ARG 12 -14.285 3.176 0.901
73 HB2 ARG 12 HB2 ARG 12 -14.833 4.164 -1.904
74 HB3 ARG 12 HB3 ARG 12 -15.916 4.293 -0.524
75 HG2 ARG 12 HG2 ARG 12 -14.420 5.814 0.578
76 HG3 ARG 12 HG3 ARG 12 -13.207 5.593 -0.684
77 HD2 ARG 12 HD2 ARG 12 -14.115 7.439 -1.580
78 HD3 ARG 12 HD3 ARG 12 -15.372 6.340 -2.147
79 HE ARG 12 HE ARG 12 -16.831 7.330 -0.695
80 HH11 ARG 12 HH11 ARG 12 -13.579 8.124 0.258
81 HH12 ARG 12 HH12 ARG 12 -14.072 9.250 1.479
82 HH21 ARG 12 HH21 ARG 12 -17.494 8.810 0.909
83 HH22 ARG 12 HH22 ARG 12 -16.299 9.639 1.849
84 H GLY 13 H GLY 13 -13.082 0.829 -0.485
85 HA2 GLY 13 HA3 GLY 13 -15.492 -0.408 -1.633
86 HA3 GLY 13 HA2 GLY 13 -13.849 -0.995 -1.838
87 H ASP 14 H ASP 14 -13.341 -2.740 -0.709
88 HA ASP 14 HA ASP 14 -14.861 -3.295 1.756
89 HB2 ASP 14 HB2 ASP 14 -15.410 -4.914 0.041
90 HB3 ASP 14 HB3 ASP 14 -13.704 -5.228 -0.262
91 H PHE 15 H PHE 15 -11.917 -4.718 0.368
92 HA PHE 15 HA PHE 15 -10.536 -4.081 2.891
93 HB2 PHE 15 HB2 PHE 15 -10.365 -6.473 1.078
94 HB3 PHE 15 HB3 PHE 15 -9.047 -6.074 2.175
95 HD1 PHE 15 HD2 PHE 15 -10.180 -5.329 4.627
96 HD2 PHE 15 HD1 PHE 15 -11.622 -8.217 1.852
97 HE1 PHE 15 HE2 PHE 15 -11.347 -6.495 6.452
98 HE2 PHE 15 HE1 PHE 15 -12.792 -9.387 3.673
99 HZ PHE 15 HZ PHE 15 -12.654 -8.527 5.977
100 HA PRO 16 HA PRO 16 -7.642 -1.804 0.433
101 HB2 PRO 16 HB2 PRO 16 -5.371 -1.788 2.012
102 HB3 PRO 16 HB3 PRO 16 -6.922 -1.106 2.592
103 HG2 PRO 16 HG2 PRO 16 -5.891 -3.927 3.133
104 HG3 PRO 16 HG3 PRO 16 -6.394 -2.703 4.358
105 HD2 PRO 16 HD2 PRO 16 -8.133 -4.573 3.581
106 HD3 PRO 16 HD3 PRO 16 -8.699 -2.871 3.761
107 H ILE 17 H ILE 17 -5.190 -2.001 -0.468
108 HA ILE 17 HA ILE 17 -5.193 -4.703 -1.775
109 HB ILE 17 HB ILE 17 -4.129 -2.006 -2.739
110 HG12 ILE 17 HG12 ILE 17 -6.607 -3.609 -3.628
111 HG13 ILE 17 HG13 ILE 17 -6.646 -2.172 -2.578
112 HG21 ILE 17 HG21 ILE 17 -2.800 -3.969 -3.618
113 HG22 ILE 17 HG22 ILE 17 -4.313 -4.702 -4.220
114 HG23 ILE 17 HG23 ILE 17 -3.707 -3.164 -4.902
115 HD11 ILE 17 HD11 ILE 17 -5.586 -0.799 -4.427
116 HD12 ILE 17 HD12 ILE 17 -5.758 -2.205 -5.525
117 HD13 ILE 17 HD13 ILE 17 -7.203 -1.446 -4.821
118 H SER 18 H SER 18 -2.733 -2.119 -0.780
119 HA SER 18 HA SER 18 -0.695 -4.338 -0.788
120 HB2 SER 18 HB2 SER 18 0.865 -2.418 -1.248
121 HB3 SER 18 HB3 SER 18 -0.447 -2.532 -2.460
122 HG SER 18 HG SER 18 -0.286 -0.329 -1.634
123 H PHE 19 H PHE 19 1.273 -3.644 0.812
124 HA PHE 19 HA PHE 19 0.071 -2.691 3.356
125 HB2 PHE 19 HB2 PHE 19 1.610 -5.306 3.133
126 HB3 PHE 19 HB3 PHE 19 0.581 -4.800 4.493
127 HD1 PHE 19 HD2 PHE 19 -1.957 -4.796 4.165
128 HD2 PHE 19 HD1 PHE 19 0.712 -6.412 1.198
129 HE1 PHE 19 HE2 PHE 19 -3.871 -5.863 3.010
130 HE2 PHE 19 HE1 PHE 19 -1.183 -7.551 0.108
131 HZ PHE 19 HZ PHE 19 -3.486 -7.268 0.998
132 H TYR 20 H TYR 20 1.965 -2.992 5.175
