Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
488130 | 2l4g RC | 17240 | 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 -14.725 -3.674 -0.019
2 HA2 GLY 1 1HA GLY 1 -14.392 -1.433 -0.149
3 HA3 GLY 1 2HA GLY 1 -15.027 -1.236 1.473
4 H LEU 2 H LEU 2 -13.133 -3.377 2.556
5 HA LEU 2 HA LEU 2 -10.991 -1.579 3.126
6 HB3 LEU 2 2HB LEU 2 -10.963 -4.458 3.906
7 HG LEU 2 HG LEU 2 -9.336 -2.578 4.750
8 HD11 LEU 2 1HD1 LEU 2 -10.702 -0.857 5.470
9 HD12 LEU 2 2HD1 LEU 2 -11.897 -1.960 6.194
10 HD13 LEU 2 3HD1 LEU 2 -10.327 -1.702 6.992
11 HD21 LEU 2 3HD2 LEU 2 -9.816 -3.770 7.183
12 HD22 LEU 2 1HD2 LEU 2 -10.520 -4.930 6.031
13 HD23 LEU 2 2HD2 LEU 2 -8.817 -4.438 5.871
14 H PHE 3 H PHE 3 -11.333 -4.746 1.396
15 HA PHE 3 HA PHE 3 -8.685 -5.036 0.700
16 HB3 PHE 3 2HB PHE 3 -10.869 -5.706 -1.282
17 HD1 PHE 3 2HD PHE 3 -8.423 -6.121 -2.271
18 HD2 PHE 3 1HD PHE 3 -10.234 -8.434 0.792
19 HE1 PHE 3 2HE PHE 3 -6.898 -8.037 -2.816
20 HE2 PHE 3 1HE PHE 3 -8.708 -10.350 0.246
21 HZ PHE 3 HZ PHE 3 -7.057 -10.129 -1.552
22 H GLY 4 H GLY 4 -11.083 -2.754 -0.471
23 HA2 GLY 4 1HA GLY 4 -9.657 -2.230 -2.953
24 HA3 GLY 4 2HA GLY 4 -11.136 -1.480 -2.386
25 H ALA 5 H ALA 5 -9.739 -1.127 0.393
26 HA ALA 5 HA ALA 5 -8.682 1.476 -0.241
27 HB1 ALA 5 1HB ALA 5 -8.744 1.808 2.157
28 HB2 ALA 5 2HB ALA 5 -10.248 0.987 1.673
29 HB3 ALA 5 3HB ALA 5 -8.936 0.061 2.441
30 H ILE 6 H ILE 6 -7.527 -1.779 0.508
31 HA ILE 6 HA ILE 6 -5.089 -1.345 1.597
32 HB ILE 6 HB ILE 6 -5.807 -3.312 -0.579
33 HG13 ILE 6 2HG1 ILE 6 -7.376 -3.599 1.163
34 HG21 ILE 6 1HG2 ILE 6 -3.292 -2.788 0.283
35 HG22 ILE 6 2HG2 ILE 6 -3.795 -4.018 1.466
36 HG23 ILE 6 3HG2 ILE 6 -3.852 -4.383 -0.275
37 HD11 ILE 6 3HD1 ILE 6 -5.695 -5.609 0.501
38 HD12 ILE 6 1HD1 ILE 6 -5.300 -5.482 2.232
39 HD13 ILE 6 2HD1 ILE 6 -6.974 -5.807 1.723
40 H ALA 7 H ALA 7 -6.042 -0.973 -1.862
41 HA ALA 7 HA ALA 7 -3.610 -0.574 -3.001
42 HB1 ALA 7 1HB ALA 7 -5.256 1.339 -4.192
43 HB2 ALA 7 2HB ALA 7 -5.137 -0.376 -4.650
44 HB3 ALA 7 3HB ALA 7 -6.402 0.157 -3.516
45 H GLY 8 H GLY 8 -5.581 1.758 -1.078
46 HA2 GLY 8 1HA GLY 8 -3.904 3.990 -1.482
47 HA3 GLY 8 2HA GLY 8 -5.074 3.765 -0.198
48 H PHE 9 H PHE 9 -3.791 1.184 0.727
49 HA PHE 9 HA PHE 9 -1.905 2.414 2.485
50 HB3 PHE 9 2HB PHE 9 -2.329 -0.581 2.134
51 HD1 PHE 9 1HD PHE 9 -0.088 -0.079 3.510
52 HD2 PHE 9 2HD PHE 9 -4.027 0.599 4.932
53 HE1 PHE 9 1HE PHE 9 0.746 -0.194 5.875
54 HE2 PHE 9 2HE PHE 9 -3.194 0.484 7.298
55 HZ PHE 9 HZ PHE 9 -0.818 0.088 7.740
56 H ILE 10 H ILE 10 -1.798 0.608 -0.540
57 HA ILE 10 HA ILE 10 0.714 -0.545 -0.318
58 HB ILE 10 HB ILE 10 -0.740 0.521 -2.740
59 HG13 ILE 10 2HG1 ILE 10 -2.154 -1.060 -1.718
60 HG21 ILE 10 1HG2 ILE 10 1.635 0.221 -3.213
61 HG22 ILE 10 2HG2 ILE 10 1.568 -1.436 -2.567
62 HG23 ILE 10 3HG2 ILE 10 0.658 -1.018 -4.038
63 HD11 ILE 10 3HD1 ILE 10 -2.260 -2.803 -3.317
64 HD12 ILE 10 1HD1 ILE 10 -1.402 -1.508 -4.187
65 HD13 ILE 10 2HD1 ILE 10 -0.490 -2.871 -3.494
66 H GLU 11 H GLU 11 -0.298 2.809 -0.753
67 HA GLU 11 HA GLU 11 2.026 3.771 -1.898
68 HB3 GLU 11 2HB GLU 11 1.271 5.983 -0.852
69 HG3 GLU 11 2HG GLU 11 -0.975 4.419 -2.201
70 H ASN 12 H ASN 12 1.372 2.546 1.297
71 HA ASN 12 HA ASN 12 3.831 3.791 2.242
72 HB3 ASN 12 2HB ASN 12 2.208 2.385 4.273
73 HD21 ASN 12 1HD2 ASN 12 2.634 5.699 3.032
74 HD22 ASN 12 2HD2 ASN 12 3.461 6.344 4.410
75 H ALA 13 H ALA 13 1.925 0.788 1.780
76 HA ALA 13 HA ALA 13 3.823 -0.898 3.089
77 HB1 ALA 13 1HB ALA 13 2.211 -2.445 1.387
78 HB2 ALA 13 2HB ALA 13 1.926 -2.110 3.112
79 HB3 ALA 13 3HB ALA 13 1.179 -1.077 1.868
80 H TRP 14 H TRP 14 3.670 0.741 0.063
81 HA TRP 14 HA TRP 14 5.418 -1.241 -1.198
82 HB3 TRP 14 2HB TRP 14 4.100 1.173 -2.446
83 HD1 TRP 14 HD TRP 14 6.492 -1.735 -3.009
84 HE1 TRP 14 1HE TRP 14 7.254 -1.910 -5.529
85 HE3 TRP 14 3HE TRP 14 3.145 1.647 -4.804
86 HZ2 TRP 14 2HZ TRP 14 6.392 -0.643 -7.937
87 HZ3 TRP 14 3HZ TRP 14 3.172 2.120 -7.252
88 HH2 TRP 14 HH TRP 14 4.722 1.038 -8.801
89 H GLU 15 H GLU 15 5.173 2.376 -1.371
90 HA GLU 15 HA GLU 15 7.688 2.955 -1.891
91 HB3 GLU 15 2HB GLU 15 6.265 4.541 0.267
92 HG3 GLU 15 2HG GLU 15 7.058 6.183 -1.860
93 H GLY 16 H GLY 16 6.435 1.825 1.251
94 HA2 GLY 16 1HA GLY 16 8.685 2.465 2.828
95 HA3 GLY 16 2HA GLY 16 7.456 1.265 3.175
96 H MET 17 H MET 17 7.656 -0.642 1.230
97 HA MET 17 HA MET 17 10.012 -1.955 1.985
98 HB3 MET 17 2HB MET 17 7.776 -2.465 -0.027
99 HG3 MET 17 2HG MET 17 10.325 -4.065 0.409
100 HE1 MET 17 3HE MET 17 9.213 -7.473 -1.151
101 HE2 MET 17 1HE MET 17 9.832 -6.038 -2.005
102 HE3 MET 17 2HE MET 17 10.557 -6.534 -0.458
103 H ILE 18 H ILE 18 9.482 0.502 -0.292
104 HA ILE 18 HA ILE 18 11.527 -0.501 -2.116
105 HB ILE 18 HB ILE 18 9.694 1.893 -2.293
106 HG13 ILE 18 2HG1 ILE 18 8.246 0.662 -3.580
107 HG21 ILE 18 1HG2 ILE 18 11.637 2.429 -3.528
108 HG22 ILE 18 2HG2 ILE 18 11.765 0.784 -4.196
109 HG23 ILE 18 3HG2 ILE 18 10.441 1.856 -4.715
110 HD11 ILE 18 3HD1 ILE 18 8.947 -1.613 -4.561
111 HD12 ILE 18 1HD1 ILE 18 9.690 -0.177 -5.304
112 HD13 ILE 18 2HD1 ILE 18 10.618 -1.160 -4.147
113 H ASP 19 H ASP 19 10.922 1.801 0.496
114 HA ASP 19 HA ASP 19 12.147 3.342 1.429
115 HB3 ASP 19 2HB ASP 19 14.414 1.453 0.639
116 H GLY 20 H GLY 20 11.632 4.766 -0.561
117 HA2 GLY 20 1HA GLY 20 13.766 6.284 -1.372
118 HA3 GLY 20 2HA GLY 20 13.609 5.054 -2.609
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -14.797 -4.078 0.827
2 HA2 GLY 1 1HA GLY 1 -14.351 -1.891 0.563
3 HA3 GLY 1 2HA GLY 1 -14.885 -1.638 2.213
4 H LEU 2 H LEU 2 -12.819 -3.631 3.266
5 HA LEU 2 HA LEU 2 -10.734 -1.708 3.595
6 HB2 LEU 2 1HB LEU 2 -11.766 -3.530 5.213
7 HB3 LEU 2 2HB LEU 2 -10.513 -4.538 4.515
8 HG LEU 2 HG LEU 2 -9.026 -2.373 5.150
9 HD11 LEU 2 1HD1 LEU 2 -11.344 -1.536 6.208
10 HD12 LEU 2 2HD1 LEU 2 -10.707 -2.449 7.597
11 HD13 LEU 2 3HD1 LEU 2 -9.753 -1.122 6.891
12 HD21 LEU 2 3HD2 LEU 2 -9.533 -4.996 6.268
13 HD22 LEU 2 1HD2 LEU 2 -8.007 -4.090 6.123
14 HD23 LEU 2 2HD2 LEU 2 -9.062 -3.836 7.534
15 H PHE 3 H PHE 3 -11.036 -4.976 2.055
16 HA PHE 3 HA PHE 3 -8.430 -5.180 1.190
17 HB2 PHE 3 1HB PHE 3 -10.791 -6.617 1.059
18 HB3 PHE 3 2HB PHE 3 -10.707 -6.055 -0.599
19 HD1 PHE 3 2HD PHE 3 -7.937 -7.095 1.664
20 HD2 PHE 3 1HD PHE 3 -10.180 -7.951 -1.835
21 HE1 PHE 3 2HE PHE 3 -6.358 -8.967 1.110
22 HE2 PHE 3 1HE PHE 3 -8.601 -9.823 -2.389
23 HZ PHE 3 HZ PHE 3 -6.709 -10.308 -0.910
24 H GLY 4 H GLY 4 -11.011 -3.076 0.077
25 HA2 GLY 4 1HA GLY 4 -9.782 -2.621 -2.522
26 HA3 GLY 4 2HA GLY 4 -11.255 -1.910 -1.892
27 H ALA 5 H ALA 5 -9.693 -1.347 0.763
28 HA ALA 5 HA ALA 5 -8.811 1.265 -0.073
29 HB1 ALA 5 1HB ALA 5 -8.958 1.814 2.195
30 HB2 ALA 5 2HB ALA 5 -10.199 0.547 2.036
31 HB3 ALA 5 3HB ALA 5 -8.606 0.152 2.725
32 H ILE 6 H ILE 6 -7.449 -1.888 0.755
33 HA ILE 6 HA ILE 6 -4.968 -1.286 1.649
34 HB ILE 6 HB ILE 6 -5.733 -3.397 -0.373
35 HG12 ILE 6 1HG1 ILE 6 -5.900 -3.282 2.639
36 HG13 ILE 6 2HG1 ILE 6 -7.165 -3.662 1.487
37 HG21 ILE 6 1HG2 ILE 6 -3.791 -4.626 0.408
38 HG22 ILE 6 2HG2 ILE 6 -3.300 -3.041 -0.236
39 HG23 ILE 6 3HG2 ILE 6 -3.369 -3.304 1.523
40 HD11 ILE 6 3HD1 ILE 6 -5.768 -5.706 0.795
41 HD12 ILE 6 1HD1 ILE 6 -4.747 -5.365 2.213
42 HD13 ILE 6 2HD1 ILE 6 -6.469 -5.761 2.430
43 H ALA 7 H ALA 7 -6.168 -1.142 -1.751
44 HA ALA 7 HA ALA 7 -3.841 -0.692 -3.074
45 HB1 ALA 7 1HB ALA 7 -5.312 0.735 -4.604
46 HB2 ALA 7 2HB ALA 7 -5.902 -0.910 -4.265
47 HB3 ALA 7 3HB ALA 7 -6.620 0.484 -3.422
48 H GLY 8 H GLY 8 -5.792 1.646 -1.137
49 HA2 GLY 8 1HA GLY 8 -4.257 3.927 -1.767
50 HA3 GLY 8 2HA GLY 8 -5.325 3.717 -0.394
51 H PHE 9 H PHE 9 -3.857 1.249 0.564
52 HA PHE 9 HA PHE 9 -1.922 2.655 2.123
53 HB2 PHE 9 1HB PHE 9 -3.585 0.401 2.339
54 HB3 PHE 9 2HB PHE 9 -2.020 -0.343 2.082
55 HD1 PHE 9 2HD PHE 9 -0.265 1.579 3.534
56 HD2 PHE 9 1HD PHE 9 -4.038 -0.056 4.580
57 HE1 PHE 9 2HE PHE 9 0.277 1.883 5.965
58 HE2 PHE 9 1HE PHE 9 -3.496 0.247 7.012
59 HZ PHE 9 HZ PHE 9 -1.344 1.214 7.676
60 H ILE 10 H ILE 10 -1.929 0.698 -0.807
61 HA ILE 10 HA ILE 10 0.646 -0.326 -0.703
62 HB ILE 10 HB ILE 10 -1.017 0.543 -3.069
63 HG12 ILE 10 1HG1 ILE 10 -0.875 -2.004 -1.460
64 HG13 ILE 10 2HG1 ILE 10 -2.281 -1.043 -1.874
65 HG21 ILE 10 1HG2 ILE 10 1.334 0.326 -3.688
66 HG22 ILE 10 2HG2 ILE 10 1.389 -1.297 -2.959
67 HG23 ILE 10 3HG2 ILE 10 0.364 -0.995 -4.382
68 HD11 ILE 10 3HD1 ILE 10 -0.584 -2.703 -3.791
69 HD12 ILE 10 1HD1 ILE 10 -2.265 -3.017 -3.297
70 HD13 ILE 10 2HD1 ILE 10 -1.886 -1.607 -4.313
71 H GLU 11 H GLU 11 -0.556 2.951 -1.233
72 HA GLU 11 HA GLU 11 1.637 3.956 -2.583
73 HB2 GLU 11 1HB GLU 11 -0.786 4.944 -1.498
74 HB3 GLU 11 2HB GLU 11 0.471 5.895 -0.730
75 HG2 GLU 11 1HG GLU 11 0.611 5.420 -3.717
76 HG3 GLU 11 2HG GLU 11 -0.513 6.614 -3.099
77 H ASN 12 H ASN 12 1.259 2.872 0.706
78 HA ASN 12 HA ASN 12 3.711 4.277 1.415
79 HB2 ASN 12 1HB ASN 12 1.983 2.866 3.464
80 HB3 ASN 12 2HB ASN 12 2.998 4.279 3.675
81 HD21 ASN 12 1HD2 ASN 12 1.899 6.028 4.065
82 HD22 ASN 12 2HD2 ASN 12 0.373 6.493 3.389
83 H ALA 13 H ALA 13 1.928 1.170 1.237
84 HA ALA 13 HA ALA 13 3.990 -0.356 2.494
85 HB1 ALA 13 1HB ALA 13 2.105 -1.797 0.761
86 HB2 ALA 13 2HB ALA 13 2.388 -1.947 2.512
87 HB3 ALA 13 3HB ALA 13 1.293 -0.688 1.892
88 H TRP 14 H TRP 14 3.555 1.112 -0.592
89 HA TRP 14 HA TRP 14 5.310 -0.854 -1.871
90 HB2 TRP 14 1HB TRP 14 3.136 -0.183 -2.944
91 HB3 TRP 14 2HB TRP 14 3.795 1.429 -3.142
92 HD1 TRP 14 HD TRP 14 6.282 -1.392 -3.727
93 HE1 TRP 14 1HE TRP 14 6.881 -1.666 -6.282
94 HE3 TRP 14 3HE TRP 14 2.661 1.733 -5.451
95 HZ2 TRP 14 2HZ TRP 14 5.798 -0.569 -8.683
96 HZ3 TRP 14 3HZ TRP 14 2.500 2.077 -7.915
97 HH2 TRP 14 HH TRP 14 3.994 0.985 -9.512
98 H GLU 15 H GLU 15 4.877 2.735 -2.206
99 HA GLU 15 HA GLU 15 7.320 3.399 -2.928
100 HB2 GLU 15 1HB GLU 15 5.109 4.774 -2.002
101 HB3 GLU 15 2HB GLU 15 6.298 5.185 -0.782
102 HG2 GLU 15 1HG GLU 15 6.617 6.859 -2.425
103 HG3 GLU 15 2HG GLU 15 7.899 5.716 -2.773
104 H GLY 16 H GLY 16 6.301 2.609 0.432
105 HA2 GLY 16 1HA GLY 16 8.719 3.326 1.701
106 HA3 GLY 16 2HA GLY 16 7.481 2.247 2.313
107 H MET 17 H MET 17 7.444 0.173 0.422
108 HA MET 17 HA MET 17 9.697 -1.263 1.238
109 HB2 MET 17 1HB MET 17 7.219 -1.671 -0.340
110 HB3 MET 17 2HB MET 17 8.553 -2.616 -0.972
111 HG2 MET 17 1HG MET 17 7.491 -4.011 0.676
112 HG3 MET 17 2HG MET 17 8.975 -3.447 1.419
113 HE1 MET 17 3HE MET 17 8.037 -2.510 4.546
114 HE2 MET 17 1HE MET 17 7.070 -3.958 4.173
115 HE3 MET 17 2HE MET 17 8.686 -3.758 3.454
116 H ILE 18 H ILE 18 9.359 1.108 -1.164
117 HA ILE 18 HA ILE 18 11.293 -0.136 -2.952
118 HB ILE 18 HB ILE 18 9.634 2.378 -3.142
119 HG12 ILE 18 1HG1 ILE 18 9.496 -0.122 -4.841
120 HG13 ILE 18 2HG1 ILE 18 8.533 0.090 -3.391
121 HG21 ILE 18 1HG2 ILE 18 11.115 3.158 -4.602
122 HG22 ILE 18 2HG2 ILE 18 12.071 1.658 -4.529
123 HG23 ILE 18 3HG2 ILE 18 10.702 1.786 -5.660
124 HD11 ILE 18 3HD1 ILE 18 7.245 1.810 -4.314
125 HD12 ILE 18 1HD1 ILE 18 8.530 2.303 -5.444
126 HD13 ILE 18 2HD1 ILE 18 7.583 0.831 -5.763
127 H ASP 19 H ASP 19 10.957 2.314 -0.417
128 HA ASP 19 HA ASP 19 13.716 3.083 -0.939
129 HB2 ASP 19 1HB ASP 19 13.254 5.142 0.251
130 HB3 ASP 19 2HB ASP 19 11.963 4.905 -0.910
131 H GLY 20 H GLY 20 14.148 4.219 1.719
132 HA2 GLY 20 1HA GLY 20 14.824 1.861 3.170
133 HA3 GLY 20 2HA GLY 20 15.030 3.525 3.678
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -14.790 -3.993 2.625
2 HA2 GLY 1 1HA GLY 1 -14.328 -1.930 0.592
3 HA3 GLY 1 2HA GLY 1 -14.853 -1.690 2.246
4 H LEU 2 H LEU 2 -12.774 -3.681 3.275
5 HA LEU 2 HA LEU 2 -10.695 -1.752 3.606
6 HB2 LEU 2 1HB LEU 2 -11.711 -3.590 5.216
7 HB3 LEU 2 2HB LEU 2 -10.458 -4.589 4.505
8 HG LEU 2 HG LEU 2 -8.900 -2.545 5.141
9 HD11 LEU 2 1HD1 LEU 2 -10.772 -2.279 7.454
10 HD12 LEU 2 2HD1 LEU 2 -9.568 -1.136 6.811
11 HD13 LEU 2 3HD1 LEU 2 -11.118 -1.364 5.967
12 HD21 LEU 2 3HD2 LEU 2 -9.775 -4.956 6.574
13 HD22 LEU 2 1HD2 LEU 2 -8.139 -4.361 6.205
14 HD23 LEU 2 2HD2 LEU 2 -9.022 -3.722 7.612
15 H PHE 3 H PHE 3 -10.992 -5.012 2.045
16 HA PHE 3 HA PHE 3 -8.390 -5.200 1.165
17 HB2 PHE 3 1HB PHE 3 -10.747 -6.645 1.037
18 HB3 PHE 3 2HB PHE 3 -10.673 -6.071 -0.618
19 HD1 PHE 3 1HD PHE 3 -8.781 -6.734 -2.074
20 HD2 PHE 3 2HD PHE 3 -9.249 -8.338 1.825
21 HE1 PHE 3 1HE PHE 3 -7.199 -8.594 -2.650
22 HE2 PHE 3 2HE PHE 3 -7.667 -10.199 1.251
23 HZ PHE 3 HZ PHE 3 -6.660 -10.305 -0.981
24 H GLY 4 H GLY 4 -10.985 -3.099 0.080
25 HA2 GLY 4 1HA GLY 4 -9.771 -2.620 -2.522
26 HA3 GLY 4 2HA GLY 4 -11.244 -1.921 -1.879
27 H ALA 5 H ALA 5 -9.668 -1.371 0.770
28 HA ALA 5 HA ALA 5 -8.804 1.252 -0.051
29 HB1 ALA 5 1HB ALA 5 -10.193 0.870 1.972
30 HB2 ALA 5 2HB ALA 5 -8.874 -0.093 2.681
31 HB3 ALA 5 3HB ALA 5 -8.639 1.643 2.368
32 H ILE 6 H ILE 6 -7.425 -1.902 0.749
33 HA ILE 6 HA ILE 6 -4.942 -1.294 1.637
34 HB ILE 6 HB ILE 6 -5.707 -3.393 -0.396
35 HG12 ILE 6 1HG1 ILE 6 -5.862 -3.300 2.617
36 HG13 ILE 6 2HG1 ILE 6 -7.129 -3.678 1.467
37 HG21 ILE 6 1HG2 ILE 6 -3.344 -3.329 1.500
38 HG22 ILE 6 2HG2 ILE 6 -3.754 -4.614 0.338
39 HG23 ILE 6 3HG2 ILE 6 -3.267 -3.005 -0.249
40 HD11 ILE 6 3HD1 ILE 6 -5.866 -5.743 0.783
41 HD12 ILE 6 1HD1 ILE 6 -4.653 -5.372 2.032
42 HD13 ILE 6 2HD1 ILE 6 -6.328 -5.752 2.502
43 H ALA 7 H ALA 7 -6.158 -1.131 -1.756
44 HA ALA 7 HA ALA 7 -3.838 -0.661 -3.086
45 HB1 ALA 7 1HB ALA 7 -6.215 1.053 -3.725
46 HB2 ALA 7 2HB ALA 7 -5.206 0.055 -4.801
47 HB3 ALA 7 3HB ALA 7 -6.426 -0.714 -3.758
48 H GLY 8 H GLY 8 -5.791 1.655 -1.125
49 HA2 GLY 8 1HA GLY 8 -4.270 3.948 -1.745
50 HA3 GLY 8 2HA GLY 8 -5.334 3.723 -0.370
51 H PHE 9 H PHE 9 -3.850 1.255 0.566
52 HA PHE 9 HA PHE 9 -1.914 2.660 2.128
53 HB2 PHE 9 1HB PHE 9 -3.474 0.758 2.865
54 HB3 PHE 9 2HB PHE 9 -2.594 -0.326 1.807
55 HD1 PHE 9 2HD PHE 9 -1.744 2.165 4.468
56 HD2 PHE 9 1HD PHE 9 -1.102 -1.712 2.865
57 HE1 PHE 9 2HE PHE 9 -0.130 1.664 6.325
58 HE2 PHE 9 1HE PHE 9 0.511 -2.212 4.721
59 HZ PHE 9 HZ PHE 9 0.978 -0.519 6.429
60 H ILE 10 H ILE 10 -1.924 0.723 -0.816
61 HA ILE 10 HA ILE 10 0.657 -0.289 -0.730
62 HB ILE 10 HB ILE 10 -1.020 0.589 -3.083
63 HG12 ILE 10 1HG1 ILE 10 -0.858 -1.970 -1.494
64 HG13 ILE 10 2HG1 ILE 10 -2.271 -1.013 -1.894
65 HG21 ILE 10 1HG2 ILE 10 1.326 0.388 -3.716
66 HG22 ILE 10 2HG2 ILE 10 1.397 -1.238 -2.994
67 HG23 ILE 10 3HG2 ILE 10 0.363 -0.937 -4.411
68 HD11 ILE 10 3HD1 ILE 10 -2.321 -2.913 -3.363
69 HD12 ILE 10 1HD1 ILE 10 -1.788 -1.542 -4.365
70 HD13 ILE 10 2HD1 ILE 10 -0.600 -2.728 -3.774
71 H GLU 11 H GLU 11 -0.563 2.986 -1.233
72 HA GLU 11 HA GLU 11 1.619 4.011 -2.583
73 HB2 GLU 11 1HB GLU 11 -0.627 5.107 -0.939
74 HB3 GLU 11 2HB GLU 11 0.752 6.167 -1.155
75 HG2 GLU 11 1HG GLU 11 0.560 5.502 -3.704
76 HG3 GLU 11 2HG GLU 11 -1.056 4.972 -3.280
77 H ASN 12 H ASN 12 1.259 2.902 0.700
78 HA ASN 12 HA ASN 12 3.707 4.313 1.410
79 HB2 ASN 12 1HB ASN 12 1.323 3.339 2.999
