Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
591150 | 2mzk RC | 25490 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 HT1 GLY 1 1.789 4.845 1.654
2 H2 GLY 1 HT2 GLY 1 2.180 4.426 0.054
3 H3 GLY 1 HT3 GLY 1 1.443 5.920 0.389
4 HA2 GLY 1 HA1 GLY 1 3.753 6.301 -0.028
5 HA3 GLY 1 HA2 GLY 1 3.414 6.583 1.679
6 H GLU 2 HN GLU 2 3.138 3.310 1.091
7 HA GLU 2 HA GLU 2 5.953 2.865 2.000
8 HB2 GLU 2 HB2 GLU 2 3.603 1.000 2.411
9 HB3 GLU 2 HB1 GLU 2 5.182 0.932 3.194
10 HG2 GLU 2 HG2 GLU 2 4.706 3.175 4.216
11 HG3 GLU 2 HG1 GLU 2 3.077 3.085 3.546
12 H CGU 3 HN GLA 3 3.739 2.353 -0.539
13 HA CGU 3 HA GLA 3 4.777 -0.166 -1.534
14 HB2 CGU 3 HB2 GLA 3 3.693 1.732 -3.509
15 HB3 CGU 3 HB3 GLA 3 2.628 1.447 -2.141
16 HG CGU 3 HG GLA 3 3.873 -0.695 -3.889
17 H CGU 4 HN GLA 4 5.169 3.203 -2.601
18 HA CGU 4 HA GLA 4 7.072 2.894 -4.596
19 HB2 CGU 4 HB2 GLA 4 8.041 5.115 -3.274
20 HB3 CGU 4 HB3 GLA 4 6.369 5.053 -2.723
21 HG CGU 4 HG GLA 4 5.614 4.893 -5.077
22 H LEU 5 HN LEU 5 7.712 3.007 -1.088
23 HA LEU 5 HA LEU 5 10.573 2.736 -1.386
24 HB2 LEU 5 HB2 LEU 5 8.937 1.941 1.033
25 HB3 LEU 5 HB1 LEU 5 10.619 2.470 0.992
26 HG LEU 5 HG LEU 5 8.266 4.196 0.171
27 HD11 LEU 5 HD11 LEU 5 9.948 4.482 2.664
28 HD12 LEU 5 HD12 LEU 5 8.455 3.543 2.653
29 HD13 LEU 5 HD13 LEU 5 8.415 5.269 2.285
30 HD21 LEU 5 HD21 LEU 5 11.216 4.460 0.104
31 HD22 LEU 5 HD22 LEU 5 10.352 5.856 0.751
32 HD23 LEU 5 HD23 LEU 5 9.991 5.270 -0.873
33 H ALA 6 HN ALA 6 7.902 0.453 -1.138
34 HA ALA 6 HA ALA 6 9.663 -1.843 -0.708
35 HB1 ALA 6 HB1 ALA 6 6.755 -1.359 -0.936
36 HB2 ALA 6 HB2 ALA 6 7.633 -2.464 0.120
37 HB3 ALA 6 HB3 ALA 6 7.299 -2.920 -1.550
38 H CGU 7 HN GLA 7 7.933 -0.401 -3.455
39 HA CGU 7 HA GLA 7 8.614 -2.491 -5.316
40 HB2 CGU 7 HB2 GLA 7 8.022 -0.755 -7.045
41 HB3 CGU 7 HB3 GLA 7 7.817 0.400 -5.727
42 HG CGU 7 HG GLA 7 6.122 -1.102 -4.705
43 H LYS 8 HN LYS 8 10.106 0.669 -4.577
44 HA LYS 8 HA LYS 8 12.336 0.025 -6.412
45 HB2 LYS 8 HB2 LYS 8 11.550 2.469 -4.832
46 HB3 LYS 8 HB1 LYS 8 13.157 2.327 -5.545
47 HG2 LYS 8 HG2 LYS 8 11.854 3.432 -7.197
48 HG3 LYS 8 HG1 LYS 8 11.952 1.759 -7.742
49 HD2 LYS 8 HD2 LYS 8 9.746 1.291 -6.779
50 HD3 LYS 8 HD1 LYS 8 9.647 2.941 -6.167