133 HA TYR 20 HA TYR 20 3.445 -0.680 4.345
134 HB2 TYR 20 HB2 TYR 20 2.616 -1.554 6.826
135 HB3 TYR 20 HB3 TYR 20 4.287 -2.126 6.886
136 HD1 TYR 20 HD2 TYR 20 2.049 0.797 6.095
137 HD2 TYR 20 HD1 TYR 20 5.897 -0.381 7.612
138 HE1 TYR 20 HE2 TYR 20 2.600 3.166 6.539
139 HE2 TYR 20 HE1 TYR 20 6.427 1.972 8.101
140 HH TYR 20 HH TYR 20 5.683 4.241 7.986
141 H GLY 21 H GLY 21 6.027 -0.619 5.041
142 HA2 GLY 21 HA3 GLY 21 8.137 -1.639 4.842
143 HA3 GLY 21 HA2 GLY 21 7.369 -3.147 4.308
Start of MODEL 13
1 H1 GLY 1 H GLY 1 1.212 -0.571 0.606
2 HA2 GLY 1 HA3 GLY 1 2.149 0.170 -1.524
3 HA3 GLY 1 HA2 GLY 1 3.538 0.871 -0.687
4 H GLY 2 H GLY 2 4.429 -1.070 1.084
5 HA2 GLY 2 HA3 GLY 2 5.692 -2.898 -0.803
6 HA3 GLY 2 HA2 GLY 2 5.926 -2.846 0.956
7 H ALA 3 H ALA 3 5.926 -5.290 0.722
8 HA ALA 3 HA ALA 3 3.118 -6.384 0.525
9 HB1 ALA 3 HB1 ALA 3 5.821 -7.794 0.157
10 HB2 ALA 3 HB2 ALA 3 4.196 -8.519 -0.043
11 HB3 ALA 3 HB3 ALA 3 4.755 -7.247 -1.171
12 H GLY 4 H GLY 4 3.976 -4.964 2.932
13 HA2 GLY 4 HA3 GLY 4 4.935 -7.000 4.805
14 HA3 GLY 4 HA2 GLY 4 4.439 -5.345 5.172
15 H HIS 5 H HIS 5 3.108 -5.940 6.924
16 HA HIS 5 HA HIS 5 0.953 -7.885 6.451
17 HB2 HIS 5 HB2 HIS 5 2.516 -7.148 8.916
18 HB3 HIS 5 HB3 HIS 5 0.987 -8.016 9.022
19 HD1 HIS 5 HD1 HIS 5 1.254 -10.464 9.104
20 HD2 HIS 5 HD2 HIS 5 4.379 -8.647 7.056
21 HE1 HIS 5 HE1 HIS 5 2.816 -12.329 8.469
22 H VAL 6 H VAL 6 1.525 -4.433 7.273
23 HA VAL 6 HA VAL 6 -1.224 -4.237 8.417
24 HB VAL 6 HB VAL 6 1.244 -2.441 8.679
25 HG11 VAL 6 HG11 VAL 6 -0.026 -1.193 10.379
26 HG12 VAL 6 HG12 VAL 6 -0.925 -1.158 8.841
27 HG13 VAL 6 HG13 VAL 6 -1.444 -2.250 10.167
28 HG21 VAL 6 HG21 VAL 6 -0.044 -4.382 10.701
29 HG22 VAL 6 HG22 VAL 6 1.536 -4.609 9.900
30 HG23 VAL 6 HG23 VAL 6 1.309 -3.266 11.048
31 HA PRO 7 HA PRO 7 -1.796 -2.361 4.388
32 HB2 PRO 7 HB2 PRO 7 -4.162 -0.988 4.617
33 HB3 PRO 7 HB3 PRO 7 -4.010 -2.780 4.702
34 HG2 PRO 7 HG2 PRO 7 -4.020 -0.877 7.094
35 HG3 PRO 7 HG3 PRO 7 -5.172 -2.230 6.807
36 HD2 PRO 7 HD2 PRO 7 -2.995 -2.640 8.365
37 HD3 PRO 7 HD3 PRO 7 -3.380 -3.894 7.123
38 H GLU 8 H GLU 8 -1.428 -0.362 3.199
39 HA GLU 8 HA GLU 8 -0.140 1.747 4.833
40 HB2 GLU 8 HB2 GLU 8 -0.406 1.340 1.788
41 HB3 GLU 8 HB3 GLU 8 0.423 2.721 2.554
42 HG2 GLU 8 HG2 GLU 8 2.021 1.216 3.687
43 HG3 GLU 8 HG3 GLU 8 1.169 -0.217 3.072
44 H TYR 9 H TYR 9 -3.008 1.365 2.575
45 HA TYR 9 HA TYR 9 -4.216 3.750 3.907
46 HB2 TYR 9 HB2 TYR 9 -4.759 4.628 1.519
47 HB3 TYR 9 HB3 TYR 9 -3.052 4.740 1.993
48 HD1 TYR 9 HD1 TYR 9 -5.503 2.581 0.090
49 HD2 TYR 9 HD2 TYR 9 -1.364 3.588 0.714
50 HE1 TYR 9 HE1 TYR 9 -4.862 1.089 -1.761
51 HE2 TYR 9 HE2 TYR 9 -0.729 2.134 -1.171
52 HH TYR 9 HH TYR 9 -3.073 0.371 -3.192
53 H PHE 10 H PHE 10 -6.607 3.989 3.033
54 HA PHE 10 HA PHE 10 -7.656 1.226 2.519
55 HB2 PHE 10 HB2 PHE 10 -8.772 3.374 4.395