80 HB3 ASN 12 2HB ASN 12 2.877 3.384 3.808
81 HD21 ASN 12 1HD2 ASN 12 4.163 5.460 3.351
82 HD22 ASN 12 2HD2 ASN 12 3.302 6.955 3.519
83 H ALA 13 H ALA 13 1.939 1.200 1.216
84 HA ALA 13 HA ALA 13 4.012 -0.325 2.454
85 HB1 ALA 13 1HB ALA 13 1.329 -0.675 1.934
86 HB2 ALA 13 2HB ALA 13 2.081 -1.709 0.695
87 HB3 ALA 13 3HB ALA 13 2.451 -1.970 2.417
88 H TRP 14 H TRP 14 3.559 1.162 -0.620
89 HA TRP 14 HA TRP 14 5.318 -0.785 -1.919
90 HB2 TRP 14 1HB TRP 14 3.137 -0.118 -2.978
91 HB3 TRP 14 2HB TRP 14 3.787 1.499 -3.169
92 HD1 TRP 14 HD TRP 14 6.286 -1.307 -3.782
93 HE1 TRP 14 1HE TRP 14 6.876 -1.560 -6.341
94 HE3 TRP 14 3HE TRP 14 2.643 1.813 -5.471
95 HZ2 TRP 14 2HZ TRP 14 5.779 -0.452 -8.732
96 HZ3 TRP 14 3HZ TRP 14 2.472 2.174 -7.931
97 HH2 TRP 14 HH TRP 14 3.965 1.101 -9.542
98 H GLU 15 H GLU 15 4.867 2.802 -2.227
99 HA GLU 15 HA GLU 15 7.304 3.484 -2.954
100 HB2 GLU 15 1HB GLU 15 5.504 4.906 -0.951
101 HB3 GLU 15 2HB GLU 15 6.935 5.654 -1.633
102 HG2 GLU 15 1HG GLU 15 6.046 5.455 -3.904
103 HG3 GLU 15 2HG GLU 15 4.699 4.480 -3.347
104 H GLY 16 H GLY 16 6.297 2.728 0.425
105 HA2 GLY 16 1HA GLY 16 8.769 3.401 1.634
106 HA3 GLY 16 2HA GLY 16 7.490 2.411 2.308
107 H MET 17 H MET 17 7.324 0.294 0.435
108 HA MET 17 HA MET 17 9.478 -1.256 1.300
109 HB2 MET 17 1HB MET 17 7.125 -1.559 -0.581
110 HB3 MET 17 2HB MET 17 8.393 -2.763 -0.695
111 HG2 MET 17 1HG MET 17 7.236 -2.033 2.018
112 HG3 MET 17 2HG MET 17 6.388 -3.159 0.977
113 HE1 MET 17 3HE MET 17 6.889 -5.431 0.600
114 HE2 MET 17 1HE MET 17 8.309 -5.093 -0.419
115 HE3 MET 17 2HE MET 17 8.422 -6.286 0.896
116 H ILE 18 H ILE 18 9.313 1.092 -1.142
117 HA ILE 18 HA ILE 18 11.193 -0.293 -2.884
118 HB ILE 18 HB ILE 18 9.559 2.220 -3.114
119 HG12 ILE 18 1HG1 ILE 18 9.642 -0.435 -4.554
120 HG13 ILE 18 2HG1 ILE 18 8.313 0.278 -3.662
121 HG21 ILE 18 1HG2 ILE 18 11.817 2.717 -3.959
122 HG22 ILE 18 2HG2 ILE 18 11.713 1.307 -5.041
123 HG23 ILE 18 3HG2 ILE 18 10.601 2.680 -5.259
124 HD11 ILE 18 3HD1 ILE 18 9.373 1.013 -6.395
125 HD12 ILE 18 1HD1 ILE 18 7.693 0.740 -5.875
126 HD13 ILE 18 2HD1 ILE 18 8.531 2.245 -5.425
127 H ASP 19 H ASP 19 10.940 2.323 -0.478
128 HA ASP 19 HA ASP 19 13.738 2.927 -0.969
129 HB2 ASP 19 1HB ASP 19 13.367 4.998 0.183
130 HB3 ASP 19 2HB ASP 19 11.981 4.780 -0.865
131 H GLY 20 H GLY 20 14.116 4.055 1.756
132 HA2 GLY 20 1HA GLY 20 14.439 1.535 3.217
133 HA3 GLY 20 2HA GLY 20 15.266 3.050 3.518
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -13.805 -4.402 1.293
2 HA2 GLY 1 1HA GLY 1 -14.297 -2.067 0.451
3 HA3 GLY 1 2HA GLY 1 -14.866 -1.760 2.081
4 H LEU 2 H LEU 2 -12.780 -3.666 3.247
5 HA LEU 2 HA LEU 2 -10.741 -1.687 3.537
6 HB2 LEU 2 1HB LEU 2 -11.764 -3.467 5.206
7 HB3 LEU 2 2HB LEU 2 -10.477 -4.474 4.571
8 HG LEU 2 HG LEU 2 -9.139 -2.135 5.159
9 HD11 LEU 2 1HD1 LEU 2 -11.567 -1.818 6.448
10 HD12 LEU 2 2HD1 LEU 2 -10.497 -2.445 7.725
11 HD13 LEU 2 3HD1 LEU 2 -10.047 -0.973 6.830
12 HD21 LEU 2 3HD2 LEU 2 -8.310 -3.401 7.160
13 HD22 LEU 2 1HD2 LEU 2 -9.536 -4.642 6.806
14 HD23 LEU 2 2HD2 LEU 2 -8.250 -4.299 5.625
15 H PHE 3 H PHE 3 -10.947 -5.019 2.122
16 HA PHE 3 HA PHE 3 -8.322 -5.203 1.311
17 HB2 PHE 3 1HB PHE 3 -10.651 -6.692 1.196
18 HB3 PHE 3 2HB PHE 3 -10.547 -6.194 -0.482
19 HD1 PHE 3 2HD PHE 3 -7.850 -7.143 1.915
20 HD2 PHE 3 1HD PHE 3 -9.907 -8.069 -1.680
21 HE1 PHE 3 2HE PHE 3 -6.225 -9.001 1.464
22 HE2 PHE 3 1HE PHE 3 -8.281 -9.926 -2.131
23 HZ PHE 3 HZ PHE 3 -6.459 -10.370 -0.554
24 H GLY 4 H GLY 4 -10.924 -3.198 0.071
25 HA2 GLY 4 1HA GLY 4 -9.658 -2.818 -2.522
26 HA3 GLY 4 2HA GLY 4 -11.156 -2.115 -1.946
27 H ALA 5 H ALA 5 -9.654 -1.417 0.711
28 HA ALA 5 HA ALA 5 -8.811 1.179 -0.212
29 HB1 ALA 5 1HB ALA 5 -8.387 0.599 2.617
30 HB2 ALA 5 2HB ALA 5 -9.465 1.793 1.854
31 HB3 ALA 5 3HB ALA 5 -10.018 0.118 2.091
32 H ILE 6 H ILE 6 -7.401 -1.910 0.764
33 HA ILE 6 HA ILE 6 -4.949 -1.221 1.679
34 HB ILE 6 HB ILE 6 -5.633 -3.425 -0.270
35 HG12 ILE 6 1HG1 ILE 6 -5.859 -3.195 2.730
36 HG13 ILE 6 2HG1 ILE 6 -7.094 -3.648 1.572
37 HG21 ILE 6 1HG2 ILE 6 -3.403 -3.529 1.741
38 HG22 ILE 6 2HG2 ILE 6 -3.646 -4.489 0.263
39 HG23 ILE 6 3HG2 ILE 6 -3.151 -2.783 0.145
40 HD11 ILE 6 3HD1 ILE 6 -6.185 -5.620 2.811
41 HD12 ILE 6 1HD1 ILE 6 -5.911 -5.749 1.057
42 HD13 ILE 6 2HD1 ILE 6 -4.574 -5.279 2.135
43 H ALA 7 H ALA 7 -6.087 -1.235 -1.745
44 HA ALA 7 HA ALA 7 -3.746 -0.789 -3.042
45 HB1 ALA 7 1HB ALA 7 -5.353 0.736 -4.519
46 HB2 ALA 7 2HB ALA 7 -5.581 -1.026 -4.432
47 HB3 ALA 7 3HB ALA 7 -6.601 0.052 -3.451
48 H GLY 8 H GLY 8 -5.781 1.583 -1.237
49 HA2 GLY 8 1HA GLY 8 -4.281 3.869 -1.929
50 HA3 GLY 8 2HA GLY 8 -5.372 3.690 -0.569
51 H PHE 9 H PHE 9 -3.873 1.295 0.515
52 HA PHE 9 HA PHE 9 -1.996 2.802 2.052
53 HB2 PHE 9 1HB PHE 9 -3.557 0.894 2.815
54 HB3 PHE 9 2HB PHE 9 -2.587 -0.213 1.863
55 HD1 PHE 9 1HD PHE 9 -1.666 2.551 4.206
56 HD2 PHE 9 2HD PHE 9 -1.395 -1.582 3.280
57 HE1 PHE 9 1HE PHE 9 -0.131 2.213 6.163
58 HE2 PHE 9 2HE PHE 9 0.141 -1.920 5.236
59 HZ PHE 9 HZ PHE 9 0.755 -0.018 6.654
60 H ILE 10 H ILE 10 -1.907 0.731 -0.797
61 HA ILE 10 HA ILE 10 0.686 -0.232 -0.606
62 HB ILE 10 HB ILE 10 -0.950 0.506 -3.035
63 HG12 ILE 10 1HG1 ILE 10 -0.784 -1.972 -1.325
64 HG13 ILE 10 2HG1 ILE 10 -2.202 -1.059 -1.801
65 HG21 ILE 10 1HG2 ILE 10 1.421 0.316 -3.596
66 HG22 ILE 10 2HG2 ILE 10 1.490 -1.280 -2.810
67 HG23 ILE 10 3HG2 ILE 10 0.489 -1.046 -4.263
68 HD11 ILE 10 3HD1 ILE 10 -1.736 -1.705 -4.213
69 HD12 ILE 10 1HD1 ILE 10 -0.438 -2.766 -3.611
70 HD13 ILE 10 2HD1 ILE 10 -2.128 -3.078 -3.149
71 H GLU 11 H GLU 11 -0.573 2.995 -1.288
72 HA GLU 11 HA GLU 11 1.624 3.993 -2.635
73 HB2 GLU 11 1HB GLU 11 -0.383 5.374 -0.802
74 HB3 GLU 11 2HB GLU 11 0.768 6.236 -1.806
75 HG2 GLU 11 1HG GLU 11 -0.258 5.533 -3.825
76 HG3 GLU 11 2HG GLU 11 -1.031 4.154 -3.072
77 H ASN 12 H ASN 12 1.205 3.031 0.687
78 HA ASN 12 HA ASN 12 3.614 4.515 1.385
79 HB2 ASN 12 1HB ASN 12 1.190 3.614 2.943
80 HB3 ASN 12 2HB ASN 12 2.719 3.643 3.801
81 HD21 ASN 12 1HD2 ASN 12 0.440 5.538 1.904
82 HD22 ASN 12 2HD2 ASN 12 0.873 7.104 2.507
83 H ALA 13 H ALA 13 1.899 1.366 1.296
84 HA ALA 13 HA ALA 13 3.968 -0.065 2.651
85 HB1 ALA 13 1HB ALA 13 2.561 -1.918 2.380
86 HB2 ALA 13 2HB ALA 13 1.406 -0.563 2.416
87 HB3 ALA 13 3HB ALA 13 1.869 -1.297 0.862
88 H TRP 14 H TRP 14 3.562 1.271 -0.499
89 HA TRP 14 HA TRP 14 5.381 -0.705 -1.666
90 HB2 TRP 14 1HB TRP 14 3.215 -0.124 -2.804
91 HB3 TRP 14 2HB TRP 14 3.844 1.493 -3.055
92 HD1 TRP 14 HD TRP 14 6.401 -1.296 -3.480
93 HE1 TRP 14 1HE TRP 14 7.055 -1.657 -6.011
94 HE3 TRP 14 3HE TRP 14 2.749 1.681 -5.394
95 HZ2 TRP 14 2HZ TRP 14 5.996 -0.679 -8.474
96 HZ3 TRP 14 3HZ TRP 14 2.629 1.924 -7.872
97 HH2 TRP 14 HH TRP 14 4.176 0.803 -9.397
98 H GLU 15 H GLU 15 4.880 2.857 -2.151
99 HA GLU 15 HA GLU 15 7.323 3.545 -2.854
100 HB2 GLU 15 1HB GLU 15 6.794 5.759 -2.234
101 HB3 GLU 15 2HB GLU 15 5.221 5.007 -2.414
102 HG2 GLU 15 1HG GLU 15 5.151 4.590 0.062
103 HG3 GLU 15 2HG GLU 15 6.709 5.374 0.230
104 H GLY 16 H GLY 16 6.281 2.715 0.468
105 HA2 GLY 16 1HA GLY 16 8.674 3.573 1.756
106 HA3 GLY 16 2HA GLY 16 7.423 2.529 2.406
107 H MET 17 H MET 17 7.387 0.350 0.666
108 HA MET 17 HA MET 17 9.638 -1.039 1.555
109 HB2 MET 17 1HB MET 17 7.227 -1.538 -0.171
110 HB3 MET 17 2HB MET 17 8.572 -2.628 -0.441
111 HG2 MET 17 1HG MET 17 8.534 -2.683 2.283
112 HG3 MET 17 2HG MET 17 6.845 -2.308 1.998
113 HE1 MET 17 3HE MET 17 9.509 -5.249 1.955
114 HE2 MET 17 1HE MET 17 9.116 -5.951 0.367
115 HE3 MET 17 2HE MET 17 9.712 -4.278 0.477
116 H ILE 18 H ILE 18 9.305 1.188 -0.981
117 HA ILE 18 HA ILE 18 11.258 -0.163 -2.675
118 HB ILE 18 HB ILE 18 9.513 2.266 -3.055
119 HG12 ILE 18 1HG1 ILE 18 9.567 -0.429 -4.447
120 HG13 ILE 18 2HG1 ILE 18 8.407 0.064 -3.228
121 HG21 ILE 18 1HG2 ILE 18 11.949 1.408 -4.508
122 HG22 ILE 18 2HG2 ILE 18 10.545 1.849 -5.510
123 HG23 ILE 18 3HG2 ILE 18 11.208 3.018 -4.342
124 HD11 ILE 18 3HD1 ILE 18 7.157 1.138 -4.778
125 HD12 ILE 18 1HD1 ILE 18 8.558 2.111 -5.287
126 HD13 ILE 18 2HD1 ILE 18 8.262 0.521 -6.030
127 H ASP 19 H ASP 19 10.804 2.623 -0.483
128 HA ASP 19 HA ASP 19 13.289 3.773 -1.159
129 HB2 ASP 19 1HB ASP 19 11.103 4.744 0.050
130 HB3 ASP 19 2HB ASP 19 11.929 4.221 1.505
131 H GLY 20 H GLY 20 11.964 2.013 1.752
132 HA2 GLY 20 1HA GLY 20 12.972 0.497 3.108
133 HA3 GLY 20 2HA GLY 20 14.431 0.589 2.141
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -13.973 -4.449 1.094
2 HA2 GLY 1 1HA GLY 1 -14.337 -2.160 0.327
3 HA3 GLY 1 2HA GLY 1 -14.944 -1.780 1.926
4 H LEU 2 H LEU 2 -12.869 -3.609 3.229
5 HA LEU 2 HA LEU 2 -10.853 -1.601 3.465
6 HB2 LEU 2 1HB LEU 2 -11.897 -3.307 5.196
7 HB3 LEU 2 2HB LEU 2 -10.590 -4.332 4.638
8 HG LEU 2 HG LEU 2 -8.968 -2.530 5.241
9 HD11 LEU 2 1HD1 LEU 2 -10.606 -1.073 7.086
10 HD12 LEU 2 2HD1 LEU 2 -9.627 -0.470 5.727
11 HD13 LEU 2 3HD1 LEU 2 -11.317 -0.960 5.457
12 HD21 LEU 2 3HD2 LEU 2 -9.204 -4.331 6.766
13 HD22 LEU 2 1HD2 LEU 2 -9.222 -2.837 7.733
14 HD23 LEU 2 2HD2 LEU 2 -10.744 -3.695 7.393
15 H PHE 3 H PHE 3 -11.002 -4.999 2.209
16 HA PHE 3 HA PHE 3 -8.359 -5.197 1.464
17 HB2 PHE 3 1HB PHE 3 -10.672 -6.712 1.372
18 HB3 PHE 3 2HB PHE 3 -10.537 -6.293 -0.325
19 HD1 PHE 3 2HD PHE 3 -8.106 -6.680 -1.344
20 HD2 PHE 3 1HD PHE 3 -9.634 -8.639 2.096
21 HE1 PHE 3 2HE PHE 3 -6.456 -8.542 -1.671
22 HE2 PHE 3 1HE PHE 3 -7.983 -10.502 1.768
23 HZ PHE 3 HZ PHE 3 -6.414 -10.431 -0.111
24 H GLY 4 H GLY 4 -10.950 -3.279 0.073
25 HA2 GLY 4 1HA GLY 4 -9.631 -3.013 -2.507
26 HA3 GLY 4 2HA GLY 4 -11.147 -2.298 -1.999
27 H ALA 5 H ALA 5 -9.708 -1.459 0.653
28 HA ALA 5 HA ALA 5 -8.869 1.100 -0.375
29 HB1 ALA 5 1HB ALA 5 -8.971 1.795 1.911
30 HB2 ALA 5 2HB ALA 5 -10.346 0.690 1.669
31 HB3 ALA 5 3HB ALA 5 -8.879 0.118 2.500
32 H ILE 6 H ILE 6 -7.453 -1.926 0.777
33 HA ILE 6 HA ILE 6 -5.029 -1.169 1.711
34 HB ILE 6 HB ILE 6 -5.649 -3.469 -0.146
35 HG12 ILE 6 1HG1 ILE 6 -5.944 -3.101 2.835
36 HG13 ILE 6 2HG1 ILE 6 -7.149 -3.620 1.672
37 HG21 ILE 6 1HG2 ILE 6 -3.655 -4.460 0.420
38 HG22 ILE 6 2HG2 ILE 6 -3.175 -2.747 0.348
39 HG23 ILE 6 3HG2 ILE 6 -3.482 -3.520 1.922
40 HD11 ILE 6 3HD1 ILE 6 -4.797 -5.174 2.779
41 HD12 ILE 6 1HD1 ILE 6 -6.509 -5.649 2.683
42 HD13 ILE 6 2HD1 ILE 6 -5.509 -5.627 1.212
43 H ALA 7 H ALA 7 -6.090 -1.358 -1.732
44 HA ALA 7 HA ALA 7 -3.724 -0.949 -2.998
45 HB1 ALA 7 1HB ALA 7 -5.037 -0.509 -4.824
46 HB2 ALA 7 2HB ALA 7 -6.319 -1.093 -3.737
47 HB3 ALA 7 3HB ALA 7 -6.058 0.655 -3.945
48 H GLY 8 H GLY 8 -5.821 1.481 -1.349
49 HA2 GLY 8 1HA GLY 8 -4.331 3.751 -2.118
50 HA3 GLY 8 2HA GLY 8 -5.448 3.624 -0.775
51 H PHE 9 H PHE 9 -3.950 1.299 0.454
52 HA PHE 9 HA PHE 9 -2.122 2.898 1.957
53 HB2 PHE 9 1HB PHE 9 -3.737 0.655 2.343
54 HB3 PHE 9 2HB PHE 9 -2.172 -0.108 2.143
55 HD1 PHE 9 1HD PHE 9 -4.187 2.086 4.267
56 HD2 PHE 9 2HD PHE 9 -0.420 0.189 3.796
57 HE1 PHE 9 1HE PHE 9 -3.645 2.566 6.670
58 HE2 PHE 9 2HE PHE 9 0.121 0.669 6.200
59 HZ PHE 9 HZ PHE 9 -1.497 1.852 7.608
60 H ILE 10 H ILE 10 -1.949 0.696 -0.787
61 HA ILE 10 HA ILE 10 0.647 -0.229 -0.494
62 HB ILE 10 HB ILE 10 -0.940 0.377 -2.991
63 HG12 ILE 10 1HG1 ILE 10 -0.789 -2.016 -1.161
64 HG13 ILE 10 2HG1 ILE 10 -2.205 -1.142 -1.711
65 HG21 ILE 10 1HG2 ILE 10 0.539 -1.236 -4.102
66 HG22 ILE 10 2HG2 ILE 10 1.431 0.186 -3.509
67 HG23 ILE 10 3HG2 ILE 10 1.520 -1.353 -2.621
68 HD11 ILE 10 3HD1 ILE 10 -1.488 -1.878 -4.115
69 HD12 ILE 10 1HD1 ILE 10 -0.448 -3.055 -3.278
70 HD13 ILE 10 2HD1 ILE 10 -2.212 -3.101 -3.043
71 H GLU 11 H GLU 11 -0.628 2.947 -1.356
72 HA GLU 11 HA GLU 11 1.588 3.905 -2.703
73 HB2 GLU 11 1HB GLU 11 -0.706 5.135 -1.191
74 HB3 GLU 11 2HB GLU 11 0.637 6.175 -1.621
75 HG2 GLU 11 1HG GLU 11 -0.025 4.537 -3.918
76 HG3 GLU 11 2HG GLU 11 -1.502 5.255 -3.308
77 H ASN 12 H ASN 12 1.106 3.098 0.652
78 HA ASN 12 HA ASN 12 3.484 4.639 1.330
79 HB2 ASN 12 1HB ASN 12 1.015 3.833 2.851
80 HB3 ASN 12 2HB ASN 12 2.513 3.826 3.761
81 HD21 ASN 12 1HD2 ASN 12 0.656 5.802 1.464
82 HD22 ASN 12 2HD2 ASN 12 1.026 7.349 2.150
83 H ALA 13 H ALA 13 1.803 1.471 1.355
84 HA ALA 13 HA ALA 13 3.855 0.128 2.820
85 HB1 ALA 13 1HB ALA 13 1.206 -0.418 1.710
86 HB2 ALA 13 2HB ALA 13 2.335 -1.763 1.420
87 HB3 ALA 13 3HB ALA 13 2.045 -1.187 3.078
88 H TRP 14 H TRP 14 3.504 1.308 -0.398
89 HA TRP 14 HA TRP 14 5.369 -0.700 -1.430
90 HB2 TRP 14 1HB TRP 14 3.223 -0.197 -2.641
91 HB3 TRP 14 2HB TRP 14 3.841 1.412 -2.955
92 HD1 TRP 14 HD TRP 14 6.434 -1.365 -3.191
93 HE1 TRP 14 1HE TRP 14 7.147 -1.839 -5.688
94 HE3 TRP 14 3HE TRP 14 2.796 1.478 -5.324
95 HZ2 TRP 14 2HZ TRP 14 6.133 -0.990 -8.216
96 HZ3 TRP 14 3HZ TRP 14 2.728 1.602 -7.812
97 HH2 TRP 14 HH TRP 14 4.319 0.426 -9.248
98 H GLU 15 H GLU 15 4.844 2.829 -2.095
99 HA GLU 15 HA GLU 15 7.294 3.510 -2.777
100 HB2 GLU 15 1HB GLU 15 6.730 5.746 -2.275
101 HB3 GLU 15 2HB GLU 15 5.170 4.969 -2.453
102 HG2 GLU 15 1HG GLU 15 5.046 4.668 0.036
103 HG3 GLU 15 2HG GLU 15 6.594 5.473 0.204
104 H GLY 16 H GLY 16 6.210 2.734 0.529
105 HA2 GLY 16 1HA GLY 16 8.484 3.740 1.895
106 HA3 GLY 16 2HA GLY 16 7.310 2.583 2.489
107 H MET 17 H MET 17 7.511 0.409 0.794
108 HA MET 17 HA MET 17 9.881 -0.751 1.713
109 HB2 MET 17 1HB MET 17 7.457 -1.499 0.184
110 HB3 MET 17 2HB MET 17 8.872 -2.356 -0.396
111 HG2 MET 17 1HG MET 17 8.713 -2.263 2.563
112 HG3 MET 17 2HG MET 17 7.341 -3.071 1.830
113 HE1 MET 17 3HE MET 17 8.506 -6.165 0.313
114 HE2 MET 17 1HE MET 17 7.784 -5.895 1.918
115 HE3 MET 17 2HE MET 17 7.264 -4.909 0.531
116 H ILE 18 H ILE 18 9.344 1.395 -0.857
117 HA ILE 18 HA ILE 18 11.331 0.195 -2.598
118 HB ILE 18 HB ILE 18 9.622 2.671 -2.845
119 HG12 ILE 18 1HG1 ILE 18 9.416 0.139 -4.473
120 HG13 ILE 18 2HG1 ILE 18 8.580 0.306 -2.942
121 HG21 ILE 18 1HG2 ILE 18 12.047 2.242 -4.095
122 HG22 ILE 18 2HG2 ILE 18 10.862 1.651 -5.286
123 HG23 ILE 18 3HG2 ILE 18 10.744 3.314 -4.661
124 HD11 ILE 18 3HD1 ILE 18 8.188 2.710 -4.546
125 HD12 ILE 18 1HD1 ILE 18 7.723 1.260 -5.469
126 HD13 ILE 18 2HD1 ILE 18 6.971 1.588 -3.889
127 H ASP 19 H ASP 19 10.929 2.771 -0.181
128 HA ASP 19 HA ASP 19 13.205 4.204 -0.865
129 HB2 ASP 19 1HB ASP 19 11.358 3.977 1.462
130 HB3 ASP 19 2HB ASP 19 12.965 4.540 1.878
131 H GLY 20 H GLY 20 12.684 2.161 2.114
132 HA2 GLY 20 1HA GLY 20 15.545 1.458 2.057
133 HA3 GLY 20 2HA GLY 20 14.497 1.451 3.461
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -14.830 -3.983 2.514
2 HA2 GLY 1 1HA GLY 1 -14.420 -1.960 0.412
3 HA3 GLY 1 2HA GLY 1 -14.982 -1.670 2.045
4 H LEU 2 H LEU 2 -12.925 -3.625 3.181
5 HA LEU 2 HA LEU 2 -10.857 -1.684 3.500
6 HB2 LEU 2 1HB LEU 2 -11.903 -3.476 5.140
7 HB3 LEU 2 2HB LEU 2 -10.634 -4.492 4.486
8 HG LEU 2 HG LEU 2 -9.018 -2.585 5.116
9 HD11 LEU 2 1HD1 LEU 2 -10.881 -0.929 5.486
10 HD12 LEU 2 2HD1 LEU 2 -11.266 -1.808 6.985