51 HE2 LYS 8 HE2 LYS 8 9.841 2.140 -9.085
52 HE3 LYS 8 HE1 LYS 8 8.394 2.733 -8.271
53 HZ1 LYS 8 HZ1 LYS 8 9.067 4.771 -8.764
54 HZ2 LYS 8 HZ2 LYS 8 10.548 4.202 -9.376
55 HZ3 LYS 8 HZ3 LYS 8 10.389 4.560 -7.722
56 H ALA 9 HN ALA 9 11.813 0.695 -2.943
57 HA ALA 9 HA ALA 9 13.364 0.423 -1.146
58 HB1 ALA 9 HB1 ALA 9 12.282 -1.719 -1.216
59 HB2 ALA 9 HB2 ALA 9 14.007 -2.015 -1.000
60 HB3 ALA 9 HB3 ALA 9 13.266 -2.238 -2.585
61 HA HYP 10 HA HYP 10 17.038 1.061 -4.189
62 HB2 HYP 10 HB2 HYP 10 17.681 3.233 -2.395
63 HB3 HYP 10 HB1 HYP 10 17.138 3.367 -4.081
64 HG HYP 10 HG HYP 10 15.721 4.190 -1.883
65 HD22 HYP 10 HD22 HYP 10 15.116 2.120 -1.007
66 HD23 HYP 10 HD21 HYP 10 13.805 2.298 -2.197
67 HD1 HYP 10 HD1 HYP 10 14.918 4.868 -3.753
68 H CGU 11 HN GLA 11 19.402 1.259 -3.018
69 HA CGU 11 HA GLA 11 19.866 -0.919 -1.381
70 HB2 CGU 11 HB2 GLA 11 21.841 0.016 -2.154
71 HB3 CGU 11 HB3 GLA 11 21.821 0.544 -0.479
72 HG CGU 11 HG GLA 11 20.669 2.242 -2.677
73 H PHE 12 HN PHE 12 17.859 -0.590 -0.138
74 HA PHE 12 HA PHE 12 17.946 1.266 2.142
75 HB2 PHE 12 HB2 PHE 12 15.637 0.820 2.324
76 HB3 PHE 12 HB1 PHE 12 15.913 0.676 0.600
77 HD1 PHE 12 HD1 PHE 12 16.578 -1.712 -0.270
78 HD2 PHE 12 HD2 PHE 12 14.617 -0.954 3.477
79 HE1 PHE 12 HE1 PHE 12 15.773 -4.056 -0.217
80 HE2 PHE 12 HE2 PHE 12 13.814 -3.299 3.530
81 HZ PHE 12 HZ PHE 12 14.391 -4.850 1.683
82 H ALA 13 HN ALA 13 17.692 -2.241 1.533
83 HA ALA 13 HA ALA 13 17.711 -3.074 4.247
84 HB1 ALA 13 HB1 ALA 13 17.974 -4.304 1.636
85 HB2 ALA 13 HB2 ALA 13 17.370 -5.005 3.136
86 HB3 ALA 13 HB3 ALA 13 19.096 -5.040 2.780
87 H ARG 14 HN ARG 14 20.404 -2.475 1.989
88 HA ARG 14 HA ARG 14 22.414 -3.284 3.920
89 HB2 ARG 14 HB2 ARG 14 23.985 -2.770 2.283
90 HB3 ARG 14 HB1 ARG 14 22.560 -3.094 1.298
91 HG2 ARG 14 HG2 ARG 14 22.049 -0.652 1.315
92 HG3 ARG 14 HG1 ARG 14 23.575 -0.375 2.160
93 HD2 ARG 14 HD2 ARG 14 23.918 -0.037 -0.234
94 HD3 ARG 14 HD1 ARG 14 24.780 -1.486 0.282
95 HE ARG 14 HE ARG 14 22.118 -2.129 -0.655
96 HH11 ARG 14 HH11 ARG 14 23.343 -0.401 -2.831
97 HH12 ARG 14 HH12 ARG 14 24.116 -1.594 -3.820
98 HH21 ARG 14 HH21 ARG 14 23.967 -4.079 -1.406
99 HH22 ARG 14 HH22 ARG 14 24.469 -3.674 -3.015