56 HB3 PHE 10 HB3 PHE 10 -9.631 1.891 3.929
57 HD1 PHE 10 HD1 PHE 10 -6.677 3.210 5.806
58 HD2 PHE 10 HD2 PHE 10 -8.818 -0.342 4.669
59 HE1 PHE 10 HE1 PHE 10 -5.653 1.983 7.699
60 HE2 PHE 10 HE2 PHE 10 -7.805 -1.563 6.569
61 HZ PHE 10 HZ PHE 10 -6.318 -0.364 8.161
62 H VAL 11 H VAL 11 -9.356 1.111 1.046
63 HA VAL 11 HA VAL 11 -10.096 3.606 -0.321
64 HB VAL 11 HB VAL 11 -10.531 0.784 -1.302
65 HG11 VAL 11 HG11 VAL 11 -10.547 2.145 -3.523
66 HG12 VAL 11 HG12 VAL 11 -11.990 2.107 -2.508
67 HG13 VAL 11 HG13 VAL 11 -10.920 3.508 -2.467
68 HG21 VAL 11 HG21 VAL 11 -8.592 1.317 -2.828
69 HG22 VAL 11 HG22 VAL 11 -8.242 2.684 -1.770
70 HG23 VAL 11 HG23 VAL 11 -8.179 1.039 -1.136
71 H ARG 12 H ARG 12 -12.357 3.688 -1.174
72 HA ARG 12 HA ARG 12 -14.193 3.229 0.983
73 HB2 ARG 12 HB2 ARG 12 -14.473 4.416 -1.771
74 HB3 ARG 12 HB3 ARG 12 -15.859 4.182 -0.714
75 HG2 ARG 12 HG2 ARG 12 -14.841 5.625 0.962
76 HG3 ARG 12 HG3 ARG 12 -13.430 5.843 -0.075
77 HD2 ARG 12 HD2 ARG 12 -14.483 7.627 -0.901
78 HD3 ARG 12 HD3 ARG 12 -15.545 6.486 -1.724
79 HE ARG 12 HE ARG 12 -16.595 6.826 0.805
80 HH11 ARG 12 HH11 ARG 12 -15.903 8.830 -1.957
81 HH12 ARG 12 HH12 ARG 12 -17.186 9.947 -1.631
82 HH21 ARG 12 HH21 ARG 12 -18.288 8.290 1.244
83 HH22 ARG 12 HH22 ARG 12 -18.542 9.640 0.190
84 H GLY 13 H GLY 13 -12.997 0.888 -0.422
85 HA2 GLY 13 HA3 GLY 13 -15.415 -0.339 -1.564
86 HA3 GLY 13 HA2 GLY 13 -13.773 -0.926 -1.783
87 H ASP 14 H ASP 14 -13.259 -2.678 -0.668
88 HA ASP 14 HA ASP 14 -14.766 -3.250 1.800
89 HB2 ASP 14 HB2 ASP 14 -15.318 -4.858 0.074
90 HB3 ASP 14 HB3 ASP 14 -13.611 -5.170 -0.230
91 H PHE 15 H PHE 15 -11.826 -4.660 0.393
92 HA PHE 15 HA PHE 15 -10.433 -4.029 2.911
93 HB2 PHE 15 HB2 PHE 15 -10.276 -6.423 1.099
94 HB3 PHE 15 HB3 PHE 15 -8.952 -6.025 2.188
95 HD1 PHE 15 HD2 PHE 15 -10.077 -5.272 4.645
96 HD2 PHE 15 HD1 PHE 15 -11.525 -8.169 1.882
97 HE1 PHE 15 HE2 PHE 15 -11.236 -6.435 6.477
98 HE2 PHE 15 HE1 PHE 15 -12.687 -9.336 3.710
99 HZ PHE 15 HZ PHE 15 -12.542 -8.470 6.011
100 HA PRO 16 HA PRO 16 -7.561 -1.745 0.456
101 HB2 PRO 16 HB2 PRO 16 -5.269 -1.749 2.001
102 HB3 PRO 16 HB3 PRO 16 -6.809 -1.053 2.596
103 HG2 PRO 16 HG2 PRO 16 -5.790 -3.875 3.142
104 HG3 PRO 16 HG3 PRO 16 -6.296 -2.648 4.363
105 HD2 PRO 16 HD2 PRO 16 -8.034 -4.522 3.591
106 HD3 PRO 16 HD3 PRO 16 -8.597 -2.819 3.773
107 H ILE 17 H ILE 17 -5.201 -1.914 -0.575
108 HA ILE 17 HA ILE 17 -5.201 -4.623 -1.848
109 HB ILE 17 HB ILE 17 -4.138 -1.930 -2.821
110 HG12 ILE 17 HG12 ILE 17 -5.764 -2.240 -4.670
111 HG13 ILE 17 HG13 ILE 17 -6.381 -3.737 -3.927
112 HG21 ILE 17 HG21 ILE 17 -3.946 -4.704 -4.139
113 HG22 ILE 17 HG22 ILE 17 -3.532 -3.160 -4.934
114 HG23 ILE 17 HG23 ILE 17 -2.570 -3.725 -3.558
115 HD11 ILE 17 HD11 ILE 17 -7.373 -2.445 -2.066