11 HD13 LEU 2 3HD1 LEU 2 -9.675 -1.033 6.791
12 HD21 LEU 2 3HD2 LEU 2 -9.940 -4.845 6.475
13 HD22 LEU 2 1HD2 LEU 2 -8.438 -3.938 6.780
14 HD23 LEU 2 2HD2 LEU 2 -9.913 -3.552 7.698
15 H PHE 3 H PHE 3 -11.112 -4.989 2.030
16 HA PHE 3 HA PHE 3 -8.491 -5.195 1.212
17 HB2 PHE 3 1HB PHE 3 -10.841 -6.649 1.075
18 HB3 PHE 3 2HB PHE 3 -10.733 -6.125 -0.593
19 HD1 PHE 3 2HD PHE 3 -8.716 -7.794 2.057
20 HD2 PHE 3 1HD PHE 3 -9.451 -7.346 -2.098
21 HE1 PHE 3 2HE PHE 3 -7.116 -9.667 1.572
22 HE2 PHE 3 1HE PHE 3 -7.852 -9.219 -2.584
23 HZ PHE 3 HZ PHE 3 -6.704 -10.357 -0.743
24 H GLY 4 H GLY 4 -11.066 -3.134 0.010
25 HA2 GLY 4 1HA GLY 4 -9.795 -2.728 -2.577
26 HA3 GLY 4 2HA GLY 4 -11.286 -2.016 -1.991
27 H ALA 5 H ALA 5 -9.766 -1.387 0.678
28 HA ALA 5 HA ALA 5 -8.895 1.217 -0.201
29 HB1 ALA 5 1HB ALA 5 -8.562 1.437 2.363
30 HB2 ALA 5 2HB ALA 5 -10.222 1.236 1.752
31 HB3 ALA 5 3HB ALA 5 -9.361 -0.151 2.461
32 H ILE 6 H ILE 6 -7.524 -1.906 0.721
33 HA ILE 6 HA ILE 6 -5.067 -1.265 1.651
34 HB ILE 6 HB ILE 6 -5.775 -3.423 -0.340
35 HG12 ILE 6 1HG1 ILE 6 -6.003 -3.247 2.664
36 HG13 ILE 6 2HG1 ILE 6 -7.242 -3.661 1.496
37 HG21 ILE 6 1HG2 ILE 6 -3.313 -2.920 -0.044
38 HG22 ILE 6 2HG2 ILE 6 -3.500 -3.432 1.650
39 HG23 ILE 6 3HG2 ILE 6 -3.823 -4.582 0.333
40 HD11 ILE 6 3HD1 ILE 6 -4.749 -5.334 2.066
41 HD12 ILE 6 1HD1 ILE 6 -6.385 -5.678 2.677
42 HD13 ILE 6 2HD1 ILE 6 -6.052 -5.761 0.931
43 H ALA 7 H ALA 7 -6.199 -1.204 -1.774
44 HA ALA 7 HA ALA 7 -3.849 -0.761 -3.059
45 HB1 ALA 7 1HB ALA 7 -6.392 0.782 -3.663
46 HB2 ALA 7 2HB ALA 7 -5.173 0.167 -4.805
47 HB3 ALA 7 3HB ALA 7 -6.250 -0.968 -3.956
48 H GLY 8 H GLY 8 -5.859 1.601 -1.213
49 HA2 GLY 8 1HA GLY 8 -4.332 3.882 -1.860
50 HA3 GLY 8 2HA GLY 8 -5.427 3.691 -0.506
51 H PHE 9 H PHE 9 -3.958 1.258 0.536
52 HA PHE 9 HA PHE 9 -2.067 2.714 2.104
53 HB2 PHE 9 1HB PHE 9 -3.724 0.488 2.377
54 HB3 PHE 9 2HB PHE 9 -2.183 -0.296 2.091
55 HD1 PHE 9 2HD PHE 9 -0.201 1.016 3.526
56 HD2 PHE 9 1HD PHE 9 -4.289 0.630 4.595
57 HE1 PHE 9 2HE PHE 9 0.404 1.321 5.943
58 HE2 PHE 9 1HE PHE 9 -3.685 0.935 7.012
59 HZ PHE 9 HZ PHE 9 -1.347 1.276 7.657
60 H ILE 10 H ILE 10 -1.996 0.696 -0.784
61 HA ILE 10 HA ILE 10 0.585 -0.302 -0.604
62 HB ILE 10 HB ILE 10 -1.037 0.501 -3.023
63 HG12 ILE 10 1HG1 ILE 10 -0.906 -2.009 -1.357
64 HG13 ILE 10 2HG1 ILE 10 -2.311 -1.071 -1.819
65 HG21 ILE 10 1HG2 ILE 10 1.319 0.295 -3.600
66 HG22 ILE 10 2HG2 ILE 10 1.391 -1.302 -2.818
67 HG23 ILE 10 3HG2 ILE 10 0.385 -1.066 -4.267
68 HD11 ILE 10 3HD1 ILE 10 -0.610 -2.881 -3.570
69 HD12 ILE 10 1HD1 ILE 10 -2.360 -2.968 -3.259
70 HD13 ILE 10 2HD1 ILE 10 -1.702 -1.664 -4.275
71 H GLU 11 H GLU 11 -0.634 2.951 -1.230
72 HA GLU 11 HA GLU 11 1.576 3.948 -2.555
73 HB2 GLU 11 1HB GLU 11 0.628 6.078 -2.185
74 HB3 GLU 11 2HB GLU 11 -0.759 5.007 -2.151
75 HG2 GLU 11 1HG GLU 11 -0.538 4.912 0.386
76 HG3 GLU 11 2HG GLU 11 0.723 6.123 0.274
77 H ASN 12 H ASN 12 1.140 2.930 0.748
78 HA ASN 12 HA ASN 12 3.566 4.372 1.477
79 HB2 ASN 12 1HB ASN 12 1.183 3.366 3.074
80 HB3 ASN 12 2HB ASN 12 2.721 3.582 3.884
81 HD21 ASN 12 1HD2 ASN 12 0.211 4.987 4.250
82 HD22 ASN 12 2HD2 ASN 12 0.506 6.673 3.981
83 H ALA 13 H ALA 13 1.813 1.246 1.328
84 HA ALA 13 HA ALA 13 3.861 -0.235 2.659
85 HB1 ALA 13 1HB ALA 13 1.165 -0.606 1.800
86 HB2 ALA 13 2HB ALA 13 2.151 -1.867 1.018
87 HB3 ALA 13 3HB ALA 13 2.164 -1.697 2.791
88 H TRP 14 H TRP 14 3.478 1.164 -0.465
89 HA TRP 14 HA TRP 14 5.275 -0.812 -1.666
90 HB2 TRP 14 1HB TRP 14 3.119 -0.184 -2.796
91 HB3 TRP 14 2HB TRP 14 3.766 1.429 -3.017
92 HD1 TRP 14 HD TRP 14 6.290 -1.382 -3.489
93 HE1 TRP 14 1HE TRP 14 6.945 -1.704 -6.025
94 HE3 TRP 14 3HE TRP 14 2.679 1.674 -5.354
95 HZ2 TRP 14 2HZ TRP 14 5.902 -0.668 -8.471
96 HZ3 TRP 14 3HZ TRP 14 2.567 1.964 -7.827
97 HH2 TRP 14 HH TRP 14 4.103 0.852 -9.370
98 H GLU 15 H GLU 15 4.818 2.764 -2.086
99 HA GLU 15 HA GLU 15 7.270 3.437 -2.772
100 HB2 GLU 15 1HB GLU 15 6.766 5.645 -2.112
101 HB3 GLU 15 2HB GLU 15 5.186 4.915 -2.310
102 HG2 GLU 15 1HG GLU 15 5.102 4.453 0.156
103 HG3 GLU 15 2HG GLU 15 6.669 5.214 0.345
104 H GLY 16 H GLY 16 6.227 2.480 0.502
105 HA2 GLY 16 1HA GLY 16 8.573 3.331 1.863
106 HA3 GLY 16 2HA GLY 16 7.360 2.203 2.432
107 H MET 17 H MET 17 7.425 0.118 0.601
108 HA MET 17 HA MET 17 9.757 -1.199 1.412
109 HB2 MET 17 1HB MET 17 7.226 -1.790 0.116
110 HB3 MET 17 2HB MET 17 8.497 -2.514 -0.849
111 HG2 MET 17 1HG MET 17 8.253 -2.892 2.174
112 HG3 MET 17 2HG MET 17 7.586 -4.012 1.002
113 HE1 MET 17 3HE MET 17 8.435 -5.836 1.432
114 HE2 MET 17 1HE MET 17 9.874 -6.404 0.554
115 HE3 MET 17 2HE MET 17 9.972 -6.071 2.299
116 H ILE 18 H ILE 18 9.259 1.097 -1.035
117 HA ILE 18 HA ILE 18 11.166 -0.102 -2.871
118 HB ILE 18 HB ILE 18 9.407 2.339 -2.963
119 HG12 ILE 18 1HG1 ILE 18 9.488 -0.207 -4.609
120 HG13 ILE 18 2HG1 ILE 18 8.316 0.179 -3.366
121 HG21 ILE 18 1HG2 ILE 18 10.366 2.294 -5.448
122 HG22 ILE 18 2HG2 ILE 18 11.126 3.243 -4.147
123 HG23 ILE 18 3HG2 ILE 18 11.799 1.659 -4.604
124 HD11 ILE 18 3HD1 ILE 18 7.078 1.042 -5.076
125 HD12 ILE 18 1HD1 ILE 18 8.179 2.437 -4.970
126 HD13 ILE 18 2HD1 ILE 18 8.487 1.147 -6.158
127 H ASP 19 H ASP 19 10.900 2.342 -0.317
128 HA ASP 19 HA ASP 19 13.512 3.355 -1.014
129 HB2 ASP 19 1HB ASP 19 11.197 4.254 0.609
130 HB3 ASP 19 2HB ASP 19 12.738 4.570 1.380
131 H GLY 20 H GLY 20 14.840 3.850 1.265
132 HA2 GLY 20 1HA GLY 20 14.667 1.470 2.993
133 HA3 GLY 20 2HA GLY 20 16.178 1.870 2.201
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -14.908 -3.701 1.933
2 HA2 GLY 1 1HA GLY 1 -14.367 -1.467 0.089
3 HA3 GLY 1 2HA GLY 1 -14.953 -1.343 1.737
4 H LEU 2 H LEU 2 -13.014 -3.514 2.669
5 HA LEU 2 HA LEU 2 -10.864 -1.725 3.246
6 HB2 LEU 2 1HB LEU 2 -12.033 -3.638 4.652
7 HB3 LEU 2 2HB LEU 2 -10.797 -4.634 3.910
8 HG LEU 2 HG LEU 2 -9.098 -2.925 4.786
9 HD11 LEU 2 1HD1 LEU 2 -9.842 -1.666 6.806
10 HD12 LEU 2 2HD1 LEU 2 -10.549 -1.079 5.281
11 HD13 LEU 2 3HD1 LEU 2 -11.524 -2.075 6.389
12 HD21 LEU 2 3HD2 LEU 2 -8.859 -4.846 5.942
13 HD22 LEU 2 1HD2 LEU 2 -9.593 -3.896 7.256
14 HD23 LEU 2 2HD2 LEU 2 -10.600 -4.994 6.282
15 H PHE 3 H PHE 3 -11.246 -4.823 1.402
16 HA PHE 3 HA PHE 3 -8.619 -5.068 0.612
17 HB2 PHE 3 1HB PHE 3 -11.034 -6.377 0.269
18 HB3 PHE 3 2HB PHE 3 -10.860 -5.673 -1.327
19 HD1 PHE 3 2HD PHE 3 -8.514 -6.069 -2.467
20 HD2 PHE 3 1HD PHE 3 -10.079 -8.443 0.683
21 HE1 PHE 3 2HE PHE 3 -6.995 -7.954 -3.133
22 HE2 PHE 3 1HE PHE 3 -8.562 -10.327 0.017
23 HZ PHE 3 HZ PHE 3 -7.038 -10.060 -1.883
24 H GLY 4 H GLY 4 -11.061 -2.755 -0.389
25 HA2 GLY 4 1HA GLY 4 -9.716 -2.123 -2.892
26 HA3 GLY 4 2HA GLY 4 -11.182 -1.408 -2.252
27 H ALA 5 H ALA 5 -9.696 -1.162 0.497
28 HA ALA 5 HA ALA 5 -8.678 1.475 -0.064
29 HB1 ALA 5 1HB ALA 5 -8.337 1.261 2.555
30 HB2 ALA 5 2HB ALA 5 -9.968 1.459 1.868
31 HB3 ALA 5 3HB ALA 5 -9.400 -0.154 2.361
32 H ILE 6 H ILE 6 -7.483 -1.799 0.516
33 HA ILE 6 HA ILE 6 -5.017 -1.393 1.552
34 HB ILE 6 HB ILE 6 -5.786 -3.273 -0.683
35 HG12 ILE 6 1HG1 ILE 6 -6.070 -3.427 2.318
36 HG13 ILE 6 2HG1 ILE 6 -7.302 -3.642 1.090
37 HG21 ILE 6 1HG2 ILE 6 -3.711 -4.046 1.275
38 HG22 ILE 6 2HG2 ILE 6 -3.817 -4.342 -0.478
39 HG23 ILE 6 3HG2 ILE 6 -3.249 -2.767 0.126
40 HD11 ILE 6 3HD1 ILE 6 -5.688 -5.622 0.282
41 HD12 ILE 6 1HD1 ILE 6 -5.143 -5.545 1.975
42 HD13 ILE 6 2HD1 ILE 6 -6.855 -5.868 1.604
43 H ALA 7 H ALA 7 -6.070 -0.885 -1.861
44 HA ALA 7 HA ALA 7 -3.674 -0.421 -3.049
45 HB1 ALA 7 1HB ALA 7 -4.935 0.957 -4.630
46 HB2 ALA 7 2HB ALA 7 -5.916 -0.445 -4.139
47 HB3 ALA 7 3HB ALA 7 -6.248 1.159 -3.444
48 H GLY 8 H GLY 8 -5.605 1.814 -0.975
49 HA2 GLY 8 1HA GLY 8 -3.955 4.074 -1.334
50 HA3 GLY 8 2HA GLY 8 -5.086 3.786 -0.027
51 H PHE 9 H PHE 9 -3.760 1.179 0.752
52 HA PHE 9 HA PHE 9 -1.834 2.350 2.506
53 HB2 PHE 9 1HB PHE 9 -3.595 0.161 2.447
54 HB3 PHE 9 2HB PHE 9 -2.051 -0.625 2.184
55 HD1 PHE 9 1HD PHE 9 -3.226 2.166 4.384
56 HD2 PHE 9 2HD PHE 9 -1.220 -1.564 4.107
57 HE1 PHE 9 1HE PHE 9 -2.775 2.225 6.852
58 HE2 PHE 9 2HE PHE 9 -0.770 -1.505 6.576
59 HZ PHE 9 HZ PHE 9 -1.553 0.388 7.918
60 H ILE 10 H ILE 10 -1.802 0.671 -0.592
61 HA ILE 10 HA ILE 10 0.723 -0.471 -0.489
62 HB ILE 10 HB ILE 10 -0.805 0.683 -2.825
63 HG12 ILE 10 1HG1 ILE 10 -0.832 -2.005 -1.456
64 HG13 ILE 10 2HG1 ILE 10 -2.180 -0.949 -1.829
65 HG21 ILE 10 1HG2 ILE 10 1.561 0.417 -3.367
66 HG22 ILE 10 2HG2 ILE 10 1.513 -1.269 -2.801
67 HG23 ILE 10 3HG2 ILE 10 0.565 -0.781 -4.225
68 HD11 ILE 10 3HD1 ILE 10 -0.502 -2.567 -3.789
69 HD12 ILE 10 1HD1 ILE 10 -2.243 -2.725 -3.451
70 HD13 ILE 10 2HD1 ILE 10 -1.629 -1.294 -4.311
71 H GLU 11 H GLU 11 -0.321 2.890 -0.757
72 HA GLU 11 HA GLU 11 1.963 3.916 -1.925
73 HB2 GLU 11 1HB GLU 11 -0.114 5.095 -0.047
74 HB3 GLU 11 2HB GLU 11 1.215 6.063 -0.655
75 HG2 GLU 11 1HG GLU 11 -0.380 4.460 -2.652
76 HG3 GLU 11 2HG GLU 11 -1.131 5.887 -1.968
77 H ASN 12 H ASN 12 1.408 2.555 1.233
78 HA ASN 12 HA ASN 12 3.884 3.778 2.160
79 HB2 ASN 12 1HB ASN 12 1.748 2.362 3.835
80 HB3 ASN 12 2HB ASN 12 3.107 3.283 4.449
81 HD21 ASN 12 1HD2 ASN 12 1.583 4.539 5.606
82 HD22 ASN 12 2HD2 ASN 12 0.707 5.829 4.853
83 H ALA 13 H ALA 13 1.984 0.783 1.626
84 HA ALA 13 HA ALA 13 3.930 -0.941 2.812
85 HB1 ALA 13 1HB ALA 13 1.370 -1.271 2.519
86 HB2 ALA 13 2HB ALA 13 1.769 -1.747 0.850
87 HB3 ALA 13 3HB ALA 13 2.434 -2.667 2.221
88 H TRP 14 H TRP 14 3.681 0.820 -0.138
89 HA TRP 14 HA TRP 14 5.405 -1.095 -1.529
90 HB2 TRP 14 1HB TRP 14 3.306 -0.235 -2.613
91 HB3 TRP 14 2HB TRP 14 4.037 1.358 -2.637
92 HD1 TRP 14 HD TRP 14 6.429 -1.507 -3.389
93 HE1 TRP 14 1HE TRP 14 7.121 -1.572 -5.935
94 HE3 TRP 14 3HE TRP 14 3.012 1.922 -4.948
95 HZ2 TRP 14 2HZ TRP 14 6.182 -0.213 -8.262
96 HZ3 TRP 14 3HZ TRP 14 2.966 2.496 -7.373
97 HH2 TRP 14 HH TRP 14 4.479 1.490 -9.009
98 H GLU 15 H GLU 15 5.133 2.524 -1.545
99 HA GLU 15 HA GLU 15 7.628 3.142 -2.111
100 HB2 GLU 15 1HB GLU 15 5.587 4.649 -1.487
101 HB3 GLU 15 2HB GLU 15 6.230 4.617 0.144
102 HG2 GLU 15 1HG GLU 15 7.767 5.531 -2.334
103 HG3 GLU 15 2HG GLU 15 7.046 6.596 -1.144
104 H GLY 16 H GLY 16 6.454 1.980 1.068
105 HA2 GLY 16 1HA GLY 16 8.880 2.490 2.476
106 HA3 GLY 16 2HA GLY 16 7.539 1.484 2.985
107 H MET 17 H MET 17 7.363 -0.467 1.000
108 HA MET 17 HA MET 17 9.490 -2.123 1.739
109 HB2 MET 17 1HB MET 17 7.174 -2.264 -0.233
110 HB3 MET 17 2HB MET 17 8.380 -3.537 -0.246
111 HG2 MET 17 1HG MET 17 7.002 -2.688 2.335
112 HG3 MET 17 2HG MET 17 6.282 -3.875 1.266
113 HE1 MET 17 3HE MET 17 9.212 -6.264 0.727
114 HE2 MET 17 1HE MET 17 7.598 -6.759 1.294
115 HE3 MET 17 2HE MET 17 7.757 -5.470 0.077
116 H ILE 18 H ILE 18 9.350 0.391 -0.535
117 HA ILE 18 HA ILE 18 11.246 -0.913 -2.337
118 HB ILE 18 HB ILE 18 9.774 1.713 -2.588
119 HG12 ILE 18 1HG1 ILE 18 8.476 -0.559 -2.628
120 HG13 ILE 18 2HG1 ILE 18 8.140 0.676 -3.825
121 HG21 ILE 18 1HG2 ILE 18 10.501 1.140 -5.092
122 HG22 ILE 18 2HG2 ILE 18 11.525 2.087 -3.986
123 HG23 ILE 18 3HG2 ILE 18 11.849 0.355 -4.235
124 HD11 ILE 18 3HD1 ILE 18 9.087 -0.530 -5.553
125 HD12 ILE 18 1HD1 ILE 18 10.327 -1.258 -4.505
126 HD13 ILE 18 2HD1 ILE 18 8.665 -1.895 -4.493
127 H ASP 19 H ASP 19 10.888 1.601 0.150
128 HA ASP 19 HA ASP 19 12.407 2.608 1.348
129 HB2 ASP 19 1HB ASP 19 13.825 0.459 0.777
130 HB3 ASP 19 2HB ASP 19 14.672 1.501 -0.349
131 H GLY 20 H GLY 20 12.059 4.769 0.708
132 HA2 GLY 20 1HA GLY 20 13.818 5.812 -1.397
133 HA3 GLY 20 2HA GLY 20 12.089 6.054 -1.561
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -14.705 -3.939 2.684
2 HA2 GLY 1 1HA GLY 1 -14.281 -1.899 0.609
3 HA3 GLY 1 2HA GLY 1 -14.807 -1.631 2.260
4 H LEU 2 H LEU 2 -12.737 -3.615 3.319
5 HA LEU 2 HA LEU 2 -10.651 -1.692 3.624
6 HB2 LEU 2 1HB LEU 2 -11.671 -3.503 5.258
7 HB3 LEU 2 2HB LEU 2 -10.423 -4.516 4.560
8 HG LEU 2 HG LEU 2 -8.784 -2.626 5.185
9 HD11 LEU 2 1HD1 LEU 2 -9.825 -0.751 5.854
10 HD12 LEU 2 2HD1 LEU 2 -11.299 -1.615 6.353
11 HD13 LEU 2 3HD1 LEU 2 -9.884 -1.573 7.432
12 HD21 LEU 2 3HD2 LEU 2 -8.970 -4.858 6.286
13 HD22 LEU 2 1HD2 LEU 2 -8.417 -3.555 7.364
14 HD23 LEU 2 2HD2 LEU 2 -10.097 -4.135 7.459
15 H PHE 3 H PHE 3 -10.957 -4.970 2.109
16 HA PHE 3 HA PHE 3 -8.357 -5.178 1.230
17 HB2 PHE 3 1HB PHE 3 -10.717 -6.618 1.122
18 HB3 PHE 3 2HB PHE 3 -10.642 -6.067 -0.540
19 HD1 PHE 3 2HD PHE 3 -8.454 -7.681 2.021
20 HD2 PHE 3 1HD PHE 3 -9.524 -7.379 -2.074
21 HE1 PHE 3 2HE PHE 3 -6.876 -9.555 1.470
22 HE2 PHE 3 1HE PHE 3 -7.947 -9.252 -2.624
23 HZ PHE 3 HZ PHE 3 -6.642 -10.318 -0.846
24 H GLY 4 H GLY 4 -10.945 -3.085 0.116
25 HA2 GLY 4 1HA GLY 4 -9.726 -2.644 -2.491
26 HA3 GLY 4 2HA GLY 4 -11.200 -1.934 -1.861
27 H ALA 5 H ALA 5 -9.619 -1.356 0.784
28 HA ALA 5 HA ALA 5 -8.753 1.257 -0.072
29 HB1 ALA 5 1HB ALA 5 -8.224 0.894 2.671
30 HB2 ALA 5 2HB ALA 5 -9.644 1.687 1.948
31 HB3 ALA 5 3HB ALA 5 -9.701 -0.045 2.353
32 H ILE 6 H ILE 6 -7.381 -1.888 0.771
33 HA ILE 6 HA ILE 6 -4.900 -1.275 1.657
34 HB ILE 6 HB ILE 6 -5.663 -3.398 -0.351
35 HG12 ILE 6 1HG1 ILE 6 -5.826 -3.268 2.660
36 HG13 ILE 6 2HG1 ILE 6 -7.091 -3.657 1.512
37 HG21 ILE 6 1HG2 ILE 6 -3.192 -2.913 -0.100
38 HG22 ILE 6 2HG2 ILE 6 -3.346 -3.450 1.590
39 HG23 ILE 6 3HG2 ILE 6 -3.705 -4.579 0.261
40 HD11 ILE 6 3HD1 ILE 6 -4.651 -5.350 2.200
41 HD12 ILE 6 1HD1 ILE 6 -6.361 -5.740 2.499
42 HD13 ILE 6 2HD1 ILE 6 -5.734 -5.711 0.834
43 H ALA 7 H ALA 7 -6.106 -1.152 -1.740
44 HA ALA 7 HA ALA 7 -3.781 -0.702 -3.068
45 HB1 ALA 7 1HB ALA 7 -5.305 0.790 -4.553
46 HB2 ALA 7 2HB ALA 7 -5.764 -0.915 -4.326
47 HB3 ALA 7 3HB ALA 7 -6.596 0.361 -3.404
48 H GLY 8 H GLY 8 -5.739 1.640 -1.144
49 HA2 GLY 8 1HA GLY 8 -4.215 3.925 -1.789
50 HA3 GLY 8 2HA GLY 8 -5.281 3.717 -0.413
51 H PHE 9 H PHE 9 -3.801 1.261 0.556
52 HA PHE 9 HA PHE 9 -1.869 2.684 2.106
53 HB2 PHE 9 1HB PHE 9 -3.538 0.523 2.457
54 HB3 PHE 9 2HB PHE 9 -2.082 -0.337 1.994
55 HD1 PHE 9 2HD PHE 9 -3.021 2.466 4.288
56 HD2 PHE 9 1HD PHE 9 -0.755 -1.076 3.716
57 HE1 PHE 9 2HE PHE 9 -2.176 2.627 6.646
58 HE2 PHE 9 1HE PHE 9 0.090 -0.915 6.075
59 HZ PHE 9 HZ PHE 9 -0.630 0.934 7.510
60 H ILE 10 H ILE 10 -1.872 0.711 -0.813
61 HA ILE 10 HA ILE 10 0.707 -0.301 -0.707
62 HB ILE 10 HB ILE 10 -0.963 0.546 -3.076
63 HG12 ILE 10 1HG1 ILE 10 -0.806 -1.991 -1.453
64 HG13 ILE 10 2HG1 ILE 10 -2.217 -1.040 -1.869
65 HG21 ILE 10 1HG2 ILE 10 1.391 0.335 -3.692
66 HG22 ILE 10 2HG2 ILE 10 1.449 -1.287 -2.961
67 HG23 ILE 10 3HG2 ILE 10 0.424 -0.987 -4.385
68 HD11 ILE 10 3HD1 ILE 10 -2.278 -2.945 -3.320
69 HD12 ILE 10 1HD1 ILE 10 -1.709 -1.600 -4.337
70 HD13 ILE 10 2HD1 ILE 10 -0.548 -2.795 -3.711
71 H GLU 11 H GLU 11 -0.509 2.966 -1.255
72 HA GLU 11 HA GLU 11 1.677 3.973 -2.614
73 HB2 GLU 11 1HB GLU 11 0.756 6.109 -2.171
74 HB3 GLU 11 2HB GLU 11 -0.635 5.043 -2.162
75 HG2 GLU 11 1HG GLU 11 -1.120 5.858 -0.099
76 HG3 GLU 11 2HG GLU 11 0.253 4.948 0.498