100 H CGU 15 HN GLA 15 21.492 -0.043 2.628
101 HA CGU 15 HA GLA 15 23.113 1.514 4.304
102 HB2 CGU 15 HB2 GLA 15 20.787 2.955 4.326
103 HB3 CGU 15 HB3 GLA 15 20.513 1.914 2.939
104 HG CGU 15 HG GLA 15 22.649 2.626 1.958
105 H LEU 16 HN LEU 16 20.059 -0.041 4.929
106 HA LEU 16 HA LEU 16 19.657 1.005 7.586
107 HB2 LEU 16 HB2 LEU 16 17.810 0.008 6.326
108 HB3 LEU 16 HB1 LEU 16 18.635 -1.551 6.313
109 HG LEU 16 HG LEU 16 18.518 -1.669 8.756
110 HD11 LEU 16 HD11 LEU 16 16.948 0.162 9.801
111 HD12 LEU 16 HD12 LEU 16 17.452 1.120 8.409
112 HD13 LEU 16 HD13 LEU 16 18.656 0.523 9.552
113 HD21 LEU 16 HD21 LEU 16 16.375 -2.436 8.727
114 HD22 LEU 16 HD22 LEU 16 16.413 -1.986 7.021
115 HD23 LEU 16 HD23 LEU 16 15.726 -0.880 8.212
116 H ALA 17 HN ALA 17 21.645 -1.560 6.319
117 HA ALA 17 HA ALA 17 22.161 -2.532 9.094
118 HB1 ALA 17 HB1 ALA 17 21.540 -4.277 7.481
119 HB2 ALA 17 HB2 ALA 17 23.215 -4.485 7.990
120 HB3 ALA 17 HB3 ALA 17 22.852 -3.777 6.416
121 H ASN 18 HN ASN 18 23.325 -0.219 7.168
122 HA ASN 18 HA ASN 18 26.048 -0.476 8.295
123 HB2 ASN 18 HB2 ASN 18 25.822 -1.357 5.826
124 HB3 ASN 18 HB1 ASN 18 25.724 0.357 5.422
125 HD21 ASN 18 HD21 ASN 18 27.949 -2.065 5.569
126 HD22 ASN 18 HD22 ASN 18 29.336 -1.170 5.996
127 HN1 NH2 19 H1 NH2 19 23.333 1.232 8.156
128 HN2 NH2 19 H2 NH2 19 23.913 2.813 8.107
Start of MODEL 2
1 H1 GLY 1 HT1 GLY 1 -1.355 0.096 0.466
2 H2 GLY 1 HT2 GLY 1 0.113 0.100 1.323
3 H3 GLY 1 HT3 GLY 1 -0.182 -1.085 0.140
4 HA2 GLY 1 HA1 GLY 1 0.219 0.309 -1.597
5 HA3 GLY 1 HA2 GLY 1 -0.274 1.728 -0.672
6 H GLU 2 HN GLU 2 2.167 -0.865 -0.219
7 HA GLU 2 HA GLU 2 4.135 1.299 0.413
8 HB2 GLU 2 HB2 GLU 2 5.334 -0.380 1.753
9 HB3 GLU 2 HB1 GLU 2 3.665 -0.237 2.303
10 HG2 GLU 2 HG2 GLU 2 3.071 -2.199 0.868
11 HG3 GLU 2 HG1 GLU 2 4.781 -2.382 0.474
12 H CGU 3 HN GLA 3 3.364 0.066 -2.240
13 HA CGU 3 HA GLA 3 5.646 -1.562 -3.046
14 HB2 CGU 3 HB2 GLA 3 4.161 -0.182 -5.167
15 HB3 CGU 3 HB3 GLA 3 3.127 -1.078 -4.065
16 HG CGU 3 HG GLA 3 5.560 -2.187 -5.494
17 H CGU 4 HN GLA 4 4.535 1.726 -3.850
18 HA CGU 4 HA GLA 4 6.957 2.431 -5.236
19 HB2 CGU 4 HB2 GLA 4 4.465 3.603 -4.870
20 HB3 CGU 4 HB3 GLA 4 5.814 4.323 -5.735
21 HG CGU 4 HG GLA 4 5.355 4.598 -2.776