116 HD12 ILE 17 HD12 ILE 17 -6.522 -0.953 -2.587
117 HD13 ILE 17 HD13 ILE 17 -7.828 -1.651 -3.582
118 H SER 18 H SER 18 -2.712 -2.080 -0.848
119 HA SER 18 HA SER 18 -0.706 -4.324 -0.838
120 HB2 SER 18 HB2 SER 18 0.883 -2.415 -1.261
121 HB3 SER 18 HB3 SER 18 -0.419 -2.503 -2.483
122 HG SER 18 HG SER 18 -0.246 -0.311 -1.629
123 H PHE 19 H PHE 19 1.275 -3.681 0.765
124 HA PHE 19 HA PHE 19 0.100 -2.727 3.319
125 HB2 PHE 19 HB2 PHE 19 1.616 -5.354 3.089
126 HB3 PHE 19 HB3 PHE 19 0.579 -4.847 4.442
127 HD1 PHE 19 HD2 PHE 19 -1.960 -4.797 4.079
128 HD2 PHE 19 HD1 PHE 19 0.725 -6.471 1.159
129 HE1 PHE 19 HE2 PHE 19 -3.872 -5.860 2.917
130 HE2 PHE 19 HE1 PHE 19 -1.171 -7.600 0.058
131 HZ PHE 19 HZ PHE 19 -3.479 -7.290 0.925
132 H TYR 20 H TYR 20 2.009 -3.082 5.126
133 HA TYR 20 HA TYR 20 3.506 -0.768 4.318
134 HB2 TYR 20 HB2 TYR 20 2.673 -1.668 6.790
135 HB3 TYR 20 HB3 TYR 20 4.338 -2.255 6.839
136 HD1 TYR 20 HD2 TYR 20 2.124 0.696 6.092
137 HD2 TYR 20 HD1 TYR 20 5.961 -0.533 7.594
138 HE1 TYR 20 HE2 TYR 20 2.680 3.047 6.562
139 HE2 TYR 20 HE1 TYR 20 6.503 1.824 8.110
140 HH TYR 20 HH TYR 20 4.314 4.560 7.429
141 H GLY 21 H GLY 21 6.096 -0.757 5.034
142 HA2 GLY 21 HA3 GLY 21 8.192 -1.783 4.814
143 HA3 GLY 21 HA2 GLY 21 7.403 -3.296 4.326
Start of MODEL 14
1 H1 GLY 1 H GLY 1 1.283 -0.579 0.635
2 HA2 GLY 1 HA3 GLY 1 2.224 0.160 -1.498
3 HA3 GLY 1 HA2 GLY 1 3.613 0.860 -0.656
4 H GLY 2 H GLY 2 4.467 -1.085 1.140
5 HA2 GLY 2 HA3 GLY 2 5.745 -2.930 -0.720
6 HA3 GLY 2 HA2 GLY 2 5.945 -2.878 1.044
7 H ALA 3 H ALA 3 5.913 -5.321 0.839
8 HA ALA 3 HA ALA 3 3.088 -6.370 0.605
9 HB1 ALA 3 HB1 ALA 3 4.716 -7.248 -1.096
10 HB2 ALA 3 HB2 ALA 3 5.768 -7.821 0.232
11 HB3 ALA 3 HB3 ALA 3 4.132 -8.518 0.021
12 H GLY 4 H GLY 4 3.998 -4.978 3.024
13 HA2 GLY 4 HA3 GLY 4 4.871 -7.065 4.883
14 HA3 GLY 4 HA2 GLY 4 4.433 -5.397 5.262
15 H HIS 5 H HIS 5 3.042 -5.925 6.981
16 HA HIS 5 HA HIS 5 0.872 -7.850 6.504
17 HB2 HIS 5 HB2 HIS 5 2.420 -7.106 8.977
18 HB3 HIS 5 HB3 HIS 5 0.883 -7.960 9.076
19 HD1 HIS 5 HD1 HIS 5 4.457 -8.418 8.133
20 HD2 HIS 5 HD2 HIS 5 0.944 -10.635 8.199
21 HE1 HIS 5 HE1 HIS 5 5.164 -10.808 7.794
22 H VAL 6 H VAL 6 1.468 -4.400 7.316
23 HA VAL 6 HA VAL 6 -1.296 -4.172 8.420
24 HB VAL 6 HB VAL 6 1.178 -2.382 8.683
25 HG11 VAL 6 HG11 VAL 6 -0.988 -1.088 8.804
26 HG12 VAL 6 HG12 VAL 6 -1.525 -2.160 10.139
27 HG13 VAL 6 HG13 VAL 6 -0.104 -1.106 10.352
28 HG21 VAL 6 HG21 VAL 6 1.214 -3.174 11.063
29 HG22 VAL 6 HG22 VAL 6 -0.140 -4.289 10.718
30 HG23 VAL 6 HG23 VAL 6 1.448 -4.536 9.938
31 HA PRO 7 HA PRO 7 -1.812 -2.325 4.357
32 HB2 PRO 7 HB2 PRO 7 -4.171 -0.932 4.558
33 HB3 PRO 7 HB3 PRO 7 -4.039 -2.725 4.650
34 HG2 PRO 7 HG2 PRO 7 -4.057 -0.812 7.034
35 HG3 PRO 7 HG3 PRO 7 -5.214 -2.158 6.741
36 HD2 PRO 7 HD2 PRO 7 -3.058 -2.573 8.326
37 HD3 PRO 7 HD3 PRO 7 -3.440 -3.834 7.089