77 H ASN 12 H ASN 12 1.309 2.907 0.683
78 HA ASN 12 HA ASN 12 3.755 4.327 1.380
79 HB2 ASN 12 1HB ASN 12 1.292 3.580 2.890
80 HB3 ASN 12 2HB ASN 12 2.777 3.243 3.757
81 HD21 ASN 12 1HD2 ASN 12 4.490 5.123 3.246
82 HD22 ASN 12 2HD2 ASN 12 3.923 6.714 3.632
83 H ALA 13 H ALA 13 1.985 1.212 1.223
84 HA ALA 13 HA ALA 13 4.056 -0.298 2.485
85 HB1 ALA 13 1HB ALA 13 1.852 -1.375 0.707
86 HB2 ALA 13 2HB ALA 13 2.629 -2.145 2.111
87 HB3 ALA 13 3HB ALA 13 1.514 -0.778 2.349
88 H TRP 14 H TRP 14 3.610 1.150 -0.608
89 HA TRP 14 HA TRP 14 5.372 -0.815 -1.879
90 HB2 TRP 14 1HB TRP 14 3.193 -0.160 -2.951
91 HB3 TRP 14 2HB TRP 14 3.844 1.453 -3.162
92 HD1 TRP 14 HD TRP 14 6.344 -1.361 -3.732
93 HE1 TRP 14 1HE TRP 14 6.941 -1.648 -6.287
94 HE3 TRP 14 3HE TRP 14 2.707 1.739 -5.470
95 HZ2 TRP 14 2HZ TRP 14 5.850 -0.569 -8.693
96 HZ3 TRP 14 3HZ TRP 14 2.542 2.068 -7.936
97 HH2 TRP 14 HH TRP 14 4.038 0.972 -9.528
98 H GLU 15 H GLU 15 4.922 2.769 -2.235
99 HA GLU 15 HA GLU 15 7.362 3.440 -2.964
100 HB2 GLU 15 1HB GLU 15 5.245 4.888 -2.345
101 HB3 GLU 15 2HB GLU 15 6.041 5.095 -0.798
102 HG2 GLU 15 1HG GLU 15 7.855 6.278 -1.724
103 HG3 GLU 15 2HG GLU 15 7.649 5.564 -3.312
104 H GLY 16 H GLY 16 6.363 2.576 0.372
105 HA2 GLY 16 1HA GLY 16 8.778 3.340 1.645
106 HA3 GLY 16 2HA GLY 16 7.543 2.261 2.265
107 H MET 17 H MET 17 7.495 0.172 0.406
108 HA MET 17 HA MET 17 9.757 -1.254 1.209
109 HB2 MET 17 1HB MET 17 7.413 -1.687 -0.670
110 HB3 MET 17 2HB MET 17 8.739 -2.831 -0.739
111 HG2 MET 17 1HG MET 17 8.481 -2.957 1.878
112 HG3 MET 17 2HG MET 17 6.919 -2.209 1.614
113 HE1 MET 17 3HE MET 17 4.953 -5.214 1.581
114 HE2 MET 17 1HE MET 17 5.375 -3.612 2.229
115 HE3 MET 17 2HE MET 17 4.716 -3.760 0.582
116 H ILE 18 H ILE 18 9.403 1.102 -1.204
117 HA ILE 18 HA ILE 18 11.330 -0.152 -2.994
118 HB ILE 18 HB ILE 18 9.731 2.401 -3.216
119 HG12 ILE 18 1HG1 ILE 18 8.601 0.044 -3.323
120 HG13 ILE 18 2HG1 ILE 18 8.191 1.278 -4.498
121 HG21 ILE 18 1HG2 ILE 18 11.547 2.889 -4.535
122 HG22 ILE 18 2HG2 ILE 18 11.851 1.185 -4.948
123 HG23 ILE 18 3HG2 ILE 18 10.494 2.055 -5.702
124 HD11 ILE 18 3HD1 ILE 18 8.969 -1.262 -5.164
125 HD12 ILE 18 1HD1 ILE 18 9.168 0.144 -6.237
126 HD13 ILE 18 2HD1 ILE 18 10.531 -0.413 -5.237
127 H ASP 19 H ASP 19 11.003 2.302 -0.466
128 HA ASP 19 HA ASP 19 13.829 2.483 -0.351
129 HB2 ASP 19 1HB ASP 19 12.156 4.909 -1.141
130 HB3 ASP 19 2HB ASP 19 13.769 5.053 -0.473
131 H GLY 20 H GLY 20 13.681 1.899 1.866
132 HA2 GLY 20 1HA GLY 20 13.320 3.701 3.846
133 HA3 GLY 20 2HA GLY 20 11.694 3.101 3.584
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -14.010 -3.905 0.611
2 HA2 GLY 1 1HA GLY 1 -14.331 -1.461 0.019
3 HA3 GLY 1 2HA GLY 1 -14.929 -1.301 1.659
4 H LEU 2 H LEU 2 -13.006 -3.461 2.650
5 HA LEU 2 HA LEU 2 -10.856 -1.669 3.213
6 HB2 LEU 2 1HB LEU 2 -12.039 -3.557 4.640
7 HB3 LEU 2 2HB LEU 2 -10.801 -4.568 3.921
8 HG LEU 2 HG LEU 2 -9.376 -2.354 4.826
9 HD11 LEU 2 1HD1 LEU 2 -10.036 -2.005 7.133
10 HD12 LEU 2 2HD1 LEU 2 -11.372 -1.572 6.041
11 HD13 LEU 2 3HD1 LEU 2 -11.417 -3.110 6.935
12 HD21 LEU 2 3HD2 LEU 2 -8.563 -3.931 6.584
13 HD22 LEU 2 1HD2 LEU 2 -9.832 -5.073 6.080
14 HD23 LEU 2 2HD2 LEU 2 -8.553 -4.602 4.935
15 H PHE 3 H PHE 3 -11.226 -4.797 1.417
16 HA PHE 3 HA PHE 3 -8.594 -5.057 0.651
17 HB2 PHE 3 1HB PHE 3 -11.006 -6.369 0.309
18 HB3 PHE 3 2HB PHE 3 -10.821 -5.689 -1.295
19 HD1 PHE 3 1HD PHE 3 -9.017 -6.428 -2.761
20 HD2 PHE 3 2HD PHE 3 -9.507 -8.103 1.107
21 HE1 PHE 3 1HE PHE 3 -7.497 -8.324 -3.389
22 HE2 PHE 3 2HE PHE 3 -7.986 -9.999 0.479
23 HZ PHE 3 HZ PHE 3 -6.999 -10.086 -1.762
24 H GLY 4 H GLY 4 -11.028 -2.759 -0.409
25 HA2 GLY 4 1HA GLY 4 -9.658 -2.166 -2.907
26 HA3 GLY 4 2HA GLY 4 -11.131 -1.443 -2.295
27 H ALA 5 H ALA 5 -9.663 -1.158 0.464
28 HA ALA 5 HA ALA 5 -8.644 1.474 -0.128
29 HB1 ALA 5 1HB ALA 5 -8.667 1.752 2.276
30 HB2 ALA 5 2HB ALA 5 -10.172 0.925 1.802
31 HB3 ALA 5 3HB ALA 5 -8.837 -0.003 2.525
32 H ILE 6 H ILE 6 -7.455 -1.789 0.515
33 HA ILE 6 HA ILE 6 -5.001 -1.367 1.572
34 HB ILE 6 HB ILE 6 -5.746 -3.282 -0.643
35 HG12 ILE 6 1HG1 ILE 6 -6.062 -3.390 2.357
36 HG13 ILE 6 2HG1 ILE 6 -7.281 -3.625 1.120
37 HG21 ILE 6 1HG2 ILE 6 -3.249 -2.860 -0.104
38 HG22 ILE 6 2HG2 ILE 6 -3.590 -3.740 1.405
39 HG23 ILE 6 3HG2 ILE 6 -3.850 -4.534 -0.167
40 HD11 ILE 6 3HD1 ILE 6 -6.748 -5.824 1.880
41 HD12 ILE 6 1HD1 ILE 6 -5.880 -5.659 0.336
42 HD13 ILE 6 2HD1 ILE 6 -4.999 -5.489 1.873
43 H ALA 7 H ALA 7 -6.019 -0.910 -1.858
44 HA ALA 7 HA ALA 7 -3.611 -0.464 -3.030
45 HB1 ALA 7 1HB ALA 7 -5.090 1.340 -4.338
46 HB2 ALA 7 2HB ALA 7 -5.384 -0.408 -4.504
47 HB3 ALA 7 3HB ALA 7 -6.401 0.567 -3.415
48 H GLY 8 H GLY 8 -5.560 1.802 -1.009
49 HA2 GLY 8 1HA GLY 8 -3.904 4.055 -1.384
50 HA3 GLY 8 2HA GLY 8 -5.049 3.788 -0.084
51 H PHE 9 H PHE 9 -3.733 1.191 0.745
52 HA PHE 9 HA PHE 9 -1.824 2.385 2.502
53 HB2 PHE 9 1HB PHE 9 -3.592 0.214 2.481
54 HB3 PHE 9 2HB PHE 9 -2.064 -0.596 2.202
55 HD1 PHE 9 2HD PHE 9 -0.163 0.798 3.850
56 HD2 PHE 9 1HD PHE 9 -4.225 -0.114 4.671
57 HE1 PHE 9 2HE PHE 9 0.320 0.862 6.312
58 HE2 PHE 9 1HE PHE 9 -3.742 -0.050 7.134
59 HZ PHE 9 HZ PHE 9 -1.475 0.437 7.924
60 H ILE 10 H ILE 10 -1.762 0.661 -0.570
61 HA ILE 10 HA ILE 10 0.761 -0.482 -0.425
62 HB ILE 10 HB ILE 10 -0.743 0.640 -2.792
63 HG12 ILE 10 1HG1 ILE 10 -0.786 -2.027 -1.385
64 HG13 ILE 10 2HG1 ILE 10 -2.130 -0.976 -1.787
65 HG21 ILE 10 1HG2 ILE 10 0.639 -0.858 -4.153
66 HG22 ILE 10 2HG2 ILE 10 1.624 0.368 -3.317
67 HG23 ILE 10 3HG2 ILE 10 1.580 -1.305 -2.710
68 HD11 ILE 10 3HD1 ILE 10 -2.179 -2.774 -3.385
69 HD12 ILE 10 1HD1 ILE 10 -1.550 -1.357 -4.260
70 HD13 ILE 10 2HD1 ILE 10 -0.434 -2.627 -3.704
71 H GLU 11 H GLU 11 -0.277 2.877 -0.751
72 HA GLU 11 HA GLU 11 2.020 3.884 -1.911
73 HB2 GLU 11 1HB GLU 11 0.056 5.178 0.030
74 HB3 GLU 11 2HB GLU 11 1.272 6.065 -0.866
75 HG2 GLU 11 1HG GLU 11 0.154 4.736 -2.945
76 HG3 GLU 11 2HG GLU 11 -1.228 4.724 -1.868
77 H ASN 12 H ASN 12 1.431 2.568 1.260
78 HA ASN 12 HA ASN 12 3.899 3.802 2.194
79 HB2 ASN 12 1HB ASN 12 1.489 2.652 3.679
80 HB3 ASN 12 2HB ASN 12 3.007 2.955 4.501
81 HD21 ASN 12 1HD2 ASN 12 0.292 4.155 4.709
82 HD22 ASN 12 2HD2 ASN 12 0.502 5.868 4.558
83 H ALA 13 H ALA 13 2.001 0.802 1.686
84 HA ALA 13 HA ALA 13 3.931 -0.908 2.916
85 HB1 ALA 13 1HB ALA 13 1.319 -1.159 2.455
86 HB2 ALA 13 2HB ALA 13 1.897 -1.879 0.932
87 HB3 ALA 13 3HB ALA 13 2.391 -2.579 2.492
88 H TRP 14 H TRP 14 3.715 0.811 -0.062
89 HA TRP 14 HA TRP 14 5.451 -1.126 -1.407
90 HB2 TRP 14 1HB TRP 14 3.366 -0.279 -2.525
91 HB3 TRP 14 2HB TRP 14 4.099 1.312 -2.565
92 HD1 TRP 14 HD TRP 14 6.495 -1.565 -3.249
93 HE1 TRP 14 1HE TRP 14 7.213 -1.668 -5.787
94 HE3 TRP 14 3HE TRP 14 3.099 1.844 -4.894
95 HZ2 TRP 14 2HZ TRP 14 6.301 -0.343 -8.144
96 HZ3 TRP 14 3HZ TRP 14 3.079 2.382 -7.328
97 HH2 TRP 14 HH TRP 14 4.606 1.350 -8.933
98 H GLU 15 H GLU 15 5.183 2.493 -1.478
99 HA GLU 15 HA GLU 15 7.686 3.101 -2.027
100 HB2 GLU 15 1HB GLU 15 5.850 4.470 -0.019
101 HB3 GLU 15 2HB GLU 15 7.345 5.192 -0.581
102 HG2 GLU 15 1HG GLU 15 5.421 4.165 -2.663
103 HG3 GLU 15 2HG GLU 15 4.993 5.640 -1.820
104 H GLY 16 H GLY 16 6.491 1.901 1.116
105 HA2 GLY 16 1HA GLY 16 8.859 2.475 2.592
106 HA3 GLY 16 2HA GLY 16 7.548 1.404 3.047
107 H MET 17 H MET 17 7.498 -0.524 1.047
108 HA MET 17 HA MET 17 9.691 -2.088 1.797
109 HB2 MET 17 1HB MET 17 7.275 -2.300 0.029
110 HB3 MET 17 2HB MET 17 8.591 -3.371 -0.406
111 HG2 MET 17 1HG MET 17 8.552 -3.764 2.310
112 HG3 MET 17 2HG MET 17 6.863 -3.382 2.041
113 HE1 MET 17 3HE MET 17 5.255 -4.598 0.802
114 HE2 MET 17 1HE MET 17 5.355 -6.356 0.543
115 HE3 MET 17 2HE MET 17 5.508 -5.688 2.187
116 H ILE 18 H ILE 18 9.458 0.437 -0.455
117 HA ILE 18 HA ILE 18 11.430 -0.761 -2.247
118 HB ILE 18 HB ILE 18 9.838 1.794 -2.494
119 HG12 ILE 18 1HG1 ILE 18 8.649 -0.535 -2.566
120 HG13 ILE 18 2HG1 ILE 18 8.271 0.692 -3.758
121 HG21 ILE 18 1HG2 ILE 18 11.993 0.551 -4.130
122 HG22 ILE 18 2HG2 ILE 18 10.619 1.279 -4.994
123 HG23 ILE 18 3HG2 ILE 18 11.584 2.263 -3.869
124 HD11 ILE 18 3HD1 ILE 18 10.560 -1.105 -4.446
125 HD12 ILE 18 1HD1 ILE 18 8.948 -1.860 -4.415
126 HD13 ILE 18 2HD1 ILE 18 9.260 -0.471 -5.483
127 H ASP 19 H ASP 19 10.961 1.615 0.327
128 HA ASP 19 HA ASP 19 12.408 2.710 1.525
129 HB2 ASP 19 1HB ASP 19 13.924 0.654 1.029
130 HB3 ASP 19 2HB ASP 19 14.695 1.652 -0.188
131 H GLY 20 H GLY 20 11.159 4.185 -0.351
132 HA2 GLY 20 1HA GLY 20 13.286 5.797 -1.632
133 HA3 GLY 20 2HA GLY 20 11.748 5.452 -2.400
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -14.541 -3.901 0.125
2 HA2 GLY 1 1HA GLY 1 -14.442 -1.602 -0.093
3 HA3 GLY 1 2HA GLY 1 -15.065 -1.397 1.532
4 H LEU 2 H LEU 2 -13.127 -3.498 2.619
5 HA LEU 2 HA LEU 2 -11.007 -1.658 3.148
6 HB2 LEU 2 1HB LEU 2 -12.188 -3.508 4.625
7 HB3 LEU 2 2HB LEU 2 -10.926 -4.529 3.962
8 HG LEU 2 HG LEU 2 -9.223 -2.913 4.819
9 HD11 LEU 2 1HD1 LEU 2 -9.841 -0.875 5.436
10 HD12 LEU 2 2HD1 LEU 2 -11.562 -1.311 5.306
11 HD13 LEU 2 3HD1 LEU 2 -10.688 -1.587 6.832
12 HD21 LEU 2 3HD2 LEU 2 -11.079 -4.076 6.915
13 HD22 LEU 2 1HD2 LEU 2 -9.798 -4.956 6.046
14 HD23 LEU 2 2HD2 LEU 2 -9.374 -3.623 7.148
15 H PHE 3 H PHE 3 -11.318 -4.851 1.458
16 HA PHE 3 HA PHE 3 -8.673 -5.109 0.739
17 HB2 PHE 3 1HB PHE 3 -11.066 -6.459 0.412
18 HB3 PHE 3 2HB PHE 3 -10.866 -5.833 -1.214
19 HD1 PHE 3 2HD PHE 3 -8.970 -6.560 -2.601
20 HD2 PHE 3 1HD PHE 3 -9.623 -8.191 1.262
21 HE1 PHE 3 2HE PHE 3 -7.420 -8.458 -3.141
22 HE2 PHE 3 1HE PHE 3 -8.073 -10.091 0.721
23 HZ PHE 3 HZ PHE 3 -6.991 -10.202 -1.474
24 H GLY 4 H GLY 4 -11.116 -2.877 -0.435
25 HA2 GLY 4 1HA GLY 4 -9.717 -2.359 -2.934
26 HA3 GLY 4 2HA GLY 4 -11.206 -1.629 -2.367
27 H ALA 5 H ALA 5 -9.781 -1.231 0.400
28 HA ALA 5 HA ALA 5 -8.780 1.388 -0.272
29 HB1 ALA 5 1HB ALA 5 -9.838 1.725 1.691
30 HB2 ALA 5 2HB ALA 5 -9.880 -0.019 2.048
31 HB3 ALA 5 3HB ALA 5 -8.442 0.941 2.468
32 H ILE 6 H ILE 6 -7.566 -1.837 0.504
33 HA ILE 6 HA ILE 6 -5.131 -1.351 1.577
34 HB ILE 6 HB ILE 6 -5.825 -3.351 -0.578
35 HG12 ILE 6 1HG1 ILE 6 -6.181 -3.355 2.419
36 HG13 ILE 6 2HG1 ILE 6 -7.380 -3.648 1.175
37 HG21 ILE 6 1HG2 ILE 6 -3.929 -4.577 -0.010
38 HG22 ILE 6 2HG2 ILE 6 -3.343 -2.896 -0.045
39 HG23 ILE 6 3HG2 ILE 6 -3.685 -3.688 1.512
40 HD11 ILE 6 3HD1 ILE 6 -6.280 -5.758 0.539
41 HD12 ILE 6 1HD1 ILE 6 -4.971 -5.447 1.705
42 HD13 ILE 6 2HD1 ILE 6 -6.624 -5.759 2.285
43 H ALA 7 H ALA 7 -6.106 -1.029 -1.882
44 HA ALA 7 HA ALA 7 -3.687 -0.599 -3.035
45 HB1 ALA 7 1HB ALA 7 -5.788 -0.715 -4.270
46 HB2 ALA 7 2HB ALA 7 -6.341 0.809 -3.534
47 HB3 ALA 7 3HB ALA 7 -4.961 0.813 -4.658
48 H GLY 8 H GLY 8 -5.691 1.718 -1.127
49 HA2 GLY 8 1HA GLY 8 -4.055 3.975 -1.560
50 HA3 GLY 8 2HA GLY 8 -5.215 3.741 -0.268
51 H PHE 9 H PHE 9 -3.882 1.192 0.673
52 HA PHE 9 HA PHE 9 -2.012 2.472 2.411
53 HB2 PHE 9 1HB PHE 9 -3.698 0.588 2.939
54 HB3 PHE 9 2HB PHE 9 -2.729 -0.485 1.948
55 HD1 PHE 9 1HD PHE 9 -1.759 2.049 4.516
56 HD2 PHE 9 2HD PHE 9 -1.722 -2.028 3.336
57 HE1 PHE 9 1HE PHE 9 -0.342 1.485 6.509
58 HE2 PHE 9 2HE PHE 9 -0.306 -2.592 5.330
59 HZ PHE 9 HZ PHE 9 0.367 -0.829 6.893
60 H ILE 10 H ILE 10 -1.886 0.638 -0.595
61 HA ILE 10 HA ILE 10 0.648 -0.468 -0.372
62 HB ILE 10 HB ILE 10 -0.835 0.548 -2.799
63 HG12 ILE 10 1HG1 ILE 10 -0.868 -2.066 -1.296
64 HG13 ILE 10 2HG1 ILE 10 -2.217 -1.047 -1.755
65 HG21 ILE 10 1HG2 ILE 10 1.517 -1.354 -2.607
66 HG22 ILE 10 2HG2 ILE 10 0.584 -0.996 -4.080
67 HG23 ILE 10 3HG2 ILE 10 1.534 0.289 -3.294
68 HD11 ILE 10 3HD1 ILE 10 -2.199 -2.928 -3.274
69 HD12 ILE 10 1HD1 ILE 10 -1.634 -1.514 -4.197
70 HD13 ILE 10 2HD1 ILE 10 -0.463 -2.717 -3.606
71 H GLU 11 H GLU 11 -0.425 2.864 -0.837
72 HA GLU 11 HA GLU 11 1.877 3.855 -2.001
73 HB2 GLU 11 1HB GLU 11 0.990 5.992 -1.534
74 HB3 GLU 11 2HB GLU 11 -0.434 4.976 -1.630
75 HG2 GLU 11 1HG GLU 11 -0.332 4.711 0.902
76 HG3 GLU 11 2HG GLU 11 0.976 5.878 0.925
77 H ASN 12 H ASN 12 1.258 2.649 1.209
78 HA ASN 12 HA ASN 12 3.698 3.948 2.131
79 HB2 ASN 12 1HB ASN 12 1.146 3.100 3.482
80 HB3 ASN 12 2HB ASN 12 2.614 2.883 4.414
81 HD21 ASN 12 1HD2 ASN 12 0.459 4.666 4.960
82 HD22 ASN 12 2HD2 ASN 12 1.065 6.289 4.947
83 H ALA 13 H ALA 13 1.843 0.907 1.707
84 HA ALA 13 HA ALA 13 3.775 -0.732 3.025
85 HB1 ALA 13 1HB ALA 13 1.928 -2.011 3.054
86 HB2 ALA 13 2HB ALA 13 1.123 -0.961 1.863
87 HB3 ALA 13 3HB ALA 13 2.164 -2.296 1.313
88 H TRP 14 H TRP 14 3.582 0.874 -0.016
89 HA TRP 14 HA TRP 14 5.360 -1.090 -1.264
90 HB2 TRP 14 1HB TRP 14 3.280 -0.309 -2.443
91 HB3 TRP 14 2HB TRP 14 3.995 1.288 -2.530
92 HD1 TRP 14 HD TRP 14 6.434 -1.582 -3.076
93 HE1 TRP 14 1HE TRP 14 7.190 -1.770 -5.597
94 HE3 TRP 14 3HE TRP 14 3.022 1.721 -4.891
95 HZ2 TRP 14 2HZ TRP 14 6.296 -0.543 -8.014
96 HZ3 TRP 14 3HZ TRP 14 3.031 2.170 -7.343
97 HH2 TRP 14 HH TRP 14 4.594 1.100 -8.888
98 H GLU 15 H GLU 15 5.050 2.521 -1.473
99 HA GLU 15 HA GLU 15 7.553 3.139 -2.008
100 HB2 GLU 15 1HB GLU 15 5.643 4.742 -1.685
101 HB3 GLU 15 2HB GLU 15 5.861 4.623 0.050
102 HG2 GLU 15 1HG GLU 15 8.104 5.576 -0.084
103 HG3 GLU 15 2HG GLU 15 8.104 5.477 -1.834
104 H GLY 16 H GLY 16 6.295 2.279 1.256
105 HA2 GLY 16 1HA GLY 16 8.667 2.848 2.681
106 HA3 GLY 16 2HA GLY 16 7.341 1.823 3.195
107 H MET 17 H MET 17 7.312 -0.195 1.233
108 HA MET 17 HA MET 17 9.427 -1.775 2.147
109 HB2 MET 17 1HB MET 17 7.348 -2.850 1.542
110 HB3 MET 17 2HB MET 17 7.286 -2.041 -0.011
111 HG2 MET 17 1HG MET 17 9.072 -3.400 -0.909
112 HG3 MET 17 2HG MET 17 9.525 -3.991 0.678
113 HE1 MET 17 3HE MET 17 7.106 -6.207 -2.161
114 HE2 MET 17 1HE MET 17 7.136 -4.442 -2.386
115 HE3 MET 17 2HE MET 17 8.662 -5.342 -2.205
116 H ILE 18 H ILE 18 9.373 0.675 -0.197
117 HA ILE 18 HA ILE 18 11.357 -0.626 -1.890
118 HB ILE 18 HB ILE 18 9.899 2.007 -2.140
119 HG12 ILE 18 1HG1 ILE 18 8.685 -0.297 -2.417
120 HG13 ILE 18 2HG1 ILE 18 8.409 0.998 -3.565
121 HG21 ILE 18 1HG2 ILE 18 11.843 2.443 -3.292
122 HG22 ILE 18 2HG2 ILE 18 12.078 0.743 -3.766
123 HG23 ILE 18 3HG2 ILE 18 10.830 1.727 -4.568
124 HD11 ILE 18 3HD1 ILE 18 9.789 0.003 -5.224
125 HD12 ILE 18 1HD1 ILE 18 10.608 -1.042 -4.039
126 HD13 ILE 18 2HD1 ILE 18 8.923 -1.376 -4.505
127 H ASP 19 H ASP 19 10.916 2.060 0.454
128 HA ASP 19 HA ASP 19 12.344 3.471 1.327
129 HB2 ASP 19 1HB ASP 19 13.558 0.745 1.574
130 HB3 ASP 19 2HB ASP 19 14.628 2.079 1.949
131 H GLY 20 H GLY 20 12.829 4.815 -0.561
132 HA2 GLY 20 1HA GLY 20 15.497 5.130 -1.228
133 HA3 GLY 20 2HA GLY 20 14.806 4.109 -2.474
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -13.814 -4.398 1.460
2 HA2 GLY 1 1HA GLY 1 -14.369 -2.129 0.217
3 HA3 GLY 1 2HA GLY 1 -14.987 -1.750 1.812
4 H LEU 2 H LEU 2 -12.931 -3.590 3.128
5 HA LEU 2 HA LEU 2 -10.908 -1.593 3.386
6 HB2 LEU 2 1HB LEU 2 -11.974 -3.300 5.103
7 HB3 LEU 2 2HB LEU 2 -10.667 -4.329 4.553
8 HG LEU 2 HG LEU 2 -9.312 -2.009 5.070
9 HD11 LEU 2 1HD1 LEU 2 -10.535 -1.862 7.600
10 HD12 LEU 2 2HD1 LEU 2 -10.491 -0.616 6.330
11 HD13 LEU 2 3HD1 LEU 2 -11.852 -1.759 6.407
12 HD21 LEU 2 3HD2 LEU 2 -8.998 -4.492 5.799
13 HD22 LEU 2 1HD2 LEU 2 -8.280 -3.184 6.769
14 HD23 LEU 2 2HD2 LEU 2 -9.791 -3.961 7.301
15 H PHE 3 H PHE 3 -11.060 -4.987 2.120
16 HA PHE 3 HA PHE 3 -8.413 -5.193 1.396
17 HB2 PHE 3 1HB PHE 3 -10.731 -6.698 1.279
18 HB3 PHE 3 2HB PHE 3 -10.580 -6.276 -0.415
19 HD1 PHE 3 1HD PHE 3 -8.628 -7.046 -1.715
20 HD2 PHE 3 2HD PHE 3 -9.222 -8.256 2.309
21 HE1 PHE 3 1HE PHE 3 -6.984 -8.915 -2.035
22 HE2 PHE 3 2HE PHE 3 -7.577 -10.125 1.989
23 HZ PHE 3 HZ PHE 3 -6.477 -10.432 -0.178
24 H GLY 4 H GLY 4 -10.983 -3.260 -0.011
25 HA2 GLY 4 1HA GLY 4 -9.638 -2.991 -2.578
26 HA3 GLY 4 2HA GLY 4 -11.159 -2.275 -2.084
27 H ALA 5 H ALA 5 -9.733 -1.453 0.586
28 HA ALA 5 HA ALA 5 -8.882 1.108 -0.427
29 HB1 ALA 5 1HB ALA 5 -10.229 1.303 1.471
30 HB2 ALA 5 2HB ALA 5 -9.491 -0.110 2.266
31 HB3 ALA 5 3HB ALA 5 -8.595 1.425 2.168
32 H ILE 6 H ILE 6 -7.487 -1.925 0.730
33 HA ILE 6 HA ILE 6 -5.073 -1.178 1.695
34 HB ILE 6 HB ILE 6 -5.677 -3.469 -0.179
35 HG12 ILE 6 1HG1 ILE 6 -6.005 -3.113 2.800
36 HG13 ILE 6 2HG1 ILE 6 -7.198 -3.622 1.622
37 HG21 ILE 6 1HG2 ILE 6 -3.596 -3.760 1.895
38 HG22 ILE 6 2HG2 ILE 6 -3.643 -4.343 0.213
39 HG23 ILE 6 3HG2 ILE 6 -3.193 -2.655 0.558
40 HD11 ILE 6 3HD1 ILE 6 -6.529 -5.630 2.725
41 HD12 ILE 6 1HD1 ILE 6 -5.663 -5.661 1.170
42 HD13 ILE 6 2HD1 ILE 6 -4.806 -5.188 2.657
43 H ALA 7 H ALA 7 -6.098 -1.344 -1.759
44 HA ALA 7 HA ALA 7 -3.717 -0.939 -2.998
45 HB1 ALA 7 1HB ALA 7 -5.698 0.733 -4.239
46 HB2 ALA 7 2HB ALA 7 -5.144 -0.887 -4.729
47 HB3 ALA 7 3HB ALA 7 -6.504 -0.717 -3.594
48 H GLY 8 H GLY 8 -5.823 1.494 -1.364
49 HA2 GLY 8 1HA GLY 8 -4.312 3.760 -2.103
50 HA3 GLY 8 2HA GLY 8 -5.447 3.631 -0.773
51 H PHE 9 H PHE 9 -3.968 1.290 0.456
52 HA PHE 9 HA PHE 9 -2.152 2.874 1.991
53 HB2 PHE 9 1HB PHE 9 -3.756 0.559 2.267
54 HB3 PHE 9 2HB PHE 9 -2.134 -0.104 2.233
55 HD1 PHE 9 2HD PHE 9 -0.429 1.385 3.769
56 HD2 PHE 9 1HD PHE 9 -4.610 0.962 4.359
57 HE1 PHE 9 2HE PHE 9 -0.144 1.954 6.198
58 HE2 PHE 9 1HE PHE 9 -4.325 1.533 6.787
59 HZ PHE 9 HZ PHE 9 -2.095 2.022 7.677
60 H ILE 10 H ILE 10 -1.958 0.685 -0.763
61 HA ILE 10 HA ILE 10 0.630 -0.253 -0.445
62 HB ILE 10 HB ILE 10 -0.927 0.371 -2.956
63 HG12 ILE 10 1HG1 ILE 10 -0.805 -2.031 -1.136
64 HG13 ILE 10 2HG1 ILE 10 -2.212 -1.149 -1.698
65 HG21 ILE 10 1HG2 ILE 10 0.558 -1.229 -4.067
66 HG22 ILE 10 2HG2 ILE 10 1.459 0.172 -3.435
67 HG23 ILE 10 3HG2 ILE 10 1.514 -1.385 -2.573
68 HD11 ILE 10 3HD1 ILE 10 -0.471 -3.102 -3.219
69 HD12 ILE 10 1HD1 ILE 10 -2.244 -3.061 -3.067
70 HD13 ILE 10 2HD1 ILE 10 -1.412 -1.877 -4.104
71 H GLU 11 H GLU 11 -0.620 2.933 -1.306
72 HA GLU 11 HA GLU 11 1.615 3.886 -2.623
73 HB2 GLU 11 1HB GLU 11 -0.793 5.016 -1.313
74 HB3 GLU 11 2HB GLU 11 0.575 6.112 -1.331
75 HG2 GLU 11 1HG GLU 11 -0.025 4.638 -3.884
76 HG3 GLU 11 2HG GLU 11 -1.147 5.899 -3.413
77 H ASN 12 H ASN 12 1.092 3.065 0.723
78 HA ASN 12 HA ASN 12 3.469 4.593 1.434
79 HB2 ASN 12 1HB ASN 12 1.085 3.596 3.051
80 HB3 ASN 12 2HB ASN 12 2.589 3.996 3.856
81 HD21 ASN 12 1HD2 ASN 12 -0.273 5.168 3.475
82 HD22 ASN 12 2HD2 ASN 12 -0.005 6.865 3.256
83 H ALA 13 H ALA 13 1.773 1.432 1.425
84 HA ALA 13 HA ALA 13 3.802 0.073 2.907
85 HB1 ALA 13 1HB ALA 13 2.402 -1.780 2.702
86 HB2 ALA 13 2HB ALA 13 1.238 -0.439 2.576
87 HB3 ALA 13 3HB ALA 13 1.795 -1.277 1.107
88 H TRP 14 H TRP 14 3.494 1.270 -0.308
89 HA TRP 14 HA TRP 14 5.361 -0.742 -1.329
90 HB2 TRP 14 1HB TRP 14 3.231 -0.224 -2.561
91 HB3 TRP 14 2HB TRP 14 3.859 1.384 -2.861
92 HD1 TRP 14 HD TRP 14 6.442 -1.405 -3.082
93 HE1 TRP 14 1HE TRP 14 7.181 -1.870 -5.572
94 HE3 TRP 14 3HE TRP 14 2.842 1.466 -5.241
95 HZ2 TRP 14 2HZ TRP 14 6.200 -1.004 -8.108
96 HZ3 TRP 14 3HZ TRP 14 2.803 1.601 -7.730
97 HH2 TRP 14 HH TRP 14 4.405 0.426 -9.153
98 H GLU 15 H GLU 15 4.859 2.792 -1.984
99 HA GLU 15 HA GLU 15 7.320 3.465 -2.635
100 HB2 GLU 15 1HB GLU 15 5.031 4.847 -1.941
101 HB3 GLU 15 2HB GLU 15 6.143 5.389 -0.699
102 HG2 GLU 15 1HG GLU 15 6.932 5.371 -3.640
103 HG3 GLU 15 2HG GLU 15 6.080 6.729 -2.929
104 H GLY 16 H GLY 16 6.192 2.688 0.659
105 HA2 GLY 16 1HA GLY 16 8.470 3.668 2.043
106 HA3 GLY 16 2HA GLY 16 7.268 2.538 2.633
107 H MET 17 H MET 17 7.444 0.353 0.947
108 HA MET 17 HA MET 17 9.769 -0.859 1.902
109 HB2 MET 17 1HB MET 17 7.389 -1.545 0.248
110 HB3 MET 17 2HB MET 17 8.811 -2.471 -0.195
111 HG2 MET 17 1HG MET 17 8.835 -2.516 2.627
112 HG3 MET 17 2HG MET 17 7.137 -2.671 2.223
113 HE1 MET 17 3HE MET 17 6.904 -5.511 2.927
114 HE2 MET 17 1HE MET 17 8.525 -6.241 3.008
115 HE3 MET 17 2HE MET 17 8.227 -4.651 3.749
116 H ILE 18 H ILE 18 9.339 1.311 -0.668
117 HA ILE 18 HA ILE 18 11.414 0.084 -2.309
118 HB ILE 18 HB ILE 18 9.637 2.483 -2.767
119 HG12 ILE 18 1HG1 ILE 18 8.693 0.041 -2.733
120 HG13 ILE 18 2HG1 ILE 18 8.226 1.158 -4.001
121 HG21 ILE 18 1HG2 ILE 18 11.501 2.988 -4.038
122 HG22 ILE 18 2HG2 ILE 18 11.869 1.279 -4.377
123 HG23 ILE 18 3HG2 ILE 18 10.498 2.072 -5.188
124 HD11 ILE 18 3HD1 ILE 18 9.776 0.177 -5.575
125 HD12 ILE 18 1HD1 ILE 18 10.575 -0.764 -4.293
126 HD13 ILE 18 2HD1 ILE 18 8.916 -1.171 -4.793
127 H ASP 19 H ASP 19 10.713 2.930 -0.235
128 HA ASP 19 HA ASP 19 13.190 4.145 -0.827
129 HB2 ASP 19 1HB ASP 19 11.271 5.474 -0.067
130 HB3 ASP 19 2HB ASP 19 11.159 4.546 1.416
131 H GLY 20 H GLY 20 14.433 2.005 -0.366
132 HA2 GLY 20 1HA GLY 20 16.228 1.687 1.266
133 HA3 GLY 20 2HA GLY 20 15.016 1.787 2.528
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -15.052 -3.905 2.333
2 HA2 GLY 1 1HA GLY 1 -14.416 -2.021 0.195
3 HA3 GLY 1 2HA GLY 1 -15.024 -1.655 1.797
4 H LEU 2 H LEU 2 -12.994 -3.545 3.081
5 HA LEU 2 HA LEU 2 -10.941 -1.583 3.367
6 HB2 LEU 2 1HB LEU 2 -12.027 -3.302 5.058
7 HB3 LEU 2 2HB LEU 2 -10.737 -4.342 4.487
8 HG LEU 2 HG LEU 2 -9.050 -2.770 5.226
9 HD11 LEU 2 1HD1 LEU 2 -11.393 -0.948 5.613
10 HD12 LEU 2 2HD1 LEU 2 -9.974 -0.777 6.675
11 HD13 LEU 2 3HD1 LEU 2 -9.790 -0.623 4.912
12 HD21 LEU 2 3HD2 LEU 2 -9.118 -3.591 7.292
13 HD22 LEU 2 1HD2 LEU 2 -10.580 -2.659 7.696
14 HD23 LEU 2 2HD2 LEU 2 -10.726 -4.240 6.892
15 H PHE 3 H PHE 3 -11.143 -4.953 2.045
16 HA PHE 3 HA PHE 3 -8.501 -5.184 1.310
17 HB2 PHE 3 1HB PHE 3 -10.840 -6.655 1.176
18 HB3 PHE 3 2HB PHE 3 -10.688 -6.207 -0.511
19 HD1 PHE 3 2HD PHE 3 -8.155 -7.202 2.051
20 HD2 PHE 3 1HD PHE 3 -9.944 -8.030 -1.707
21 HE1 PHE 3 2HE PHE 3 -6.536 -9.087 1.696
22 HE2 PHE 3 1HE PHE 3 -8.325 -9.915 -2.063
23 HZ PHE 3 HZ PHE 3 -6.641 -10.421 -0.357
24 H GLY 4 H GLY 4 -11.048 -3.194 -0.058
25 HA2 GLY 4 1HA GLY 4 -9.704 -2.899 -2.623
26 HA3 GLY 4 2HA GLY 4 -11.216 -2.174 -2.115
27 H ALA 5 H ALA 5 -9.768 -1.418 0.567
28 HA ALA 5 HA ALA 5 -8.892 1.153 -0.406
29 HB1 ALA 5 1HB ALA 5 -9.472 1.862 1.670
30 HB2 ALA 5 2HB ALA 5 -10.259 0.273 1.819
31 HB3 ALA 5 3HB ALA 5 -8.621 0.519 2.469
32 H ILE 6 H ILE 6 -7.534 -1.916 0.698
33 HA ILE 6 HA ILE 6 -5.110 -1.216 1.675
34 HB ILE 6 HB ILE 6 -5.742 -3.466 -0.239
35 HG12 ILE 6 1HG1 ILE 6 -6.066 -3.158 2.746
36 HG13 ILE 6 2HG1 ILE 6 -7.265 -3.633 1.560
37 HG21 ILE 6 1HG2 ILE 6 -3.820 -4.601 0.639
38 HG22 ILE 6 2HG2 ILE 6 -3.310 -3.002 0.045
39 HG23 ILE 6 3HG2 ILE 6 -3.504 -3.281 1.792
40 HD11 ILE 6 3HD1 ILE 6 -4.847 -5.247 2.477
41 HD12 ILE 6 1HD1 ILE 6 -6.567 -5.644 2.706
42 HD13 ILE 6 2HD1 ILE 6 -5.850 -5.705 1.079
43 H ALA 7 H ALA 7 -6.134 -1.316 -1.783
44 HA ALA 7 HA ALA 7 -3.746 -0.912 -3.012
45 HB1 ALA 7 1HB ALA 7 -5.326 -1.032 -4.622
46 HB2 ALA 7 2HB ALA 7 -6.589 -0.381 -3.549
47 HB3 ALA 7 3HB ALA 7 -5.496 0.727 -4.412
48 H GLY 8 H GLY 8 -5.833 1.511 -1.340
49 HA2 GLY 8 1HA GLY 8 -4.304 3.775 -2.043
50 HA3 GLY 8 2HA GLY 8 -5.441 3.636 -0.716
51 H PHE 9 H PHE 9 -3.983 1.265 0.478
52 HA PHE 9 HA PHE 9 -2.157 2.810 2.038
53 HB2 PHE 9 1HB PHE 9 -3.798 0.557 2.334
54 HB3 PHE 9 2HB PHE 9 -2.220 -0.192 2.183
55 HD1 PHE 9 2HD PHE 9 -3.557 2.826 3.950
56 HD2 PHE 9 1HD PHE 9 -1.306 -0.762 4.208
57 HE1 PHE 9 2HE PHE 9 -3.108 3.282 6.376
58 HE2 PHE 9 1HE PHE 9 -0.856 -0.305 6.635
59 HZ PHE 9 HZ PHE 9 -1.763 1.711 7.690
60 H ILE 10 H ILE 10 -1.978 0.661 -0.749
61 HA ILE 10 HA ILE 10 0.604 -0.303 -0.443
62 HB ILE 10 HB ILE 10 -0.946 0.372 -2.946
63 HG12 ILE 10 1HG1 ILE 10 -0.848 -2.058 -1.163
64 HG13 ILE 10 2HG1 ILE 10 -2.246 -1.156 -1.712
65 HG21 ILE 10 1HG2 ILE 10 1.475 -1.416 -2.590
66 HG22 ILE 10 2HG2 ILE 10 0.527 -1.214 -4.083
67 HG23 ILE 10 3HG2 ILE 10 1.443 0.159 -3.417
68 HD11 ILE 10 3HD1 ILE 10 -0.431 -2.927 -3.406
69 HD12 ILE 10 1HD1 ILE 10 -2.144 -3.202 -3.006
70 HD13 ILE 10 2HD1 ILE 10 -1.686 -1.867 -4.091
71 H GLU 11 H GLU 11 -0.620 2.906 -1.256
72 HA GLU 11 HA GLU 11 1.624 3.861 -2.555
73 HB2 GLU 11 1HB GLU 11 -0.769 4.998 -1.214
74 HB3 GLU 11 2HB GLU 11 0.610 6.080 -1.245
75 HG2 GLU 11 1HG GLU 11 0.771 5.334 -3.799
76 HG3 GLU 11 2HG GLU 11 -0.907 4.877 -3.573
77 H ASN 12 H ASN 12 1.090 2.993 0.777
78 HA ASN 12 HA ASN 12 3.479 4.489 1.514
79 HB2 ASN 12 1HB ASN 12 1.081 3.494 3.108
80 HB3 ASN 12 2HB ASN 12 2.588 3.854 3.927
81 HD21 ASN 12 1HD2 ASN 12 2.096 5.641 5.012
82 HD22 ASN 12 2HD2 ASN 12 1.574 7.142 4.323
83 H ALA 13 H ALA 13 1.757 1.343 1.455
84 HA ALA 13 HA ALA 13 3.773 -0.055 2.918
85 HB1 ALA 13 1HB ALA 13 1.274 -0.606 2.727
86 HB2 ALA 13 2HB ALA 13 1.643 -1.224 1.099
87 HB3 ALA 13 3HB ALA 13 2.404 -1.966 2.526
88 H TRP 14 H TRP 14 3.479 1.194 -0.280
89 HA TRP 14 HA TRP 14 5.330 -0.818 -1.330
90 HB2 TRP 14 1HB TRP 14 3.206 -0.263 -2.556
91 HB3 TRP 14 2HB TRP 14 3.849 1.345 -2.830
92 HD1 TRP 14 HD TRP 14 6.407 -1.461 -3.091
93 HE1 TRP 14 1HE TRP 14 7.146 -1.894 -5.587
94 HE3 TRP 14 3HE TRP 14 2.835 1.472 -5.209
95 HZ2 TRP 14 2HZ TRP 14 6.175 -0.981 -8.111
96 HZ3 TRP 14 3HZ TRP 14 2.799 1.647 -7.696
97 HH2 TRP 14 HH TRP 14 4.393 0.479 -9.135
98 H GLU 15 H GLU 15 4.858 2.731 -1.930
99 HA GLU 15 HA GLU 15 7.326 3.393 -2.567
100 HB2 GLU 15 1HB GLU 15 5.136 4.831 -2.106
101 HB3 GLU 15 2HB GLU 15 5.919 5.180 -0.577
102 HG2 GLU 15 1HG GLU 15 7.853 6.143 -1.676
103 HG3 GLU 15 2HG GLU 15 7.357 5.530 -3.241
104 H GLY 16 H GLY 16 6.188 2.572 0.711
105 HA2 GLY 16 1HA GLY 16 8.435 3.526 2.139
106 HA3 GLY 16 2HA GLY 16 7.264 2.337 2.674
107 H MET 17 H MET 17 7.505 0.202 0.977
108 HA MET 17 HA MET 17 9.931 -0.906 1.844
109 HB2 MET 17 1HB MET 17 7.771 -1.818 -0.132
110 HB3 MET 17 2HB MET 17 9.116 -2.845 0.324
111 HG2 MET 17 1HG MET 17 8.349 -2.297 2.808
112 HG3 MET 17 2HG MET 17 6.832 -1.847 2.053
113 HE1 MET 17 3HE MET 17 6.096 -5.260 3.577
114 HE2 MET 17 1HE MET 17 6.277 -3.513 3.868
115 HE3 MET 17 2HE MET 17 5.067 -4.101 2.703
116 H ILE 18 H ILE 18 9.239 1.193 -0.729
117 HA ILE 18 HA ILE 18 11.245 0.022 -2.488
118 HB ILE 18 HB ILE 18 9.370 2.362 -2.853
119 HG12 ILE 18 1HG1 ILE 18 8.484 -0.093 -2.702
120 HG13 ILE 18 2HG1 ILE 18 7.908 0.980 -3.962
121 HG21 ILE 18 1HG2 ILE 18 11.128 2.880 -4.264
122 HG22 ILE 18 2HG2 ILE 18 11.504 1.174 -4.603
123 HG23 ILE 18 3HG2 ILE 18 10.060 1.927 -5.321
124 HD11 ILE 18 3HD1 ILE 18 8.972 -1.532 -4.399
125 HD12 ILE 18 1HD1 ILE 18 8.882 -0.246 -5.626
126 HD13 ILE 18 2HD1 ILE 18 10.381 -0.486 -4.698
127 H ASP 19 H ASP 19 10.712 2.617 -0.144
128 HA ASP 19 HA ASP 19 13.190 3.860 -0.959
129 HB2 ASP 19 1HB ASP 19 11.036 4.599 1.069
130 HB3 ASP 19 2HB ASP 19 12.534 5.498 0.929
131 H GLY 20 H GLY 20 14.679 2.181 -0.199
132 HA2 GLY 20 1HA GLY 20 15.095 2.238 2.695
133 HA3 GLY 20 2HA GLY 20 14.797 0.676 1.958
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -14.762 -3.951 2.671
2 HA2 GLY 1 1HA GLY 1 -14.315 -1.922 0.596
3 HA3 GLY 1 2HA GLY 1 -14.841 -1.650 2.245
4 H LEU 2 H LEU 2 -12.769 -3.630 3.310
5 HA LEU 2 HA LEU 2 -10.684 -1.702 3.607
6 HB2 LEU 2 1HB LEU 2 -11.705 -3.507 5.250
7 HB3 LEU 2 2HB LEU 2 -10.455 -4.521 4.557
8 HG LEU 2 HG LEU 2 -8.928 -2.408 5.157
9 HD11 LEU 2 1HD1 LEU 2 -10.739 -1.021 5.993
10 HD12 LEU 2 2HD1 LEU 2 -11.174 -2.267 7.186
11 HD13 LEU 2 3HD1 LEU 2 -9.610 -1.427 7.307
12 HD21 LEU 2 3HD2 LEU 2 -8.302 -4.510 5.953
13 HD22 LEU 2 1HD2 LEU 2 -8.558 -3.554 7.432
14 HD23 LEU 2 2HD2 LEU 2 -9.799 -4.712 6.894
15 H PHE 3 H PHE 3 -10.990 -4.986 2.105
16 HA PHE 3 HA PHE 3 -8.388 -5.197 1.228
17 HB2 PHE 3 1HB PHE 3 -10.747 -6.639 1.128
18 HB3 PHE 3 2HB PHE 3 -10.673 -6.097 -0.536
19 HD1 PHE 3 2HD PHE 3 -8.488 -6.586 -1.827
20 HD2 PHE 3 1HD PHE 3 -9.550 -8.526 1.795
21 HE1 PHE 3 2HE PHE 3 -6.909 -8.460 -2.368
22 HE2 PHE 3 1HE PHE 3 -7.971 -10.400 1.253
23 HZ PHE 3 HZ PHE 3 -6.669 -10.345 -0.822
24 H GLY 4 H GLY 4 -10.979 -3.112 0.105
25 HA2 GLY 4 1HA GLY 4 -9.760 -2.682 -2.504
26 HA3 GLY 4 2HA GLY 4 -11.237 -1.975 -1.880
27 H ALA 5 H ALA 5 -9.654 -1.383 0.765
28 HA ALA 5 HA ALA 5 -8.799 1.231 -0.103
29 HB1 ALA 5 1HB ALA 5 -8.281 1.053 2.599
30 HB2 ALA 5 2HB ALA 5 -9.832 1.564 1.888
31 HB3 ALA 5 3HB ALA 5 -9.599 -0.127 2.399
32 H ILE 6 H ILE 6 -7.418 -1.906 0.750
33 HA ILE 6 HA ILE 6 -4.941 -1.284 1.641
34 HB ILE 6 HB ILE 6 -5.693 -3.412 -0.367
35 HG12 ILE 6 1HG1 ILE 6 -5.862 -3.279 2.644
36 HG13 ILE 6 2HG1 ILE 6 -7.124 -3.673 1.494
37 HG21 ILE 6 1HG2 ILE 6 -3.339 -3.319 1.539
38 HG22 ILE 6 2HG2 ILE 6 -3.743 -4.621 0.395
39 HG23 ILE 6 3HG2 ILE 6 -3.255 -3.021 -0.214
40 HD11 ILE 6 3HD1 ILE 6 -5.463 -5.652 0.816
41 HD12 ILE 6 1HD1 ILE 6 -4.828 -5.374 2.455
42 HD13 ILE 6 2HD1 ILE 6 -6.539 -5.808 2.225
43 H ALA 7 H ALA 7 -6.139 -1.171 -1.759
44 HA ALA 7 HA ALA 7 -3.813 -0.715 -3.084
45 HB1 ALA 7 1HB ALA 7 -6.203 0.976 -3.750
46 HB2 ALA 7 2HB ALA 7 -5.171 -0.007 -4.815
47 HB3 ALA 7 3HB ALA 7 -6.387 -0.794 -3.780
48 H GLY 8 H GLY 8 -5.780 1.621 -1.162
49 HA2 GLY 8 1HA GLY 8 -4.263 3.911 -1.809
50 HA3 GLY 8 2HA GLY 8 -5.331 3.701 -0.435
51 H PHE 9 H PHE 9 -3.846 1.253 0.543
52 HA PHE 9 HA PHE 9 -1.920 2.683 2.093
53 HB2 PHE 9 1HB PHE 9 -3.583 0.516 2.444
54 HB3 PHE 9 2HB PHE 9 -2.124 -0.339 1.985
55 HD1 PHE 9 1HD PHE 9 -0.095 -0.170 3.397
56 HD2 PHE 9 2HD PHE 9 -3.781 1.563 4.587
57 HE1 PHE 9 1HE PHE 9 0.746 -0.004 5.756
58 HE2 PHE 9 2HE PHE 9 -2.940 1.730 6.946
59 HZ PHE 9 HZ PHE 9 -0.687 0.945 7.502
60 H ILE 10 H ILE 10 -1.912 0.705 -0.824
61 HA ILE 10 HA ILE 10 0.670 -0.299 -0.713
62 HB ILE 10 HB ILE 10 -0.999 0.540 -3.085
63 HG12 ILE 10 1HG1 ILE 10 -0.838 -1.994 -1.459
64 HG13 ILE 10 2HG1 ILE 10 -2.252 -1.046 -1.879
65 HG21 ILE 10 1HG2 ILE 10 1.354 0.336 -3.700
66 HG22 ILE 10 2HG2 ILE 10 1.419 -1.283 -2.963
67 HG23 ILE 10 3HG2 ILE 10 0.393 -0.994 -4.388
68 HD11 ILE 10 3HD1 ILE 10 -0.544 -2.709 -3.783
69 HD12 ILE 10 1HD1 ILE 10 -2.223 -3.028 -3.289
70 HD13 ILE 10 2HD1 ILE 10 -1.849 -1.624 -4.315
71 H GLU 11 H GLU 11 -0.556 2.965 -1.266
72 HA GLU 11 HA GLU 11 1.629 3.976 -2.622