38 H GLU 8 H GLU 8 -1.389 -0.331 3.178
39 HA GLU 8 HA GLU 8 -0.112 1.761 4.834
40 HB2 GLU 8 HB2 GLU 8 -0.357 1.375 1.785
41 HB3 GLU 8 HB3 GLU 8 0.473 2.749 2.563
42 HG2 GLU 8 HG2 GLU 8 2.056 1.235 3.701
43 HG3 GLU 8 HG3 GLU 8 1.201 -0.195 3.081
44 H TYR 9 H TYR 9 -2.986 1.407 2.587
45 HA TYR 9 HA TYR 9 -4.162 3.813 3.907
46 HB2 TYR 9 HB2 TYR 9 -4.683 4.693 1.511
47 HB3 TYR 9 HB3 TYR 9 -2.978 4.780 1.994
48 HD1 TYR 9 HD1 TYR 9 -5.452 2.613 0.122
49 HD2 TYR 9 HD2 TYR 9 -1.310 3.647 0.681
50 HE1 TYR 9 HE1 TYR 9 -4.826 1.079 -1.700
51 HE2 TYR 9 HE2 TYR 9 -0.694 2.182 -1.201
52 HH TYR 9 HH TYR 9 -3.044 0.218 -3.041
53 H PHE 10 H PHE 10 -6.549 4.085 2.981
54 HA PHE 10 HA PHE 10 -7.624 1.332 2.474
55 HB2 PHE 10 HB2 PHE 10 -8.729 3.492 4.345
56 HB3 PHE 10 HB3 PHE 10 -9.607 2.023 3.867
57 HD1 PHE 10 HD1 PHE 10 -6.648 3.291 5.771
58 HD2 PHE 10 HD2 PHE 10 -8.837 -0.224 4.608
59 HE1 PHE 10 HE1 PHE 10 -5.655 2.041 7.666
60 HE2 PHE 10 HE2 PHE 10 -7.855 -1.467 6.509
61 HZ PHE 10 HZ PHE 10 -6.357 -0.298 8.114
62 H VAL 11 H VAL 11 -9.321 1.234 1.000
63 HA VAL 11 HA VAL 11 -10.017 3.725 -0.395
64 HB VAL 11 HB VAL 11 -10.486 0.899 -1.349
65 HG11 VAL 11 HG11 VAL 11 -10.482 2.234 -3.584
66 HG12 VAL 11 HG12 VAL 11 -11.927 2.229 -2.571
67 HG13 VAL 11 HG13 VAL 11 -10.835 3.615 -2.546
68 HG21 VAL 11 HG21 VAL 11 -8.191 0.946 -1.358
69 HG22 VAL 11 HG22 VAL 11 -8.533 1.646 -2.940
70 HG23 VAL 11 HG23 VAL 11 -8.118 2.693 -1.584
71 H ARG 12 H ARG 12 -12.272 3.836 -1.255
72 HA ARG 12 HA ARG 12 -14.124 3.414 0.897
73 HB2 ARG 12 HB2 ARG 12 -14.442 4.554 -1.880
74 HB3 ARG 12 HB3 ARG 12 -15.767 4.436 -0.731
75 HG2 ARG 12 HG2 ARG 12 -14.624 5.907 0.802
76 HG3 ARG 12 HG3 ARG 12 -13.213 5.957 -0.256
77 HD2 ARG 12 HD2 ARG 12 -14.113 7.579 -1.484
78 HD3 ARG 12 HD3 ARG 12 -15.596 6.653 -1.712
79 HE ARG 12 HE ARG 12 -15.156 8.789 0.156
80 HH11 ARG 12 HH11 ARG 12 -17.029 5.937 -0.533
81 HH12 ARG 12 HH12 ARG 12 -18.378 6.430 0.437
82 HH21 ARG 12 HH21 ARG 12 -16.924 9.449 1.436
83 HH22 ARG 12 HH22 ARG 12 -18.317 8.428 1.556
84 H GLY 13 H GLY 13 -12.962 1.052 -0.499
85 HA2 GLY 13 HA3 GLY 13 -15.395 -0.135 -1.653
86 HA3 GLY 13 HA2 GLY 13 -13.762 -0.751 -1.863
87 H ASP 14 H ASP 14 -13.282 -2.508 -0.741
88 HA ASP 14 HA ASP 14 -14.813 -3.052 1.718
89 HB2 ASP 14 HB2 ASP 14 -15.383 -4.655 -0.006
90 HB3 ASP 14 HB3 ASP 14 -13.680 -4.992 -0.306
91 H PHE 15 H PHE 15 -11.887 -4.506 0.327
92 HA PHE 15 HA PHE 15 -10.502 -3.903 2.857
93 HB2 PHE 15 HB2 PHE 15 -10.361 -6.290 1.032
94 HB3 PHE 15 HB3 PHE 15 -9.041 -5.915 2.135
95 HD1 PHE 15 HD2 PHE 15 -10.137 -5.189 4.594
96 HD2 PHE 15 HD1 PHE 15 -11.679 -7.995 1.789
97 HE1 PHE 15 HE2 PHE 15 -11.325 -6.347 6.410
98 HE2 PHE 15 HE1 PHE 15 -12.871 -9.157 3.601
99 HZ PHE 15 HZ PHE 15 -12.694 -8.334 5.915
100 HA PRO 16 HA PRO 16 -7.540 -1.709 0.359