73 HB2 GLU 11 1HB GLU 11 -0.516 5.175 -0.860
74 HB3 GLU 11 2HB GLU 11 0.801 6.188 -1.417
75 HG2 GLU 11 1HG GLU 11 0.137 4.956 -3.774
76 HG3 GLU 11 2HG GLU 11 -1.424 4.937 -2.979
77 H ASN 12 H ASN 12 1.259 2.913 0.674
78 HA ASN 12 HA ASN 12 3.702 4.340 1.374
79 HB2 ASN 12 1HB ASN 12 1.213 3.864 2.801
80 HB3 ASN 12 2HB ASN 12 2.509 3.078 3.679
81 HD21 ASN 12 1HD2 ASN 12 0.836 5.874 3.301
82 HD22 ASN 12 2HD2 ASN 12 1.955 7.031 3.939
83 H ALA 13 H ALA 13 1.940 1.220 1.217
84 HA ALA 13 HA ALA 13 4.013 -0.283 2.485
85 HB1 ALA 13 1HB ALA 13 1.375 -0.790 1.161
86 HB2 ALA 13 2HB ALA 13 2.521 -2.149 1.255
87 HB3 ALA 13 3HB ALA 13 1.982 -1.335 2.743
88 H TRP 14 H TRP 14 3.567 1.159 -0.611
89 HA TRP 14 HA TRP 14 5.337 -0.802 -1.876
90 HB2 TRP 14 1HB TRP 14 3.159 -0.155 -2.954
91 HB3 TRP 14 2HB TRP 14 3.805 1.461 -3.165
92 HD1 TRP 14 HD TRP 14 6.314 -1.347 -3.727
93 HE1 TRP 14 1HE TRP 14 6.917 -1.635 -6.280
94 HE3 TRP 14 3HE TRP 14 2.671 1.739 -5.475
95 HZ2 TRP 14 2HZ TRP 14 5.827 -0.563 -8.690
96 HZ3 TRP 14 3HZ TRP 14 2.509 2.065 -7.941
97 HH2 TRP 14 HH TRP 14 4.011 0.973 -9.531
98 H GLU 15 H GLU 15 4.878 2.780 -2.238
99 HA GLU 15 HA GLU 15 7.316 3.459 -2.963
100 HB2 GLU 15 1HB GLU 15 5.125 4.849 -2.176
101 HB3 GLU 15 2HB GLU 15 6.162 5.194 -0.807
102 HG2 GLU 15 1HG GLU 15 7.137 6.810 -2.066
103 HG3 GLU 15 2HG GLU 15 7.867 5.533 -3.018
104 H GLY 16 H GLY 16 6.295 2.767 0.428
105 HA2 GLY 16 1HA GLY 16 8.732 3.473 1.659
106 HA3 GLY 16 2HA GLY 16 7.479 2.437 2.311
107 H MET 17 H MET 17 7.400 0.318 0.451
108 HA MET 17 HA MET 17 9.605 -1.155 1.319
109 HB2 MET 17 1HB MET 17 7.211 -1.528 -0.456
110 HB3 MET 17 2HB MET 17 8.540 -2.624 -0.775
111 HG2 MET 17 1HG MET 17 8.419 -2.719 1.995
112 HG3 MET 17 2HG MET 17 6.731 -2.484 1.587
113 HE1 MET 17 3HE MET 17 8.442 -6.371 1.979
114 HE2 MET 17 1HE MET 17 9.637 -5.070 1.769
115 HE3 MET 17 2HE MET 17 8.322 -4.887 2.954
116 H ILE 18 H ILE 18 9.366 1.185 -1.123
117 HA ILE 18 HA ILE 18 11.313 -0.131 -2.847
118 HB ILE 18 HB ILE 18 9.642 2.362 -3.128
119 HG12 ILE 18 1HG1 ILE 18 9.634 -0.319 -4.542
120 HG13 ILE 18 2HG1 ILE 18 8.405 0.308 -3.463
121 HG21 ILE 18 1HG2 ILE 18 10.608 2.701 -5.314
122 HG22 ILE 18 2HG2 ILE 18 11.898 2.718 -4.088
123 HG23 ILE 18 3HG2 ILE 18 11.663 1.281 -5.111
124 HD11 ILE 18 3HD1 ILE 18 7.437 0.921 -5.470
125 HD12 ILE 18 1HD1 ILE 18 8.454 2.361 -5.228
126 HD13 ILE 18 2HD1 ILE 18 9.003 1.054 -6.305
127 H ASP 19 H ASP 19 10.947 2.397 -0.392
128 HA ASP 19 HA ASP 19 13.816 2.818 -0.630
129 HB2 ASP 19 1HB ASP 19 11.606 4.792 -0.731
130 HB3 ASP 19 2HB ASP 19 12.825 5.195 0.461
131 H GLY 20 H GLY 20 14.422 1.635 1.231
132 HA2 GLY 20 1HA GLY 20 13.102 1.020 3.467
133 HA3 GLY 20 2HA GLY 20 14.809 1.416 3.460
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -14.602 -4.450 0.886
2 HA2 GLY 1 1HA GLY 1 -14.247 -2.270 0.469
3 HA3 GLY 1 2HA GLY 1 -14.830 -1.921 2.085
4 H LEU 2 H LEU 2 -12.706 -3.737 3.325
5 HA LEU 2 HA LEU 2 -10.714 -1.705 3.554
6 HB2 LEU 2 1HB LEU 2 -11.702 -3.450 5.278
7 HB3 LEU 2 2HB LEU 2 -10.391 -4.449 4.682
8 HG LEU 2 HG LEU 2 -8.832 -2.500 5.234
9 HD11 LEU 2 1HD1 LEU 2 -10.762 -1.523 7.252
10 HD12 LEU 2 2HD1 LEU 2 -9.527 -0.649 6.313
11 HD13 LEU 2 3HD1 LEU 2 -11.092 -1.050 5.567
12 HD21 LEU 2 3HD2 LEU 2 -9.768 -4.646 6.746
13 HD22 LEU 2 1HD2 LEU 2 -8.295 -3.690 7.034
14 HD23 LEU 2 2HD2 LEU 2 -9.810 -3.259 7.861
15 H PHE 3 H PHE 3 -10.838 -5.085 2.251
16 HA PHE 3 HA PHE 3 -8.206 -5.235 1.455
17 HB2 PHE 3 1HB PHE 3 -10.499 -6.781 1.382
18 HB3 PHE 3 2HB PHE 3 -10.401 -6.337 -0.310
19 HD1 PHE 3 2HD PHE 3 -7.802 -7.263 2.213
20 HD2 PHE 3 1HD PHE 3 -9.603 -8.115 -1.533
21 HE1 PHE 3 2HE PHE 3 -6.132 -9.096 1.827
22 HE2 PHE 3 1HE PHE 3 -7.932 -9.948 -1.919
23 HZ PHE 3 HZ PHE 3 -6.217 -10.417 -0.234
24 H GLY 4 H GLY 4 -10.849 -3.334 0.139
25 HA2 GLY 4 1HA GLY 4 -9.581 -3.012 -2.460
26 HA3 GLY 4 2HA GLY 4 -11.097 -2.325 -1.913
27 H ALA 5 H ALA 5 -9.622 -1.504 0.724
28 HA ALA 5 HA ALA 5 -8.836 1.079 -0.282
29 HB1 ALA 5 1HB ALA 5 -8.440 0.520 2.579
30 HB2 ALA 5 2HB ALA 5 -9.429 1.770 1.788
31 HB3 ALA 5 3HB ALA 5 -10.081 0.128 2.011
32 H ILE 6 H ILE 6 -7.358 -1.942 0.802
33 HA ILE 6 HA ILE 6 -4.928 -1.166 1.700
34 HB ILE 6 HB ILE 6 -5.552 -3.450 -0.175
35 HG12 ILE 6 1HG1 ILE 6 -5.796 -3.124 2.816
36 HG13 ILE 6 2HG1 ILE 6 -7.015 -3.644 1.670
37 HG21 ILE 6 1HG2 ILE 6 -3.521 -4.377 0.263
38 HG22 ILE 6 2HG2 ILE 6 -3.071 -2.657 0.362
39 HG23 ILE 6 3HG2 ILE 6 -3.369 -3.587 1.850
40 HD11 ILE 6 3HD1 ILE 6 -4.657 -5.183 2.760
41 HD12 ILE 6 1HD1 ILE 6 -6.354 -5.692 2.589
42 HD13 ILE 6 2HD1 ILE 6 -5.301 -5.607 1.157
43 H ALA 7 H ALA 7 -6.053 -1.321 -1.722
44 HA ALA 7 HA ALA 7 -3.717 -0.867 -3.029
45 HB1 ALA 7 1HB ALA 7 -5.712 -1.255 -4.265
46 HB2 ALA 7 2HB ALA 7 -6.544 0.126 -3.509
47 HB3 ALA 7 3HB ALA 7 -5.226 0.409 -4.672
48 H GLY 8 H GLY 8 -5.809 1.518 -1.308
49 HA2 GLY 8 1HA GLY 8 -4.359 3.813 -2.072
50 HA3 GLY 8 2HA GLY 8 -5.450 3.656 -0.709
51 H PHE 9 H PHE 9 -3.902 1.332 0.458
52 HA PHE 9 HA PHE 9 -2.064 2.930 1.949
53 HB2 PHE 9 1HB PHE 9 -3.659 0.762 2.444
54 HB3 PHE 9 2HB PHE 9 -2.198 -0.105 2.011
55 HD1 PHE 9 2HD PHE 9 -2.963 2.921 4.078
56 HD2 PHE 9 1HD PHE 9 -1.027 -0.847 3.838
57 HE1 PHE 9 2HE PHE 9 -2.092 3.220 6.412
58 HE2 PHE 9 1HE PHE 9 -0.156 -0.548 6.174
59 HZ PHE 9 HZ PHE 9 -0.700 1.482 7.433
60 H ILE 10 H ILE 10 -1.919 0.768 -0.830
61 HA ILE 10 HA ILE 10 0.694 -0.130 -0.600
62 HB ILE 10 HB ILE 10 -0.949 0.492 -3.056
63 HG12 ILE 10 1HG1 ILE 10 -0.736 -1.924 -1.265
64 HG13 ILE 10 2HG1 ILE 10 -2.171 -1.059 -1.774
65 HG21 ILE 10 1HG2 ILE 10 1.414 0.337 -3.622
66 HG22 ILE 10 2HG2 ILE 10 1.538 -1.214 -2.759
67 HG23 ILE 10 3HG2 ILE 10 0.528 -1.088 -4.219
68 HD11 ILE 10 3HD1 ILE 10 -2.099 -3.079 -3.081
69 HD12 ILE 10 1HD1 ILE 10 -1.616 -1.764 -4.179
70 HD13 ILE 10 2HD1 ILE 10 -0.380 -2.838 -3.479
71 H GLU 11 H GLU 11 -0.634 3.043 -1.394
72 HA GLU 11 HA GLU 11 1.544 4.045 -2.768
73 HB2 GLU 11 1HB GLU 11 -0.466 5.470 -0.969
74 HB3 GLU 11 2HB GLU 11 0.634 6.290 -2.061
75 HG2 GLU 11 1HG GLU 11 -0.482 4.466 -3.786
76 HG3 GLU 11 2HG GLU 11 -1.821 4.697 -2.679
77 H ASN 12 H ASN 12 1.137 3.185 0.584
78 HA ASN 12 HA ASN 12 3.510 4.744 1.238
79 HB2 ASN 12 1HB ASN 12 1.007 4.248 2.648
80 HB3 ASN 12 2HB ASN 12 2.328 3.604 3.603
81 HD21 ASN 12 1HD2 ASN 12 1.563 6.446 1.594
82 HD22 ASN 12 2HD2 ASN 12 2.239 7.646 2.643
83 H ALA 13 H ALA 13 1.865 1.557 1.250
84 HA ALA 13 HA ALA 13 3.960 0.219 2.656
85 HB1 ALA 13 1HB ALA 13 1.361 -0.453 1.346
86 HB2 ALA 13 2HB ALA 13 2.550 -1.769 1.491
87 HB3 ALA 13 3HB ALA 13 1.987 -0.914 2.948
88 H TRP 14 H TRP 14 3.536 1.442 -0.534
89 HA TRP 14 HA TRP 14 5.398 -0.534 -1.634
90 HB2 TRP 14 1HB TRP 14 3.225 -0.032 -2.796
91 HB3 TRP 14 2HB TRP 14 3.823 1.588 -3.096
92 HD1 TRP 14 HD TRP 14 6.436 -1.160 -3.426
93 HE1 TRP 14 1HE TRP 14 7.105 -1.588 -5.942
94 HE3 TRP 14 3HE TRP 14 2.731 1.679 -5.442
95 HZ2 TRP 14 2HZ TRP 14 6.033 -0.711 -8.438
96 HZ3 TRP 14 3HZ TRP 14 2.612 1.841 -7.928
97 HH2 TRP 14 HH TRP 14 4.186 0.703 -9.411
98 H GLU 15 H GLU 15 4.829 3.000 -2.233
99 HA GLU 15 HA GLU 15 7.258 3.715 -2.952
100 HB2 GLU 15 1HB GLU 15 6.682 5.935 -2.405
101 HB3 GLU 15 2HB GLU 15 5.124 5.146 -2.552
102 HG2 GLU 15 1HG GLU 15 4.902 6.317 -0.519
103 HG3 GLU 15 2HG GLU 15 5.329 4.707 0.025
104 H GLY 16 H GLY 16 6.229 2.968 0.394
105 HA2 GLY 16 1HA GLY 16 8.640 3.889 1.626
106 HA3 GLY 16 2HA GLY 16 7.374 2.915 2.344
107 H MET 17 H MET 17 7.287 0.652 0.682
108 HA MET 17 HA MET 17 9.486 -0.755 1.665
109 HB2 MET 17 1HB MET 17 7.169 -1.296 -0.219
110 HB3 MET 17 2HB MET 17 8.461 -2.479 -0.149
111 HG2 MET 17 1HG MET 17 7.165 -1.457 2.406
112 HG3 MET 17 2HG MET 17 6.420 -2.748 1.485
113 HE1 MET 17 3HE MET 17 8.516 -1.579 3.921
114 HE2 MET 17 1HE MET 17 8.307 -3.123 4.780
115 HE3 MET 17 2HE MET 17 9.914 -2.650 4.180
116 H ILE 18 H ILE 18 9.253 1.370 -0.967
117 HA ILE 18 HA ILE 18 11.105 -0.102 -2.643
118 HB ILE 18 HB ILE 18 9.658 2.525 -2.950
119 HG12 ILE 18 1HG1 ILE 18 9.368 -0.027 -4.551
120 HG13 ILE 18 2HG1 ILE 18 8.392 0.329 -3.140
121 HG21 ILE 18 1HG2 ILE 18 10.766 1.686 -5.420
122 HG22 ILE 18 2HG2 ILE 18 11.129 3.155 -4.484
123 HG23 ILE 18 3HG2 ILE 18 12.082 1.676 -4.220
124 HD11 ILE 18 3HD1 ILE 18 8.151 2.694 -4.538
125 HD12 ILE 18 1HD1 ILE 18 8.281 1.511 -5.862
126 HD13 ILE 18 2HD1 ILE 18 6.996 1.343 -4.641
127 H ASP 19 H ASP 19 11.002 2.517 -0.254
128 HA ASP 19 HA ASP 19 13.871 2.819 -0.685
129 HB2 ASP 19 1HB ASP 19 11.890 4.872 0.411
130 HB3 ASP 19 2HB ASP 19 13.616 5.129 0.248
131 H GLY 20 H GLY 20 13.612 0.796 0.887
132 HA2 GLY 20 1HA GLY 20 13.902 1.795 3.620
133 HA3 GLY 20 2HA GLY 20 12.648 0.607 3.329
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -14.701 -4.198 0.805
2 HA2 GLY 1 1HA GLY 1 -14.347 -1.992 0.533
3 HA3 GLY 1 2HA GLY 1 -14.893 -1.734 2.178
4 H LEU 2 H LEU 2 -12.809 -3.692 3.258
5 HA LEU 2 HA LEU 2 -10.751 -1.740 3.584
6 HB2 LEU 2 1HB LEU 2 -11.768 -3.565 5.208
7 HB3 LEU 2 2HB LEU 2 -10.497 -4.561 4.526
8 HG LEU 2 HG LEU 2 -8.854 -2.743 5.188
9 HD11 LEU 2 1HD1 LEU 2 -9.968 -1.469 7.290
10 HD12 LEU 2 2HD1 LEU 2 -9.860 -0.779 5.652
11 HD13 LEU 2 3HD1 LEU 2 -11.370 -1.550 6.195
12 HD21 LEU 2 3HD2 LEU 2 -9.430 -4.928 6.444
13 HD22 LEU 2 1HD2 LEU 2 -8.517 -3.660 7.297
14 HD23 LEU 2 2HD2 LEU 2 -10.258 -3.861 7.603
15 H PHE 3 H PHE 3 -11.001 -5.023 2.066
16 HA PHE 3 HA PHE 3 -8.388 -5.200 1.218
17 HB2 PHE 3 1HB PHE 3 -10.730 -6.668 1.084
18 HB3 PHE 3 2HB PHE 3 -10.643 -6.118 -0.578
19 HD1 PHE 3 1HD PHE 3 -7.448 -6.134 -0.398
20 HD2 PHE 3 2HD PHE 3 -10.510 -8.986 0.310
21 HE1 PHE 3 1HE PHE 3 -5.843 -7.989 -0.929
22 HE2 PHE 3 2HE PHE 3 -8.904 -10.842 -0.220
23 HZ PHE 3 HZ PHE 3 -6.591 -10.321 -0.834
24 H GLY 4 H GLY 4 -10.988 -3.138 0.075
25 HA2 GLY 4 1HA GLY 4 -9.748 -2.684 -2.519
26 HA3 GLY 4 2HA GLY 4 -11.236 -1.992 -1.906
27 H ALA 5 H ALA 5 -9.692 -1.393 0.756
28 HA ALA 5 HA ALA 5 -8.847 1.229 -0.092
29 HB1 ALA 5 1HB ALA 5 -8.438 1.322 2.512
30 HB2 ALA 5 2HB ALA 5 -10.099 1.307 1.872
31 HB3 ALA 5 3HB ALA 5 -9.379 -0.189 2.515
32 H ILE 6 H ILE 6 -7.448 -1.900 0.753
33 HA ILE 6 HA ILE 6 -4.982 -1.255 1.670
34 HB ILE 6 HB ILE 6 -5.699 -3.391 -0.343
35 HG12 ILE 6 1HG1 ILE 6 -5.896 -3.258 2.666
36 HG13 ILE 6 2HG1 ILE 6 -7.144 -3.664 1.506
37 HG21 ILE 6 1HG2 ILE 6 -3.497 -3.726 1.639
38 HG22 ILE 6 2HG2 ILE 6 -3.690 -4.403 0.004
39 HG23 ILE 6 3HG2 ILE 6 -3.188 -2.707 0.211
40 HD11 ILE 6 3HD1 ILE 6 -4.793 -5.336 2.418
41 HD12 ILE 6 1HD1 ILE 6 -6.514 -5.778 2.322
42 HD13 ILE 6 2HD1 ILE 6 -5.544 -5.650 0.836
43 H ALA 7 H ALA 7 -6.157 -1.153 -1.739
44 HA ALA 7 HA ALA 7 -3.829 -0.681 -3.049
45 HB1 ALA 7 1HB ALA 7 -6.002 -0.942 -4.141
46 HB2 ALA 7 2HB ALA 7 -6.556 0.609 -3.464
47 HB3 ALA 7 3HB ALA 7 -5.245 0.581 -4.668
48 H GLY 8 H GLY 8 -5.807 1.633 -1.118
49 HA2 GLY 8 1HA GLY 8 -4.315 3.939 -1.758
50 HA3 GLY 8 2HA GLY 8 -5.370 3.712 -0.378
51 H PHE 9 H PHE 9 -3.873 1.283 0.598
52 HA PHE 9 HA PHE 9 -1.933 2.723 2.122
53 HB2 PHE 9 1HB PHE 9 -3.292 0.055 1.982
54 HB3 PHE 9 2HB PHE 9 -1.651 -0.038 2.590
55 HD1 PHE 9 1HD PHE 9 -4.860 1.767 3.133
56 HD2 PHE 9 2HD PHE 9 -1.219 0.407 4.834
57 HE1 PHE 9 1HE PHE 9 -5.664 2.461 5.407
58 HE2 PHE 9 2HE PHE 9 -2.022 1.099 7.108
59 HZ PHE 9 HZ PHE 9 -4.235 2.118 7.368
60 H ILE 10 H ILE 10 -1.951 0.728 -0.782
61 HA ILE 10 HA ILE 10 0.633 -0.277 -0.686
62 HB ILE 10 HB ILE 10 -1.061 0.548 -3.047
63 HG12 ILE 10 1HG1 ILE 10 -0.870 -1.978 -1.411
64 HG13 ILE 10 2HG1 ILE 10 -2.293 -1.042 -1.822
65 HG21 ILE 10 1HG2 ILE 10 1.358 -1.276 -2.950
66 HG22 ILE 10 2HG2 ILE 10 0.325 -0.968 -4.367
67 HG23 ILE 10 3HG2 ILE 10 1.298 0.350 -3.672
68 HD11 ILE 10 3HD1 ILE 10 -1.855 -1.619 -4.276
69 HD12 ILE 10 1HD1 ILE 10 -0.606 -2.749 -3.700
70 HD13 ILE 10 2HD1 ILE 10 -2.307 -2.995 -3.241
71 H GLU 11 H GLU 11 -0.597 2.985 -1.248
72 HA GLU 11 HA GLU 11 1.577 3.988 -2.629
73 HB2 GLU 11 1HB GLU 11 -0.801 5.006 -1.300
74 HB3 GLU 11 2HB GLU 11 0.559 6.054 -0.949
75 HG2 GLU 11 1HG GLU 11 0.088 5.116 -3.793
76 HG3 GLU 11 2HG GLU 11 -0.866 6.436 -3.148
77 H ASN 12 H ASN 12 1.233 2.944 0.677
78 HA ASN 12 HA ASN 12 3.682 4.375 1.349
79 HB2 ASN 12 1HB ASN 12 1.493 3.178 3.127
80 HB3 ASN 12 2HB ASN 12 2.998 3.814 3.761
81 HD21 ASN 12 1HD2 ASN 12 0.768 4.858 1.184
82 HD22 ASN 12 2HD2 ASN 12 0.486 6.462 1.774
83 H ALA 13 H ALA 13 1.918 1.254 1.224
84 HA ALA 13 HA ALA 13 4.002 -0.241 2.484
85 HB1 ALA 13 1HB ALA 13 2.378 -2.001 1.043
86 HB2 ALA 13 2HB ALA 13 2.156 -1.513 2.740
87 HB3 ALA 13 3HB ALA 13 1.292 -0.649 1.446
88 H TRP 14 H TRP 14 3.531 1.183 -0.616
89 HA TRP 14 HA TRP 14 5.290 -0.786 -1.885
90 HB2 TRP 14 1HB TRP 14 3.104 -0.145 -2.948
91 HB3 TRP 14 2HB TRP 14 3.749 1.470 -3.174
92 HD1 TRP 14 HD TRP 14 6.251 -1.343 -3.741
93 HE1 TRP 14 1HE TRP 14 6.833 -1.645 -6.297
94 HE3 TRP 14 3HE TRP 14 2.595 1.736 -5.476
95 HZ2 TRP 14 2HZ TRP 14 5.723 -0.587 -8.704
96 HZ3 TRP 14 3HZ TRP 14 2.413 2.047 -7.942
97 HH2 TRP 14 HH TRP 14 3.902 0.945 -9.538
98 H GLU 15 H GLU 15 4.829 2.794 -2.262
99 HA GLU 15 HA GLU 15 7.262 3.467 -3.012
100 HB2 GLU 15 1HB GLU 15 6.782 5.671 -2.321
101 HB3 GLU 15 2HB GLU 15 5.194 4.946 -2.477
102 HG2 GLU 15 1HG GLU 15 5.182 4.465 -0.012
103 HG3 GLU 15 2HG GLU 15 6.757 5.218 0.135
104 H GLY 16 H GLY 16 6.271 2.771 0.384
105 HA2 GLY 16 1HA GLY 16 8.741 3.478 1.574
106 HA3 GLY 16 2HA GLY 16 7.471 2.491 2.268
107 H MET 17 H MET 17 7.313 0.340 0.438
108 HA MET 17 HA MET 17 9.477 -1.183 1.320
109 HB2 MET 17 1HB MET 17 7.068 -1.509 -0.441
110 HB3 MET 17 2HB MET 17 8.365 -2.643 -0.761
111 HG2 MET 17 1HG MET 17 8.394 -3.069 1.815
112 HG3 MET 17 2HG MET 17 6.858 -2.227 1.854
113 HE1 MET 17 3HE MET 17 9.000 -4.882 0.728
114 HE2 MET 17 1HE MET 17 7.994 -6.094 1.558
115 HE3 MET 17 2HE MET 17 8.041 -6.043 -0.220
116 H ILE 18 H ILE 18 9.303 1.130 -1.154
117 HA ILE 18 HA ILE 18 11.161 -0.265 -2.902
118 HB ILE 18 HB ILE 18 9.790 2.417 -3.123
119 HG12 ILE 18 1HG1 ILE 18 8.470 0.166 -3.272
120 HG13 ILE 18 2HG1 ILE 18 8.185 1.439 -4.443
121 HG21 ILE 18 1HG2 ILE 18 11.878 1.080 -4.782
122 HG22 ILE 18 2HG2 ILE 18 10.573 1.955 -5.619
123 HG23 ILE 18 3HG2 ILE 18 11.605 2.806 -4.445
124 HD11 ILE 18 3HD1 ILE 18 9.123 0.252 -6.177
125 HD12 ILE 18 1HD1 ILE 18 10.381 -0.462 -5.141
126 HD13 ILE 18 2HD1 ILE 18 8.735 -1.140 -5.138
127 H ASP 19 H ASP 19 11.029 2.173 -0.347
128 HA ASP 19 HA ASP 19 13.898 2.517 -0.733
129 HB2 ASP 19 1HB ASP 19 13.748 4.804 -0.090
130 HB3 ASP 19 2HB ASP 19 12.413 4.573 -1.201
131 H GLY 20 H GLY 20 14.066 4.122 1.791
132 HA2 GLY 20 1HA GLY 20 13.983 3.919 4.057
133 HA3 GLY 20 2HA GLY 20 12.940 2.518 3.908
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -14.646 -3.887 -0.005
2 HA2 GLY 1 1HA GLY 1 -14.407 -1.629 -0.182
3 HA3 GLY 1 2HA GLY 1 -15.056 -1.418 1.432