101 HB2 PRO 16 HB2 PRO 16 -5.290 -1.698 1.956
102 HB3 PRO 16 HB3 PRO 16 -6.832 -0.978 2.514
103 HG2 PRO 16 HG2 PRO 16 -5.848 -3.804 3.119
104 HG3 PRO 16 HG3 PRO 16 -6.342 -2.549 4.317
105 HD2 PRO 16 HD2 PRO 16 -8.102 -4.420 3.548
106 HD3 PRO 16 HD3 PRO 16 -8.647 -2.709 3.721
107 H ILE 17 H ILE 17 -5.103 -2.004 -0.547
108 HA ILE 17 HA ILE 17 -5.102 -4.797 -1.659
109 HB ILE 17 HB ILE 17 -4.018 -2.211 -2.872
110 HG12 ILE 17 HG12 ILE 17 -6.442 -1.980 -2.713
111 HG13 ILE 17 HG13 ILE 17 -5.941 -2.229 -4.397
112 HG21 ILE 17 HG21 ILE 17 -3.914 -3.575 -4.988
113 HG22 ILE 17 HG22 ILE 17 -2.812 -4.164 -3.721
114 HG23 ILE 17 HG23 ILE 17 -4.328 -5.038 -4.050
115 HD11 ILE 17 HD11 ILE 17 -8.005 -3.487 -3.930
116 HD12 ILE 17 HD12 ILE 17 -6.696 -4.652 -4.245
117 HD13 ILE 17 HD13 ILE 17 -7.254 -4.350 -2.570
118 H SER 18 H SER 18 -2.675 -2.114 -0.856
119 HA SER 18 HA SER 18 -0.597 -4.287 -0.859
120 HB2 SER 18 HB2 SER 18 0.938 -2.353 -1.251
121 HB3 SER 18 HB3 SER 18 -0.374 -2.417 -2.466
122 HG SER 18 HG SER 18 -0.204 -0.250 -1.543
123 H PHE 19 H PHE 19 1.335 -3.636 0.785
124 HA PHE 19 HA PHE 19 0.115 -2.743 3.342
125 HB2 PHE 19 HB2 PHE 19 1.633 -5.367 3.028
126 HB3 PHE 19 HB3 PHE 19 0.671 -4.874 4.441
127 HD1 PHE 19 HD1 PHE 19 -1.875 -4.795 4.218
128 HD2 PHE 19 HD2 PHE 19 0.627 -6.409 1.106
129 HE1 PHE 19 HE1 PHE 19 -3.859 -5.810 3.136
130 HE2 PHE 19 HE2 PHE 19 -1.335 -7.514 0.099
131 HZ PHE 19 HZ PHE 19 -3.590 -7.196 1.092
132 H TYR 20 H TYR 20 1.986 -3.044 5.169
133 HA TYR 20 HA TYR 20 3.510 -0.751 4.361
134 HB2 TYR 20 HB2 TYR 20 2.614 -1.572 6.812
135 HB3 TYR 20 HB3 TYR 20 4.244 -2.248 6.915
136 HD1 TYR 20 HD2 TYR 20 2.203 0.810 6.118
137 HD2 TYR 20 HD1 TYR 20 5.960 -0.606 7.659
138 HE1 TYR 20 HE2 TYR 20 2.873 3.131 6.584
139 HE2 TYR 20 HE1 TYR 20 6.614 1.722 8.174
140 HH TYR 20 HH TYR 20 4.576 4.563 7.454
141 H GLY 21 H GLY 21 6.085 -0.719 5.058
142 HA2 GLY 21 HA3 GLY 21 8.180 -1.767 4.906
143 HA3 GLY 21 HA2 GLY 21 7.395 -3.286 4.433
Start of MODEL 15
1 H1 GLY 1 H GLY 1 1.939 -0.993 0.967
2 HA2 GLY 1 HA3 GLY 1 2.354 0.127 -1.380
3 HA3 GLY 1 HA2 GLY 1 3.831 0.730 -0.571
4 H GLY 2 H GLY 2 4.684 -1.322 1.050
5 HA2 GLY 2 HA3 GLY 2 5.743 -3.170 -0.965
6 HA3 GLY 2 HA2 GLY 2 6.126 -3.147 0.773
7 H ALA 3 H ALA 3 5.926 -5.591 0.589
8 HA ALA 3 HA ALA 3 3.045 -6.471 0.536
9 HB1 ALA 3 HB1 ALA 3 5.639 -8.095 0.150
10 HB2 ALA 3 HB2 ALA 3 3.965 -8.713 0.028
11 HB3 ALA 3 HB3 ALA 3 4.570 -7.524 -1.164
12 H GLY 4 H GLY 4 3.979 -5.036 2.855
13 HA2 GLY 4 HA3 GLY 4 4.916 -6.989 4.808
14 HA3 GLY 4 HA2 GLY 4 4.374 -5.333 5.115
15 H HIS 5 H HIS 5 3.109 -5.986 6.904
16 HA HIS 5 HA HIS 5 0.939 -7.916 6.438
17 HB2 HIS 5 HB2 HIS 5 2.523 -7.198 8.897
18 HB3 HIS 5 HB3 HIS 5 0.989 -8.056 9.009
19 HD1 HIS 5 HD1 HIS 5 3.598 -9.377 9.951
20 HD2 HIS 5 HD2 HIS 5 1.995 -9.836 6.146
21 HE1 HIS 5 HE1 HIS 5 4.544 -11.538 9.079
22 H VAL 6 H VAL 6 1.534 -4.470 7.255
23 HA VAL 6 HA VAL 6 -1.208 -4.256 8.416
24 HB VAL 6 HB VAL 6 1.270 -2.473 8.663
25 HG11 VAL 6 HG11 VAL 6 -0.894 -1.181 8.835
26 HG12 VAL 6 HG12 VAL 6 -1.411 -2.271 10.163
27 HG13 VAL 6 HG13 VAL 6 0.012 -1.219 10.369
28 HG21 VAL 6 HG21 VAL 6 -0.015 -4.407 10.695
29 HG22 VAL 6 HG22 VAL 6 1.561 -4.641 9.886
30 HG23 VAL 6 HG23 VAL 6 1.344 -3.296 11.033
31 HA PRO 7 HA PRO 7 -1.770 -2.362 4.385
32 HB2 PRO 7 HB2 PRO 7 -4.136 -0.992 4.622
33 HB3 PRO 7 HB3 PRO 7 -3.991 -2.785 4.697
34 HG2 PRO 7 HG2 PRO 7 -3.998 -0.892 7.097
35 HG3 PRO 7 HG3 PRO 7 -5.153 -2.240 6.805
36 HD2 PRO 7 HD2 PRO 7 -2.973 -2.655 8.361
37 HD3 PRO 7 HD3 PRO 7 -3.365 -3.910 7.121
38 H GLU 8 H GLU 8 -1.374 -0.348 3.230
39 HA GLU 8 HA GLU 8 -0.078 1.732 4.879
40 HB2 GLU 8 HB2 GLU 8 -0.486 1.435 1.843
41 HB3 GLU 8 HB3 GLU 8 0.359 2.805 2.610
42 HG2 GLU 8 HG2 GLU 8 2.079 1.307 3.541
43 HG3 GLU 8 HG3 GLU 8 1.185 -0.135 3.010
44 H TYR 9 H TYR 9 -2.997 1.393 2.679
45 HA TYR 9 HA TYR 9 -4.170 3.809 4.008
46 HB2 TYR 9 HB2 TYR 9 -4.719 4.646 1.616
47 HB3 TYR 9 HB3 TYR 9 -2.996 4.688 2.033
48 HD1 TYR 9 HD2 TYR 9 -5.607 2.542 0.319
49 HD2 TYR 9 HD1 TYR 9 -1.430 3.532 0.624
50 HE1 TYR 9 HE2 TYR 9 -5.083 0.918 -1.470
51 HE2 TYR 9 HE1 TYR 9 -0.919 1.968 -1.198
52 HH TYR 9 HH TYR 9 -1.775 0.257 -2.635
53 H PHE 10 H PHE 10 -6.577 4.047 3.058
54 HA PHE 10 HA PHE 10 -7.633 1.287 2.581
55 HB2 PHE 10 HB2 PHE 10 -8.738 3.411 4.493
56 HB3 PHE 10 HB3 PHE 10 -9.610 1.942 4.006
57 HD1 PHE 10 HD1 PHE 10 -6.624 3.203 5.876
58 HD2 PHE 10 HD2 PHE 10 -8.829 -0.305 4.725
59 HE1 PHE 10 HE1 PHE 10 -5.596 1.940 7.743
60 HE2 PHE 10 HE2 PHE 10 -7.812 -1.561 6.601
61 HZ PHE 10 HZ PHE 10 -6.292 -0.400 8.190
62 H VAL 11 H VAL 11 -9.341 1.183 1.123
63 HA VAL 11 HA VAL 11 -10.065 3.682 -0.245
64 HB VAL 11 HB VAL 11 -10.533 0.863 -1.215
65 HG11 VAL 11 HG11 VAL 11 -10.560 2.217 -3.439
66 HG12 VAL 11 HG12 VAL 11 -11.994 2.195 -2.410
67 HG13 VAL 11 HG13 VAL 11 -10.910 3.586 -2.385
68 HG21 VAL 11 HG21 VAL 11 -8.576 1.975 -2.807
69 HG22 VAL 11 HG22 VAL 11 -8.114 2.478 -1.182
70 HG23 VAL 11 HG23 VAL 11 -8.326 0.766 -1.548
71 H ARG 12 H ARG 12 -12.331 3.787 -1.079
72 HA ARG 12 HA ARG 12 -14.156 3.348 1.092
73 HB2 ARG 12 HB2 ARG 12 -14.470 4.521 -1.668
74 HB3 ARG 12 HB3 ARG 12 -15.825 4.335 -0.563
75 HG2 ARG 12 HG2 ARG 12 -14.731 5.781 1.054
76 HG3 ARG 12 HG3 ARG 12 -13.335 5.937 -0.014
77 HD2 ARG 12 HD2 ARG 12 -14.750 7.885 -0.228
78 HD3 ARG 12 HD3 ARG 12 -14.790 6.952 -1.723
79 HE ARG 12 HE ARG 12 -16.929 6.043 -0.293
80 HH11 ARG 12 HH11 ARG 12 -15.852 9.164 -1.395
81 HH12 ARG 12 HH12 ARG 12 -17.453 9.809 -1.545
82 HH21 ARG 12 HH21 ARG 12 -19.042 6.880 -0.486
83 HH22 ARG 12 HH22 ARG 12 -19.267 8.510 -1.027