4 H LEU 2 H LEU 2 -13.124 -3.499 2.563
5 HA LEU 2 HA LEU 2 -11.025 -1.644 3.116
6 HB2 LEU 2 1HB LEU 2 -12.218 -3.492 4.584
7 HB3 LEU 2 2HB LEU 2 -10.940 -4.508 3.948
8 HG LEU 2 HG LEU 2 -9.485 -2.359 4.773
9 HD11 LEU 2 1HD1 LEU 2 -11.995 -1.841 5.866
10 HD12 LEU 2 2HD1 LEU 2 -11.055 -2.530 7.211
11 HD13 LEU 2 3HD1 LEU 2 -10.445 -1.105 6.338
12 HD21 LEU 2 3HD2 LEU 2 -9.170 -3.771 6.929
13 HD22 LEU 2 1HD2 LEU 2 -10.261 -4.928 6.128
14 HD23 LEU 2 2HD2 LEU 2 -8.726 -4.470 5.353
15 H PHE 3 H PHE 3 -11.287 -4.848 1.441
16 HA PHE 3 HA PHE 3 -8.629 -5.093 0.766
17 HB2 PHE 3 1HB PHE 3 -11.008 -6.460 0.408
18 HB3 PHE 3 2HB PHE 3 -10.784 -5.845 -1.217
19 HD1 PHE 3 2HD PHE 3 -8.406 -7.219 1.319
20 HD2 PHE 3 1HD PHE 3 -10.023 -7.525 -2.592
21 HE1 PHE 3 2HE PHE 3 -6.835 -9.112 0.818
22 HE2 PHE 3 1HE PHE 3 -8.452 -9.418 -3.093
23 HZ PHE 3 HZ PHE 3 -6.878 -10.189 -1.382
24 H GLY 4 H GLY 4 -11.067 -2.884 -0.460
25 HA2 GLY 4 1HA GLY 4 -9.632 -2.372 -2.941
26 HA3 GLY 4 2HA GLY 4 -11.134 -1.649 -2.402
27 H ALA 5 H ALA 5 -9.759 -1.222 0.384
28 HA ALA 5 HA ALA 5 -8.764 1.399 -0.287
29 HB1 ALA 5 1HB ALA 5 -10.331 0.655 1.679
30 HB2 ALA 5 2HB ALA 5 -8.811 0.180 2.476
31 HB3 ALA 5 3HB ALA 5 -9.068 1.873 1.986
32 H ILE 6 H ILE 6 -7.540 -1.814 0.512
33 HA ILE 6 HA ILE 6 -5.124 -1.304 1.624
34 HB ILE 6 HB ILE 6 -5.774 -3.324 -0.526
35 HG12 ILE 6 1HG1 ILE 6 -6.176 -3.309 2.465
36 HG13 ILE 6 2HG1 ILE 6 -7.354 -3.618 1.205
37 HG21 ILE 6 1HG2 ILE 6 -3.286 -2.769 0.212
38 HG22 ILE 6 2HG2 ILE 6 -3.723 -3.809 1.588
39 HG23 ILE 6 3HG2 ILE 6 -3.836 -4.437 -0.074
40 HD11 ILE 6 3HD1 ILE 6 -6.837 -5.781 2.018
41 HD12 ILE 6 1HD1 ILE 6 -5.836 -5.645 0.553
42 HD13 ILE 6 2HD1 ILE 6 -5.101 -5.413 2.157
43 H ALA 7 H ALA 7 -6.052 -1.014 -1.850
44 HA ALA 7 HA ALA 7 -3.621 -0.578 -2.975
45 HB1 ALA 7 1HB ALA 7 -6.147 1.007 -3.582
46 HB2 ALA 7 2HB ALA 7 -4.825 0.604 -4.704
47 HB3 ALA 7 3HB ALA 7 -5.889 -0.681 -4.084
48 H GLY 8 H GLY 8 -5.647 1.728 -1.083
49 HA2 GLY 8 1HA GLY 8 -4.032 3.999 -1.517
50 HA3 GLY 8 2HA GLY 8 -5.189 3.755 -0.223
51 H PHE 9 H PHE 9 -3.852 1.233 0.744
52 HA PHE 9 HA PHE 9 -1.975 2.530 2.460
53 HB2 PHE 9 1HB PHE 9 -3.414 -0.075 2.108
54 HB3 PHE 9 2HB PHE 9 -1.824 -0.257 2.824
55 HD1 PHE 9 1HD PHE 9 -1.338 0.657 5.030
56 HD2 PHE 9 2HD PHE 9 -5.193 1.068 3.305
57 HE1 PHE 9 1HE PHE 9 -2.275 1.284 7.272
58 HE2 PHE 9 2HE PHE 9 -6.130 1.696 5.547
59 HZ PHE 9 HZ PHE 9 -4.659 1.796 7.504
60 H ILE 10 H ILE 10 -1.858 0.661 -0.523
61 HA ILE 10 HA ILE 10 0.674 -0.446 -0.295
62 HB ILE 10 HB ILE 10 -0.819 0.542 -2.728
63 HG12 ILE 10 1HG1 ILE 10 -0.834 -2.056 -1.197
64 HG13 ILE 10 2HG1 ILE 10 -2.190 -1.048 -1.662
65 HG21 ILE 10 1HG2 ILE 10 1.519 -1.378 -2.548
66 HG22 ILE 10 2HG2 ILE 10 0.601 -0.969 -4.016
67 HG23 ILE 10 3HG2 ILE 10 1.571 0.278 -3.196
68 HD11 ILE 10 3HD1 ILE 10 -2.240 -2.866 -3.202
69 HD12 ILE 10 1HD1 ILE 10 -1.499 -1.533 -4.120
70 HD13 ILE 10 2HD1 ILE 10 -0.476 -2.821 -3.439
71 H GLU 11 H GLU 11 -0.396 2.881 -0.796
72 HA GLU 11 HA GLU 11 1.904 3.856 -1.978
73 HB2 GLU 11 1HB GLU 11 1.021 6.001 -1.533
74 HB3 GLU 11 2HB GLU 11 -0.405 4.985 -1.613
75 HG2 GLU 11 1HG GLU 11 -0.302 4.751 0.920
76 HG3 GLU 11 2HG GLU 11 1.015 5.908 0.929
77 H ASN 12 H ASN 12 1.292 2.689 1.247
78 HA ASN 12 HA ASN 12 3.737 3.995 2.148
79 HB2 ASN 12 1HB ASN 12 1.334 2.874 3.670
80 HB3 ASN 12 2HB ASN 12 2.836 3.272 4.482
81 HD21 ASN 12 1HD2 ASN 12 0.295 4.445 4.937
82 HD22 ASN 12 2HD2 ASN 12 0.381 6.135 4.568
83 H ALA 13 H ALA 13 1.877 0.952 1.764
84 HA ALA 13 HA ALA 13 3.811 -0.674 3.097
85 HB1 ALA 13 1HB ALA 13 1.154 -0.911 2.378
86 HB2 ALA 13 2HB ALA 13 1.963 -1.961 1.188
87 HB3 ALA 13 3HB ALA 13 2.191 -2.249 2.930
88 H TRP 14 H TRP 14 3.611 0.897 0.037
89 HA TRP 14 HA TRP 14 5.383 -1.084 -1.193
90 HB2 TRP 14 1HB TRP 14 3.300 -0.315 -2.375
91 HB3 TRP 14 2HB TRP 14 4.017 1.281 -2.484
92 HD1 TRP 14 HD TRP 14 6.451 -1.599 -3.002
93 HE1 TRP 14 1HE TRP 14 7.200 -1.818 -5.523
94 HE3 TRP 14 3HE TRP 14 3.038 1.687 -4.845
95 HZ2 TRP 14 2HZ TRP 14 6.301 -0.618 -7.951
96 HZ3 TRP 14 3HZ TRP 14 3.041 2.107 -7.303
97 HH2 TRP 14 HH TRP 14 4.598 1.016 -8.840
98 H GLU 15 H GLU 15 5.077 2.524 -1.442
99 HA GLU 15 HA GLU 15 7.579 3.132 -1.994
100 HB2 GLU 15 1HB GLU 15 5.421 4.597 -1.351
101 HB3 GLU 15 2HB GLU 15 6.292 4.802 0.156
102 HG2 GLU 15 1HG GLU 15 7.203 6.577 -1.026
103 HG3 GLU 15 2HG GLU 15 8.348 5.332 -1.484
104 H GLY 16 H GLY 16 6.380 1.986 1.152
105 HA2 GLY 16 1HA GLY 16 8.706 2.690 2.651
106 HA3 GLY 16 2HA GLY 16 7.415 1.602 3.124
107 H MET 17 H MET 17 7.439 -0.400 1.205
108 HA MET 17 HA MET 17 9.648 -1.887 2.037
109 HB2 MET 17 1HB MET 17 7.169 -2.249 0.562
110 HB3 MET 17 2HB MET 17 8.455 -3.001 -0.361
111 HG2 MET 17 1HG MET 17 8.442 -3.536 2.598
112 HG3 MET 17 2HG MET 17 7.155 -4.274 1.665
113 HE1 MET 17 3HE MET 17 8.558 -6.230 2.993
114 HE2 MET 17 1HE MET 17 7.753 -6.856 1.535
115 HE3 MET 17 2HE MET 17 9.431 -7.326 1.897
116 H ILE 18 H ILE 18 9.422 0.569 -0.289
117 HA ILE 18 HA ILE 18 11.435 -0.635 -2.024
118 HB ILE 18 HB ILE 18 9.791 1.884 -2.278
119 HG12 ILE 18 1HG1 ILE 18 9.618 -0.707 -3.840
120 HG13 ILE 18 2HG1 ILE 18 8.571 -0.298 -2.496
121 HG21 ILE 18 1HG2 ILE 18 11.515 2.543 -3.572
122 HG22 ILE 18 2HG2 ILE 18 12.145 0.891 -3.773
123 HG23 ILE 18 3HG2 ILE 18 10.771 1.445 -4.759
124 HD11 ILE 18 3HD1 ILE 18 7.293 1.060 -3.790
125 HD12 ILE 18 1HD1 ILE 18 8.723 1.909 -4.425
126 HD13 ILE 18 2HD1 ILE 18 8.174 0.400 -5.189
127 H ASP 19 H ASP 19 10.947 1.752 0.536
128 HA ASP 19 HA ASP 19 12.274 3.188 1.498
129 HB2 ASP 19 1HB ASP 19 13.390 0.731 1.755
130 HB3 ASP 19 2HB ASP 19 14.705 1.514 0.902
131 H GLY 20 H GLY 20 11.858 4.030 -1.100
132 HA2 GLY 20 1HA GLY 20 14.277 4.357 -2.597
133 HA3 GLY 20 2HA GLY 20 12.717 5.095 -2.903
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -14.788 -4.122 2.465
2 HA2 GLY 1 1HA GLY 1 -14.263 -2.221 0.302
3 HA3 GLY 1 2HA GLY 1 -14.874 -1.867 1.906
4 H LEU 2 H LEU 2 -12.780 -3.691 3.186
5 HA LEU 2 HA LEU 2 -10.785 -1.666 3.448
6 HB2 LEU 2 1HB LEU 2 -11.812 -3.404 5.157
7 HB3 LEU 2 2HB LEU 2 -10.494 -4.409 4.587
8 HG LEU 2 HG LEU 2 -9.032 -2.275 5.122
9 HD11 LEU 2 1HD1 LEU 2 -10.294 -1.511 7.445
10 HD12 LEU 2 2HD1 LEU 2 -10.234 -0.575 5.932
11 HD13 LEU 2 3HD1 LEU 2 -11.638 -1.611 6.283
12 HD21 LEU 2 3HD2 LEU 2 -10.064 -3.988 7.392
13 HD22 LEU 2 1HD2 LEU 2 -8.921 -4.562 6.155
14 HD23 LEU 2 2HD2 LEU 2 -8.466 -3.222 7.234
15 H PHE 3 H PHE 3 -10.899 -5.049 2.149
16 HA PHE 3 HA PHE 3 -8.254 -5.211 1.404
17 HB2 PHE 3 1HB PHE 3 -10.552 -6.748 1.290
18 HB3 PHE 3 2HB PHE 3 -10.420 -6.308 -0.400
19 HD1 PHE 3 2HD PHE 3 -7.218 -6.224 -0.040
20 HD2 PHE 3 1HD PHE 3 -10.262 -9.106 0.610
21 HE1 PHE 3 2HE PHE 3 -5.548 -8.065 -0.388
22 HE2 PHE 3 1HE PHE 3 -8.593 -10.948 0.261
23 HZ PHE 3 HZ PHE 3 -6.256 -10.405 -0.234
24 H GLY 4 H GLY 4 -10.864 -3.302 0.036
25 HA2 GLY 4 1HA GLY 4 -9.547 -2.991 -2.541
26 HA3 GLY 4 2HA GLY 4 -11.070 -2.296 -2.024
27 H ALA 5 H ALA 5 -9.641 -1.475 0.638
28 HA ALA 5 HA ALA 5 -8.825 1.102 -0.358
29 HB1 ALA 5 1HB ALA 5 -10.294 0.816 1.632
30 HB2 ALA 5 2HB ALA 5 -8.960 -0.010 2.474
31 HB3 ALA 5 3HB ALA 5 -8.798 1.702 2.015
32 H ILE 6 H ILE 6 -7.380 -1.923 0.758
33 HA ILE 6 HA ILE 6 -4.963 -1.155 1.699
34 HB ILE 6 HB ILE 6 -5.563 -3.439 -0.184
35 HG12 ILE 6 1HG1 ILE 6 -5.860 -3.109 2.802
36 HG13 ILE 6 2HG1 ILE 6 -7.060 -3.624 1.633
37 HG21 ILE 6 1HG2 ILE 6 -3.147 -2.953 0.035
38 HG22 ILE 6 2HG2 ILE 6 -3.293 -3.135 1.800
39 HG23 ILE 6 3HG2 ILE 6 -3.608 -4.524 0.733
40 HD11 ILE 6 3HD1 ILE 6 -5.264 -5.571 1.168
41 HD12 ILE 6 1HD1 ILE 6 -4.783 -5.177 2.836
42 HD13 ILE 6 2HD1 ILE 6 -6.450 -5.694 2.488
43 H ALA 7 H ALA 7 -6.026 -1.313 -1.745
44 HA ALA 7 HA ALA 7 -3.664 -0.868 -3.007
45 HB1 ALA 7 1HB ALA 7 -6.179 0.617 -3.792
46 HB2 ALA 7 2HB ALA 7 -4.970 -0.172 -4.834
47 HB3 ALA 7 3HB ALA 7 -6.103 -1.160 -3.881
48 H GLY 8 H GLY 8 -5.781 1.525 -1.330
49 HA2 GLY 8 1HA GLY 8 -4.309 3.815 -2.072
50 HA3 GLY 8 2HA GLY 8 -5.426 3.664 -0.730
51 H PHE 9 H PHE 9 -3.906 1.336 0.470
52 HA PHE 9 HA PHE 9 -2.093 2.932 1.993
53 HB2 PHE 9 1HB PHE 9 -3.690 0.678 2.359
54 HB3 PHE 9 2HB PHE 9 -2.124 -0.077 2.137
55 HD1 PHE 9 1HD PHE 9 -3.881 2.489 4.172
56 HD2 PHE 9 2HD PHE 9 -0.613 -0.207 3.917
57 HE1 PHE 9 1HE PHE 9 -3.325 2.936 6.578
58 HE2 PHE 9 2HE PHE 9 -0.057 0.240 6.324
59 HZ PHE 9 HZ PHE 9 -1.420 1.806 7.625
60 H ILE 10 H ILE 10 -1.902 0.763 -0.778
61 HA ILE 10 HA ILE 10 0.702 -0.144 -0.496
62 HB ILE 10 HB ILE 10 -0.890 0.480 -2.985
63 HG12 ILE 10 1HG1 ILE 10 -0.719 -1.934 -1.185
64 HG13 ILE 10 2HG1 ILE 10 -2.143 -1.065 -1.723
65 HG21 ILE 10 1HG2 ILE 10 1.586 -1.233 -2.635
66 HG22 ILE 10 2HG2 ILE 10 0.603 -1.109 -4.115
67 HG23 ILE 10 3HG2 ILE 10 1.481 0.316 -3.507
68 HD11 ILE 10 3HD1 ILE 10 -1.567 -1.779 -4.111
69 HD12 ILE 10 1HD1 ILE 10 -0.319 -2.836 -3.406
70 HD13 ILE 10 2HD1 ILE 10 -2.035 -3.102 -3.016
71 H GLU 11 H GLU 11 -0.591 3.038 -1.274
72 HA GLU 11 HA GLU 11 1.598 4.038 -2.633
73 HB2 GLU 11 1HB GLU 11 0.622 6.184 -2.288
74 HB3 GLU 11 2HB GLU 11 -0.732 5.073 -2.345
75 HG2 GLU 11 1HG GLU 11 -1.372 5.981 -0.358
76 HG3 GLU 11 2HG GLU 11 -0.083 5.036 0.360
77 H ASN 12 H ASN 12 1.155 3.176 0.722
78 HA ASN 12 HA ASN 12 3.565 4.676 1.380
79 HB2 ASN 12 1HB ASN 12 2.831 4.644 3.703
80 HB3 ASN 12 2HB ASN 12 1.456 5.152 2.741
81 HD21 ASN 12 1HD2 ASN 12 3.014 2.330 4.205
82 HD22 ASN 12 2HD2 ASN 12 1.577 1.417 4.528
83 H ALA 13 H ALA 13 1.838 1.540 1.368
84 HA ALA 13 HA ALA 13 3.859 0.145 2.827
85 HB1 ALA 13 1HB ALA 13 1.913 -1.007 3.075
86 HB2 ALA 13 2HB ALA 13 1.246 -0.410 1.536
87 HB3 ALA 13 3HB ALA 13 2.391 -1.773 1.540
88 H TRP 14 H TRP 14 3.532 1.364 -0.382
89 HA TRP 14 HA TRP 14 5.377 -0.655 -1.428
90 HB2 TRP 14 1HB TRP 14 3.240 -0.109 -2.639
91 HB3 TRP 14 2HB TRP 14 3.886 1.493 -2.937
92 HD1 TRP 14 HD TRP 14 6.435 -1.322 -3.189
93 HE1 TRP 14 1HE TRP 14 7.148 -1.788 -5.687
94 HE3 TRP 14 3HE TRP 14 2.848 1.593 -5.309
95 HZ2 TRP 14 2HZ TRP 14 6.155 -0.906 -8.212
96 HZ3 TRP 14 3HZ TRP 14 2.789 1.736 -7.797
97 HH2 TRP 14 HH TRP 14 4.366 0.547 -9.237
98 H GLU 15 H GLU 15 4.900 2.887 -2.060
99 HA GLU 15 HA GLU 15 7.363 3.542 -2.724
100 HB2 GLU 15 1HB GLU 15 6.824 5.779 -2.208
101 HB3 GLU 15 2HB GLU 15 5.252 5.023 -2.393
102 HG2 GLU 15 1HG GLU 15 5.000 6.213 -0.374
103 HG3 GLU 15 2HG GLU 15 5.376 4.598 0.192
104 H GLY 16 H GLY 16 6.251 2.755 0.571
105 HA2 GLY 16 1HA GLY 16 8.568 3.702 1.929
106 HA3 GLY 16 2HA GLY 16 7.337 2.616 2.544
107 H MET 17 H MET 17 7.414 0.390 0.948
108 HA MET 17 HA MET 17 9.748 -0.850 1.851
109 HB2 MET 17 1HB MET 17 7.279 -1.533 0.327
110 HB3 MET 17 2HB MET 17 8.655 -2.518 -0.129
111 HG2 MET 17 1HG MET 17 7.657 -3.717 1.674
112 HG3 MET 17 2HG MET 17 9.030 -2.914 2.408
113 HE1 MET 17 3HE MET 17 6.077 -3.277 4.800
114 HE2 MET 17 1HE MET 17 7.625 -3.904 4.185
115 HE3 MET 17 2HE MET 17 7.607 -2.504 5.284
116 H ILE 18 H ILE 18 9.254 1.232 -0.781
117 HA ILE 18 HA ILE 18 11.257 -0.104 -2.432
118 HB ILE 18 HB ILE 18 9.478 2.269 -3.006
119 HG12 ILE 18 1HG1 ILE 18 8.469 -0.123 -2.685
120 HG13 ILE 18 2HG1 ILE 18 7.969 0.877 -4.035
121 HG21 ILE 18 1HG2 ILE 18 11.657 0.920 -4.538
122 HG22 ILE 18 2HG2 ILE 18 10.221 1.480 -5.427
123 HG23 ILE 18 3HG2 ILE 18 11.185 2.635 -4.476
124 HD11 ILE 18 3HD1 ILE 18 9.008 -0.461 -5.598
125 HD12 ILE 18 1HD1 ILE 18 10.373 -0.839 -4.520
126 HD13 ILE 18 2HD1 ILE 18 8.822 -1.690 -4.324
127 H ASP 19 H ASP 19 10.694 2.644 -0.272
128 HA ASP 19 HA ASP 19 12.875 4.156 -1.121
129 HB2 ASP 19 1HB ASP 19 10.863 4.779 0.426
130 HB3 ASP 19 2HB ASP 19 11.799 4.066 1.725
131 H GLY 20 H GLY 20 12.458 1.292 0.909
132 HA2 GLY 20 1HA GLY 20 14.716 0.114 1.037
133 HA3 GLY 20 2HA GLY 20 15.209 1.529 1.946
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -14.016 -4.223 1.102
2 HA2 GLY 1 1HA GLY 1 -14.378 -1.880 0.419
3 HA3 GLY 1 2HA GLY 1 -14.948 -1.578 2.048
4 H LEU 2 H LEU 2 -12.901 -3.531 3.206
5 HA LEU 2 HA LEU 2 -10.829 -1.592 3.524
6 HB2 LEU 2 1HB LEU 2 -11.890 -3.370 5.171
7 HB3 LEU 2 2HB LEU 2 -10.619 -4.393 4.531
8 HG LEU 2 HG LEU 2 -9.012 -2.463 5.152
9 HD11 LEU 2 1HD1 LEU 2 -11.531 -1.620 6.570
10 HD12 LEU 2 2HD1 LEU 2 -9.925 -1.232 7.234
11 HD13 LEU 2 3HD1 LEU 2 -10.386 -0.645 5.618
12 HD21 LEU 2 3HD2 LEU 2 -9.994 -3.537 7.700
13 HD22 LEU 2 1HD2 LEU 2 -9.782 -4.767 6.431
14 HD23 LEU 2 2HD2 LEU 2 -8.417 -3.726 6.899
15 H PHE 3 H PHE 3 -11.086 -4.905 2.075
16 HA PHE 3 HA PHE 3 -8.462 -5.125 1.274
17 HB2 PHE 3 1HB PHE 3 -10.815 -6.574 1.132
18 HB3 PHE 3 2HB PHE 3 -10.697 -6.059 -0.538
19 HD1 PHE 3 2HD PHE 3 -8.393 -7.444 2.067
20 HD2 PHE 3 1HD PHE 3 -9.716 -7.568 -1.963
21 HE1 PHE 3 2HE PHE 3 -6.797 -9.324 1.600
22 HE2 PHE 3 1HE PHE 3 -8.122 -9.449 -2.430
23 HZ PHE 3 HZ PHE 3 -6.681 -10.304 -0.642
24 H GLY 4 H GLY 4 -11.024 -3.065 0.042
25 HA2 GLY 4 1HA GLY 4 -9.740 -2.681 -2.541
26 HA3 GLY 4 2HA GLY 4 -11.227 -1.956 -1.963
27 H ALA 5 H ALA 5 -9.727 -1.309 0.706
28 HA ALA 5 HA ALA 5 -8.833 1.279 -0.187
29 HB1 ALA 5 1HB ALA 5 -8.394 1.240 2.495
30 HB2 ALA 5 2HB ALA 5 -9.982 1.578 1.765
31 HB3 ALA 5 3HB ALA 5 -9.606 -0.057 2.360
32 H ILE 6 H ILE 6 -7.482 -1.845 0.764
33 HA ILE 6 HA ILE 6 -5.021 -1.207 1.692
34 HB ILE 6 HB ILE 6 -5.737 -3.381 -0.280
35 HG12 ILE 6 1HG1 ILE 6 -5.969 -3.175 2.723
36 HG13 ILE 6 2HG1 ILE 6 -7.208 -3.594 1.556
37 HG21 ILE 6 1HG2 ILE 6 -3.288 -2.940 -0.038
38 HG22 ILE 6 2HG2 ILE 6 -3.445 -3.312 1.696
39 HG23 ILE 6 3HG2 ILE 6 -3.801 -4.563 0.481
40 HD11 ILE 6 3HD1 ILE 6 -4.818 -5.267 2.418
41 HD12 ILE 6 1HD1 ILE 6 -6.547 -5.669 2.548
42 HD13 ILE 6 2HD1 ILE 6 -5.756 -5.645 0.953
43 H ALA 7 H ALA 7 -6.163 -1.143 -1.726
44 HA ALA 7 HA ALA 7 -3.816 -0.744 -3.029
45 HB1 ALA 7 1HB ALA 7 -5.329 0.794 -4.523
46 HB2 ALA 7 2HB ALA 7 -5.739 -0.930 -4.350
47 HB3 ALA 7 3HB ALA 7 -6.626 0.294 -3.411
48 H GLY 8 H GLY 8 -5.771 1.664 -1.180
49 HA2 GLY 8 1HA GLY 8 -4.197 3.910 -1.834
50 HA3 GLY 8 2HA GLY 8 -5.290 3.744 -0.475
51 H PHE 9 H PHE 9 -3.867 1.282 0.563
52 HA PHE 9 HA PHE 9 -1.939 2.700 2.121
53 HB2 PHE 9 1HB PHE 9 -3.647 0.558 2.464
54 HB3 PHE 9 2HB PHE 9 -2.182 -0.317 2.066
55 HD1 PHE 9 2HD PHE 9 -3.361 2.399 4.340
56 HD2 PHE 9 1HD PHE 9 -0.733 -0.885 3.775
57 HE1 PHE 9 2HE PHE 9 -2.590 2.608 6.718
58 HE2 PHE 9 1HE PHE 9 0.039 -0.676 6.154
59 HZ PHE 9 HZ PHE 9 -0.899 1.068 7.598
60 H ILE 10 H ILE 10 -1.923 0.678 -0.765
61 HA ILE 10 HA ILE 10 0.638 -0.372 -0.596
62 HB ILE 10 HB ILE 10 -0.978 0.462 -3.007
63 HG12 ILE 10 1HG1 ILE 10 -0.890 -2.051 -1.341
64 HG13 ILE 10 2HG1 ILE 10 -2.278 -1.084 -1.797
65 HG21 ILE 10 1HG2 ILE 10 0.407 -1.158 -4.245
66 HG22 ILE 10 2HG2 ILE 10 1.356 0.211 -3.618
67 HG23 ILE 10 3HG2 ILE 10 1.427 -1.370 -2.803
68 HD11 ILE 10 3HD1 ILE 10 -2.372 -2.981 -3.235
69 HD12 ILE 10 1HD1 ILE 10 -1.691 -1.690 -4.254