84 H GLY 13 H GLY 13 -12.995 0.995 -0.324
85 HA2 GLY 13 HA3 GLY 13 -15.435 -0.205 -1.448
86 HA3 GLY 13 HA2 GLY 13 -13.802 -0.810 -1.680
87 H ASP 14 H ASP 14 -13.302 -2.571 -0.574
88 HA ASP 14 HA ASP 14 -14.793 -3.126 1.908
89 HB2 ASP 14 HB2 ASP 14 -15.372 -4.720 0.167
90 HB3 ASP 14 HB3 ASP 14 -13.670 -5.068 -0.120
91 H PHE 15 H PHE 15 -11.884 -4.570 0.470
92 HA PHE 15 HA PHE 15 -10.461 -3.966 2.979
93 HB2 PHE 15 HB2 PHE 15 -10.343 -6.349 1.149
94 HB3 PHE 15 HB3 PHE 15 -9.006 -5.971 2.230
95 HD1 PHE 15 HD1 PHE 15 -10.050 -5.261 4.710
96 HD2 PHE 15 HD2 PHE 15 -11.655 -8.050 1.924
97 HE1 PHE 15 HE1 PHE 15 -11.204 -6.424 6.545
98 HE2 PHE 15 HE2 PHE 15 -12.812 -9.218 3.755
99 HZ PHE 15 HZ PHE 15 -12.588 -8.405 6.069
100 HA PRO 16 HA PRO 16 -7.604 -1.681 0.503
101 HB2 PRO 16 HB2 PRO 16 -5.313 -1.665 2.051
102 HB3 PRO 16 HB3 PRO 16 -6.861 -1.004 2.659
103 HG2 PRO 16 HG2 PRO 16 -5.802 -3.822 3.149
104 HG3 PRO 16 HG3 PRO 16 -6.295 -2.617 4.397
105 HD2 PRO 16 HD2 PRO 16 -8.039 -4.491 3.619
106 HD3 PRO 16 HD3 PRO 16 -8.606 -2.793 3.834
107 H ILE 17 H ILE 17 -5.147 -1.838 -0.424
108 HA ILE 17 HA ILE 17 -5.125 -4.533 -1.745
109 HB ILE 17 HB ILE 17 -4.167 -1.813 -2.748
110 HG12 ILE 17 HG12 ILE 17 -6.622 -3.496 -3.540
111 HG13 ILE 17 HG13 ILE 17 -6.662 -2.032 -2.527
112 HG21 ILE 17 HG21 ILE 17 -4.310 -4.522 -4.209
113 HG22 ILE 17 HG22 ILE 17 -3.755 -2.974 -4.912
114 HG23 ILE 17 HG23 ILE 17 -2.803 -3.750 -3.641
115 HD11 ILE 17 HD11 ILE 17 -7.303 -1.374 -4.769
116 HD12 ILE 17 HD12 ILE 17 -5.684 -0.691 -4.450
117 HD13 ILE 17 HD13 ILE 17 -5.871 -2.130 -5.500
118 H SER 18 H SER 18 -2.659 -1.892 -0.891
119 HA SER 18 HA SER 18 -0.618 -4.082 -0.971
120 HB2 SER 18 HB2 SER 18 0.974 -2.153 -1.176
121 HB3 SER 18 HB3 SER 18 -0.301 -2.102 -2.416
122 HG SER 18 HG SER 18 -0.377 -0.529 -0.013
123 H PHE 19 H PHE 19 1.310 -3.626 0.723
124 HA PHE 19 HA PHE 19 0.127 -2.797 3.321
125 HB2 PHE 19 HB2 PHE 19 1.610 -5.431 2.894
126 HB3 PHE 19 HB3 PHE 19 0.709 -4.953 4.356
127 HD1 PHE 19 HD1 PHE 19 -1.835 -4.852 4.242
128 HD2 PHE 19 HD2 PHE 19 0.511 -6.353 0.955
129 HE1 PHE 19 HE1 PHE 19 -3.879 -5.790 3.200
130 HE2 PHE 19 HE2 PHE 19 -1.511 -7.378 -0.022
131 HZ PHE 19 HZ PHE 19 -3.719 -7.068 1.075
132 H TYR 20 H TYR 20 1.989 -3.081 5.114
133 HA TYR 20 HA TYR 20 3.533 -0.816 4.292
134 HB2 TYR 20 HB2 TYR 20 2.692 -1.681 6.775
135 HB3 TYR 20 HB3 TYR 20 4.355 -2.278 6.826
136 HD1 TYR 20 HD2 TYR 20 2.187 0.684 5.952
137 HD2 TYR 20 HD1 TYR 20 5.938 -0.556 7.647
138 HE1 TYR 20 HE2 TYR 20 2.767 3.045 6.395
139 HE2 TYR 20 HE1 TYR 20 6.497 1.790 8.133
140 HH TYR 20 HH TYR 20 5.811 4.073 7.954
141 H GLY 21 H GLY 21 6.138 -0.898 5.094
142 HA2 GLY 21 HA3 GLY 21 8.198 -2.053 4.850
143 HA3 GLY 21 HA2 GLY 21 7.368 -3.401 4.044
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