70 HD13 ILE 10 2HD1 ILE 10 -0.622 -2.928 -3.554
71 H GLU 11 H GLU 11 -0.517 2.905 -1.219
72 HA GLU 11 HA GLU 11 1.707 3.855 -2.555
73 HB2 GLU 11 1HB GLU 11 0.804 6.004 -2.183
74 HB3 GLU 11 2HB GLU 11 -0.604 4.961 -2.141
75 HG2 GLU 11 1HG GLU 11 -0.368 4.864 0.396
76 HG3 GLU 11 2HG GLU 11 0.912 6.053 0.274
77 H ASN 12 H ASN 12 1.265 2.849 0.751
78 HA ASN 12 HA ASN 12 3.722 4.242 1.468
79 HB2 ASN 12 1HB ASN 12 1.239 3.492 2.973
80 HB3 ASN 12 2HB ASN 12 2.735 3.267 3.858
81 HD21 ASN 12 1HD2 ASN 12 0.513 5.183 4.172
82 HD22 ASN 12 2HD2 ASN 12 1.212 6.768 4.159
83 H ALA 13 H ALA 13 1.906 1.153 1.330
84 HA ALA 13 HA ALA 13 3.930 -0.368 2.654
85 HB1 ALA 13 1HB ALA 13 1.247 -0.688 2.067
86 HB2 ALA 13 2HB ALA 13 2.025 -1.788 0.905
87 HB3 ALA 13 3HB ALA 13 2.332 -1.973 2.648
88 H TRP 14 H TRP 14 3.560 1.034 -0.471
89 HA TRP 14 HA TRP 14 5.313 -0.978 -1.678
90 HB2 TRP 14 1HB TRP 14 3.164 -0.308 -2.799
91 HB3 TRP 14 2HB TRP 14 3.845 1.291 -3.024
92 HD1 TRP 14 HD TRP 14 6.308 -1.570 -3.504
93 HE1 TRP 14 1HE TRP 14 6.945 -1.908 -6.042
94 HE3 TRP 14 3HE TRP 14 2.751 1.557 -5.356
95 HZ2 TRP 14 2HZ TRP 14 5.913 -0.854 -8.485
96 HZ3 TRP 14 3HZ TRP 14 2.634 1.847 -7.830
97 HH2 TRP 14 HH TRP 14 4.140 0.702 -9.377
98 H GLU 15 H GLU 15 4.926 2.606 -2.100
99 HA GLU 15 HA GLU 15 7.389 3.227 -2.796
100 HB2 GLU 15 1HB GLU 15 5.609 4.751 -0.847
101 HB3 GLU 15 2HB GLU 15 7.031 5.448 -1.595
102 HG2 GLU 15 1HG GLU 15 5.402 4.178 -3.642
103 HG3 GLU 15 2HG GLU 15 4.396 5.252 -2.692
104 H GLY 16 H GLY 16 6.346 2.269 0.473
105 HA2 GLY 16 1HA GLY 16 8.590 3.120 1.923
106 HA3 GLY 16 2HA GLY 16 7.492 1.826 2.355
107 H MET 17 H MET 17 7.791 -0.162 0.556
108 HA MET 17 HA MET 17 10.305 -1.187 1.226
109 HB2 MET 17 1HB MET 17 9.558 -3.125 -0.157
110 HB3 MET 17 2HB MET 17 8.243 -2.567 0.857
111 HG2 MET 17 1HG MET 17 7.037 -1.677 -0.941
112 HG3 MET 17 2HG MET 17 8.475 -1.339 -1.885
113 HE1 MET 17 3HE MET 17 9.428 -4.056 -3.783
114 HE2 MET 17 1HE MET 17 10.049 -2.964 -2.521
115 HE3 MET 17 2HE MET 17 9.912 -4.709 -2.199
116 H ILE 18 H ILE 18 9.409 1.065 -1.147
117 HA ILE 18 HA ILE 18 11.339 0.139 -3.106
118 HB ILE 18 HB ILE 18 9.410 2.459 -3.051
119 HG12 ILE 18 1HG1 ILE 18 9.391 -0.097 -4.682
120 HG13 ILE 18 2HG1 ILE 18 8.417 0.186 -3.254
121 HG21 ILE 18 1HG2 ILE 18 10.432 3.390 -4.786
122 HG22 ILE 18 2HG2 ILE 18 11.786 2.264 -4.532
123 HG23 ILE 18 3HG2 ILE 18 10.477 1.841 -5.661
124 HD11 ILE 18 3HD1 ILE 18 7.824 0.932 -5.943
125 HD12 ILE 18 1HD1 ILE 18 6.873 1.291 -4.483
126 HD13 ILE 18 2HD1 ILE 18 8.108 2.443 -5.047
127 H ASP 19 H ASP 19 10.947 2.487 -0.475
128 HA ASP 19 HA ASP 19 13.745 3.124 -0.823
129 HB2 ASP 19 1HB ASP 19 11.477 4.992 -1.161
130 HB3 ASP 19 2HB ASP 19 12.622 5.548 0.043
131 H GLY 20 H GLY 20 13.838 1.651 1.100
132 HA2 GLY 20 1HA GLY 20 12.366 1.956 3.433
133 HA3 GLY 20 2HA GLY 20 13.966 1.255 3.307
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -14.602 -4.067 0.691
2 HA2 GLY 1 1HA GLY 1 -14.354 -1.830 0.411
3 HA3 GLY 1 2HA GLY 1 -14.918 -1.557 2.048
4 H LEU 2 H LEU 2 -12.883 -3.548 3.160
5 HA LEU 2 HA LEU 2 -10.795 -1.631 3.508
6 HB2 LEU 2 1HB LEU 2 -11.865 -3.431 5.125
7 HB3 LEU 2 2HB LEU 2 -10.605 -4.452 4.464
8 HG LEU 2 HG LEU 2 -9.240 -2.127 5.130
9 HD11 LEU 2 1HD1 LEU 2 -9.924 -1.887 7.596
10 HD12 LEU 2 2HD1 LEU 2 -10.924 -1.080 6.363
11 HD13 LEU 2 3HD1 LEU 2 -11.474 -2.607 7.094
12 HD21 LEU 2 3HD2 LEU 2 -9.558 -4.833 6.381
13 HD22 LEU 2 1HD2 LEU 2 -8.160 -4.119 5.542
14 HD23 LEU 2 2HD2 LEU 2 -8.574 -3.592 7.192
15 H PHE 3 H PHE 3 -11.084 -4.915 1.999
16 HA PHE 3 HA PHE 3 -8.464 -5.143 1.186
17 HB2 PHE 3 1HB PHE 3 -10.830 -6.568 1.025
18 HB3 PHE 3 2HB PHE 3 -10.711 -6.024 -0.636
19 HD1 PHE 3 1HD PHE 3 -7.965 -7.028 1.667
20 HD2 PHE 3 2HD PHE 3 -10.196 -7.963 -1.820
21 HE1 PHE 3 1HE PHE 3 -6.387 -8.913 1.163
22 HE2 PHE 3 2HE PHE 3 -8.617 -9.849 -2.323
23 HZ PHE 3 HZ PHE 3 -6.732 -10.302 -0.826
24 H GLY 4 H GLY 4 -11.011 -3.038 0.000
25 HA2 GLY 4 1HA GLY 4 -9.730 -2.618 -2.580
26 HA3 GLY 4 2HA GLY 4 -11.210 -1.891 -1.984
27 H ALA 5 H ALA 5 -9.697 -1.306 0.692
28 HA ALA 5 HA ALA 5 -8.782 1.291 -0.155
29 HB1 ALA 5 1HB ALA 5 -9.769 -0.007 2.267
30 HB2 ALA 5 2HB ALA 5 -8.313 0.962 2.594
31 HB3 ALA 5 3HB ALA 5 -9.735 1.720 1.839
32 H ILE 6 H ILE 6 -7.455 -1.862 0.734
33 HA ILE 6 HA ILE 6 -4.988 -1.264 1.667
34 HB ILE 6 HB ILE 6 -5.728 -3.394 -0.342
35 HG12 ILE 6 1HG1 ILE 6 -5.951 -3.242 2.664
36 HG13 ILE 6 2HG1 ILE 6 -7.196 -3.629 1.493
37 HG21 ILE 6 1HG2 ILE 6 -3.739 -4.430 0.006
38 HG22 ILE 6 2HG2 ILE 6 -3.206 -2.750 0.255
39 HG23 ILE 6 3HG2 ILE 6 -3.559 -3.788 1.657
40 HD11 ILE 6 3HD1 ILE 6 -4.791 -5.337 2.258
41 HD12 ILE 6 1HD1 ILE 6 -6.514 -5.714 2.497
42 HD13 ILE 6 2HD1 ILE 6 -5.827 -5.695 0.856
43 H ALA 7 H ALA 7 -6.128 -1.144 -1.752
44 HA ALA 7 HA ALA 7 -3.776 -0.730 -3.042
45 HB1 ALA 7 1HB ALA 7 -5.800 -0.937 -4.281
46 HB2 ALA 7 2HB ALA 7 -6.545 0.446 -3.442
47 HB3 ALA 7 3HB ALA 7 -5.217 0.714 -4.597
48 H GLY 8 H GLY 8 -5.736 1.646 -1.162
49 HA2 GLY 8 1HA GLY 8 -4.170 3.907 -1.788
50 HA3 GLY 8 2HA GLY 8 -5.263 3.720 -0.431
51 H PHE 9 H PHE 9 -3.835 1.249 0.576
52 HA PHE 9 HA PHE 9 -1.912 2.652 2.155
53 HB2 PHE 9 1HB PHE 9 -3.606 0.619 2.627
54 HB3 PHE 9 2HB PHE 9 -2.321 -0.371 1.966
55 HD1 PHE 9 1HD PHE 9 -3.042 2.106 4.637
56 HD2 PHE 9 2HD PHE 9 -0.530 -1.048 3.313
57 HE1 PHE 9 1HE PHE 9 -1.926 2.051 6.885
58 HE2 PHE 9 2HE PHE 9 0.587 -1.102 5.561
59 HZ PHE 9 HZ PHE 9 -0.125 0.448 7.319
60 H ILE 10 H ILE 10 -1.888 0.666 -0.756
61 HA ILE 10 HA ILE 10 0.675 -0.379 -0.600
62 HB ILE 10 HB ILE 10 -0.940 0.481 -3.002
63 HG12 ILE 10 1HG1 ILE 10 -0.848 -2.052 -1.367
64 HG13 ILE 10 2HG1 ILE 10 -2.239 -1.083 -1.813
65 HG21 ILE 10 1HG2 ILE 10 0.449 -1.097 -4.270
66 HG22 ILE 10 2HG2 ILE 10 1.409 0.239 -3.592
67 HG23 ILE 10 3HG2 ILE 10 1.456 -1.368 -2.828
68 HD11 ILE 10 3HD1 ILE 10 -1.834 -1.678 -4.233
69 HD12 ILE 10 1HD1 ILE 10 -0.519 -2.755 -3.702
70 HD13 ILE 10 2HD1 ILE 10 -2.197 -3.087 -3.208
71 H GLU 11 H GLU 11 -0.487 2.903 -1.182
72 HA GLU 11 HA GLU 11 1.736 3.875 -2.504
73 HB2 GLU 11 1HB GLU 11 -0.343 5.170 -0.709
74 HB3 GLU 11 2HB GLU 11 0.942 6.114 -1.436
75 HG2 GLU 11 1HG GLU 11 0.188 5.678 -3.652
76 HG3 GLU 11 2HG GLU 11 -0.743 4.276 -3.164
77 H ASN 12 H ASN 12 1.294 2.826 0.789
78 HA ASN 12 HA ASN 12 3.746 4.215 1.526
79 HB2 ASN 12 1HB ASN 12 1.558 2.996 3.292
80 HB3 ASN 12 2HB ASN 12 3.016 3.750 3.907
81 HD21 ASN 12 1HD2 ASN 12 0.453 4.421 1.519
82 HD22 ASN 12 2HD2 ASN 12 0.168 6.071 1.962
83 H ALA 13 H ALA 13 1.938 1.123 1.346
84 HA ALA 13 HA ALA 13 3.964 -0.409 2.653
85 HB1 ALA 13 1HB ALA 13 1.258 -0.725 1.772
86 HB2 ALA 13 2HB ALA 13 2.232 -2.007 1.014
87 HB3 ALA 13 3HB ALA 13 2.227 -1.824 2.784
88 H TRP 14 H TRP 14 3.594 1.032 -0.454
89 HA TRP 14 HA TRP 14 5.352 -0.961 -1.684
90 HB2 TRP 14 1HB TRP 14 3.203 -0.281 -2.800
91 HB3 TRP 14 2HB TRP 14 3.880 1.323 -3.004
92 HD1 TRP 14 HD TRP 14 6.351 -1.527 -3.518
93 HE1 TRP 14 1HE TRP 14 6.990 -1.832 -6.060
94 HE3 TRP 14 3HE TRP 14 2.788 1.614 -5.333
95 HZ2 TRP 14 2HZ TRP 14 5.958 -0.749 -8.490
96 HZ3 TRP 14 3HZ TRP 14 2.672 1.934 -7.802
97 HH2 TRP 14 HH TRP 14 4.183 0.815 -9.363
98 H GLU 15 H GLU 15 4.958 2.627 -2.062
99 HA GLU 15 HA GLU 15 7.419 3.263 -2.748
100 HB2 GLU 15 1HB GLU 15 5.693 4.950 -2.557
101 HB3 GLU 15 2HB GLU 15 5.581 4.737 -0.821
102 HG2 GLU 15 1HG GLU 15 8.303 5.431 -1.847
103 HG3 GLU 15 2HG GLU 15 7.092 6.684 -2.034
104 H GLY 16 H GLY 16 6.334 2.559 0.615
105 HA2 GLY 16 1HA GLY 16 8.659 3.283 1.972
106 HA3 GLY 16 2HA GLY 16 7.483 2.091 2.488
107 H MET 17 H MET 17 7.640 0.054 0.637
108 HA MET 17 HA MET 17 10.075 -1.137 1.389
109 HB2 MET 17 1HB MET 17 8.237 -2.634 1.160
110 HB3 MET 17 2HB MET 17 7.669 -1.868 -0.311
111 HG2 MET 17 1HG MET 17 8.654 -4.051 -0.864
112 HG3 MET 17 2HG MET 17 9.648 -2.783 -1.550
113 HE1 MET 17 3HE MET 17 10.314 -6.179 0.383
114 HE2 MET 17 1HE MET 17 10.398 -5.462 2.011
115 HE3 MET 17 2HE MET 17 8.939 -5.239 1.014
116 H ILE 18 H ILE 18 9.230 1.009 -1.144
117 HA ILE 18 HA ILE 18 11.176 -0.086 -2.999
118 HB ILE 18 HB ILE 18 9.325 2.295 -3.186
119 HG12 ILE 18 1HG1 ILE 18 8.376 -0.120 -3.086
120 HG13 ILE 18 2HG1 ILE 18 7.811 0.978 -4.329
121 HG21 ILE 18 1HG2 ILE 18 10.972 2.874 -4.677
122 HG22 ILE 18 2HG2 ILE 18 11.404 1.185 -5.036
123 HG23 ILE 18 3HG2 ILE 18 9.915 1.885 -5.715
124 HD11 ILE 18 3HD1 ILE 18 8.842 -0.185 -6.035
125 HD12 ILE 18 1HD1 ILE 18 10.230 -0.646 -5.021
126 HD13 ILE 18 2HD1 ILE 18 8.691 -1.528 -4.876
127 H ASP 19 H ASP 19 10.786 2.427 -0.539
128 HA ASP 19 HA ASP 19 13.560 3.125 -1.037
129 HB2 ASP 19 1HB ASP 19 11.166 4.916 -0.995
130 HB3 ASP 19 2HB ASP 19 12.538 5.494 -0.071
131 H GLY 20 H GLY 20 14.159 1.852 0.839
132 HA2 GLY 20 1HA GLY 20 12.990 1.489 3.209
133 HA3 GLY 20 2HA GLY 20 14.716 1.741 3.040
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -14.126 -4.211 1.003
2 HA2 GLY 1 1HA GLY 1 -14.458 -1.869 0.321
3 HA3 GLY 1 2HA GLY 1 -15.040 -1.557 1.944
4 H LEU 2 H LEU 2 -13.014 -3.517 3.128
5 HA LEU 2 HA LEU 2 -10.933 -1.591 3.454
6 HB2 LEU 2 1HB LEU 2 -12.019 -3.354 5.099
7 HB3 LEU 2 2HB LEU 2 -10.749 -4.388 4.476
8 HG LEU 2 HG LEU 2 -9.166 -2.398 5.090
9 HD11 LEU 2 1HD1 LEU 2 -10.855 -1.750 7.374
10 HD12 LEU 2 2HD1 LEU 2 -9.941 -0.684 6.281
11 HD13 LEU 2 3HD1 LEU 2 -11.571 -1.233 5.829
12 HD21 LEU 2 3HD2 LEU 2 -9.060 -3.289 7.479
13 HD22 LEU 2 1HD2 LEU 2 -10.420 -4.345 7.026
14 HD23 LEU 2 2HD2 LEU 2 -8.869 -4.469 6.160
15 H PHE 3 H PHE 3 -11.200 -4.909 2.018
16 HA PHE 3 HA PHE 3 -8.571 -5.150 1.240
17 HB2 PHE 3 1HB PHE 3 -10.931 -6.584 1.086
18 HB3 PHE 3 2HB PHE 3 -10.795 -6.079 -0.586
19 HD1 PHE 3 1HD PHE 3 -8.230 -7.184 1.896
20 HD2 PHE 3 2HD PHE 3 -10.106 -7.882 -1.846
21 HE1 PHE 3 1HE PHE 3 -6.643 -9.076 1.454
22 HE2 PHE 3 2HE PHE 3 -8.518 -9.775 -2.288
23 HZ PHE 3 HZ PHE 3 -6.806 -10.350 -0.633
24 H GLY 4 H GLY 4 -11.108 -3.079 -0.023
25 HA2 GLY 4 1HA GLY 4 -9.800 -2.715 -2.597
26 HA3 GLY 4 2HA GLY 4 -11.289 -1.979 -2.036
27 H ALA 5 H ALA 5 -9.805 -1.330 0.643
28 HA ALA 5 HA ALA 5 -8.889 1.250 -0.254
29 HB1 ALA 5 1HB ALA 5 -9.073 1.869 2.004
30 HB2 ALA 5 2HB ALA 5 -10.348 0.641 1.823
31 HB3 ALA 5 3HB ALA 5 -8.797 0.208 2.583
32 H ILE 6 H ILE 6 -7.564 -1.877 0.723
33 HA ILE 6 HA ILE 6 -5.109 -1.251 1.671
34 HB ILE 6 HB ILE 6 -5.820 -3.428 -0.299
35 HG12 ILE 6 1HG1 ILE 6 -6.078 -3.208 2.701
36 HG13 ILE 6 2HG1 ILE 6 -7.309 -3.625 1.525
37 HG21 ILE 6 1HG2 ILE 6 -3.681 -3.793 1.731
38 HG22 ILE 6 2HG2 ILE 6 -3.827 -4.438 0.078
39 HG23 ILE 6 3HG2 ILE 6 -3.305 -2.755 0.336
40 HD11 ILE 6 3HD1 ILE 6 -5.727 -5.656 0.944
41 HD12 ILE 6 1HD1 ILE 6 -5.008 -5.313 2.536
42 HD13 ILE 6 2HD1 ILE 6 -6.735 -5.728 2.410
43 H ALA 7 H ALA 7 -6.205 -1.221 -1.766
44 HA ALA 7 HA ALA 7 -3.837 -0.824 -3.033
45 HB1 ALA 7 1HB ALA 7 -5.467 0.821 -4.447
46 HB2 ALA 7 2HB ALA 7 -5.570 -0.955 -4.520
47 HB3 ALA 7 3HB ALA 7 -6.681 -0.042 -3.472
48 H GLY 8 H GLY 8 -5.838 1.586 -1.239
49 HA2 GLY 8 1HA GLY 8 -4.275 3.840 -1.901
50 HA3 GLY 8 2HA GLY 8 -5.387 3.681 -0.554
51 H PHE 9 H PHE 9 -3.958 1.243 0.532
52 HA PHE 9 HA PHE 9 -2.065 2.696 2.102
53 HB2 PHE 9 1HB PHE 9 -3.761 0.626 2.548
54 HB3 PHE 9 2HB PHE 9 -2.393 -0.332 2.014
55 HD1 PHE 9 1HD PHE 9 -2.516 2.739 4.130
56 HD2 PHE 9 2HD PHE 9 -1.543 -1.384 3.891
57 HE1 PHE 9 1HE PHE 9 -1.547 2.834 6.443
58 HE2 PHE 9 2HE PHE 9 -0.574 -1.290 6.204
59 HZ PHE 9 HZ PHE 9 -0.587 0.817 7.452
60 H ILE 10 H ILE 10 -1.990 0.640 -0.758
61 HA ILE 10 HA ILE 10 0.576 -0.387 -0.540
62 HB ILE 10 HB ILE 10 -1.010 0.404 -2.985
63 HG12 ILE 10 1HG1 ILE 10 -0.926 -2.087 -1.285
64 HG13 ILE 10 2HG1 ILE 10 -2.316 -1.138 -1.774
65 HG21 ILE 10 1HG2 ILE 10 1.383 -1.440 -2.739
66 HG22 ILE 10 2HG2 ILE 10 0.404 -1.180 -4.202
67 HG23 ILE 10 3HG2 ILE 10 1.359 0.159 -3.521
68 HD11 ILE 10 3HD1 ILE 10 -1.856 -1.787 -4.178
69 HD12 ILE 10 1HD1 ILE 10 -0.566 -2.860 -3.586
70 HD13 ILE 10 2HD1 ILE 10 -2.258 -3.165 -3.125
71 H GLU 11 H GLU 11 -0.596 2.872 -1.220
72 HA GLU 11 HA GLU 11 1.640 3.824 -2.536
73 HB2 GLU 11 1HB GLU 11 0.713 5.970 -2.205
74 HB3 GLU 11 2HB GLU 11 -0.687 4.915 -2.168
75 HG2 GLU 11 1HG GLU 11 -0.506 4.858 0.366
76 HG3 GLU 11 2HG GLU 11 0.791 6.032 0.261
77 H ASN 12 H ASN 12 1.158 2.857 0.777
78 HA ASN 12 HA ASN 12 3.592 4.278 1.512
79 HB2 ASN 12 1HB ASN 12 1.294 3.171 3.202
80 HB3 ASN 12 2HB ASN 12 2.796 3.729 3.912
81 HD21 ASN 12 1HD2 ASN 12 3.524 5.922 2.764
82 HD22 ASN 12 2HD2 ASN 12 2.333 7.179 2.809
83 H ALA 13 H ALA 13 1.804 1.172 1.385
84 HA ALA 13 HA ALA 13 3.820 -0.315 2.757
85 HB1 ALA 13 1HB ALA 13 1.904 -1.715 0.974
86 HB2 ALA 13 2HB ALA 13 2.271 -1.982 2.695
87 HB3 ALA 13 3HB ALA 13 1.164 -0.674 2.214
88 H TRP 14 H TRP 14 3.485 1.046 -0.389
89 HA TRP 14 HA TRP 14 5.271 -0.966 -1.545
90 HB2 TRP 14 1HB TRP 14 3.134 -0.328 -2.706
91 HB3 TRP 14 2HB TRP 14 3.804 1.274 -2.941
92 HD1 TRP 14 HD TRP 14 6.298 -1.573 -3.350
93 HE1 TRP 14 1HE TRP 14 6.975 -1.936 -5.875
94 HE3 TRP 14 3HE TRP 14 2.744 1.501 -5.292
95 HZ2 TRP 14 2HZ TRP 14 5.970 -0.921 -8.345
96 HZ3 TRP 14 3HZ TRP 14 2.661 1.759 -7.770
97 HH2 TRP 14 HH TRP 14 4.198 0.609 -9.282
98 H GLU 15 H GLU 15 4.862 2.609 -2.018
99 HA GLU 15 HA GLU 15 7.328 3.241 -2.686
100 HB2 GLU 15 1HB GLU 15 5.355 4.803 -2.384
101 HB3 GLU 15 2HB GLU 15 5.713 4.860 -0.669
102 HG2 GLU 15 1HG GLU 15 7.702 6.066 -0.974
103 HG3 GLU 15 2HG GLU 15 7.961 5.446 -2.593
104 H GLY 16 H GLY 16 6.246 2.321 0.582
105 HA2 GLY 16 1HA GLY 16 8.469 3.205 2.047
106 HA3 GLY 16 2HA GLY 16 7.366 1.917 2.488
107 H MET 17 H MET 17 7.688 -0.120 0.776
108 HA MET 17 HA MET 17 10.198 -1.118 1.478
109 HB2 MET 17 1HB MET 17 9.471 -3.066 0.038
110 HB3 MET 17 2HB MET 17 8.216 -2.564 1.153
111 HG2 MET 17 1HG MET 17 6.886 -1.618 -0.540
112 HG3 MET 17 2HG MET 17 8.254 -1.290 -1.585
113 HE1 MET 17 3HE MET 17 6.832 -5.085 -0.072
114 HE2 MET 17 1HE MET 17 5.934 -3.549 -0.002
115 HE3 MET 17 2HE MET 17 5.543 -4.754 -1.253
116 H ILE 18 H ILE 18 9.322 1.078 -0.954
117 HA ILE 18 HA ILE 18 11.268 0.112 -2.876
118 HB ILE 18 HB ILE 18 9.331 2.425 -2.871
119 HG12 ILE 18 1HG1 ILE 18 8.613 -0.079 -3.141
120 HG13 ILE 18 2HG1 ILE 18 7.943 1.158 -4.187
121 HG21 ILE 18 1HG2 ILE 18 9.997 2.533 -5.348
122 HG22 ILE 18 2HG2 ILE 18 11.105 3.248 -4.152
123 HG23 ILE 18 3HG2 ILE 18 11.464 1.654 -4.857
124 HD11 ILE 18 3HD1 ILE 18 10.398 -0.500 -4.919
125 HD12 ILE 18 1HD1 ILE 18 8.738 -0.921 -5.403
126 HD13 ILE 18 2HD1 ILE 18 9.479 0.589 -5.987
127 H ASP 19 H ASP 19 10.829 2.591 -0.354
128 HA ASP 19 HA ASP 19 13.429 3.663 -1.075
129 HB2 ASP 19 1HB ASP 19 11.031 4.687 0.426
130 HB3 ASP 19 2HB ASP 19 12.597 5.288 0.933
131 H GLY 20 H GLY 20 14.669 4.434 1.117
132 HA2 GLY 20 1HA GLY 20 15.718 3.847 3.016
133 HA3 GLY 20 2HA GLY 20 14.242 3.050 3.521