22 H LEU 5 HN LEU 5 5.791 2.968 -1.962
23 HA LEU 5 HA LEU 5 8.000 4.461 -0.972
24 HB2 LEU 5 HB2 LEU 5 6.444 2.385 0.596
25 HB3 LEU 5 HB1 LEU 5 7.285 3.796 1.238
26 HG LEU 5 HG LEU 5 4.979 3.965 -0.715
27 HD11 LEU 5 HD11 LEU 5 3.489 4.017 1.018
28 HD12 LEU 5 HD12 LEU 5 4.631 4.805 2.107
29 HD13 LEU 5 HD13 LEU 5 4.727 3.065 1.836
30 HD21 LEU 5 HD21 LEU 5 6.285 5.957 -0.808
31 HD22 LEU 5 HD22 LEU 5 6.548 5.957 0.936
32 HD23 LEU 5 HD23 LEU 5 4.953 6.336 0.284
33 H ALA 6 HN ALA 6 7.597 1.004 -1.500
34 HA ALA 6 HA ALA 6 10.183 0.407 -0.208
35 HB1 ALA 6 HB1 ALA 6 9.662 -1.938 -0.823
36 HB2 ALA 6 HB2 ALA 6 8.233 -1.381 -1.693
37 HB3 ALA 6 HB3 ALA 6 8.330 -1.189 0.057
38 H CGU 7 HN GLA 7 8.755 0.256 -3.479
39 HA CGU 7 HA GLA 7 11.064 -0.700 -4.821
40 HB2 CGU 7 HB2 GLA 7 10.049 0.363 -6.853
41 HB3 CGU 7 HB3 GLA 7 8.852 1.119 -5.803
42 HG CGU 7 HG GLA 7 8.352 -1.269 -4.958
43 H LYS 8 HN LYS 8 10.272 2.526 -3.661
44 HA LYS 8 HA LYS 8 12.498 3.709 -5.178
45 HB2 LYS 8 HB2 LYS 8 11.460 5.673 -4.846
46 HB3 LYS 8 HB1 LYS 8 10.117 4.723 -4.224
47 HG2 LYS 8 HG2 LYS 8 12.388 5.809 -2.527
48 HG3 LYS 8 HG1 LYS 8 10.805 6.544 -2.690
49 HD2 LYS 8 HD2 LYS 8 9.986 4.102 -2.034
50 HD3 LYS 8 HD1 LYS 8 11.571 4.039 -1.268
51 HE2 LYS 8 HE2 LYS 8 9.478 6.183 -0.807
52 HE3 LYS 8 HE1 LYS 8 9.880 4.883 0.314
53 HZ1 LYS 8 HZ1 LYS 8 12.195 5.749 0.297
54 HZ2 LYS 8 HZ2 LYS 8 11.060 6.812 0.982
55 HZ3 LYS 8 HZ3 LYS 8 11.646 7.088 -0.588
56 H ALA 9 HN ALA 9 12.236 1.943 -2.373
57 HA ALA 9 HA ALA 9 14.757 3.178 -1.311
58 HB1 ALA 9 HB1 ALA 9 12.251 2.370 0.089
59 HB2 ALA 9 HB2 ALA 9 13.359 3.698 0.436
60 HB3 ALA 9 HB3 ALA 9 13.780 2.051 0.906
61 HA HYP 10 HA HYP 10 15.116 -1.424 -2.663
62 HB2 HYP 10 HB2 HYP 10 17.761 -0.606 -3.492
63 HB3 HYP 10 HB1 HYP 10 16.416 -1.098 -4.544
64 HG HYP 10 HG HYP 10 17.501 1.415 -4.419
65 HD22 HYP 10 HD22 HYP 10 16.693 2.088 -2.340
66 HD23 HYP 10 HD21 HYP 10 15.275 2.510 -3.328
67 HD1 HYP 10 HD1 HYP 10 14.826 1.437 -4.952
68 H CGU 11 HN GLA 11 17.315 -2.649 -1.813
69 HA CGU 11 HA GLA 11 17.529 -2.470 0.935
70 HB2 CGU 11 HB2 GLA 11 18.653 -4.322 0.127
71 HB3 CGU 11 HB3 GLA 11 19.995 -3.238 0.465
72 HG CGU 11 HG GLA 11 18.666 -3.530 -2.226
73 H PHE 12 HN PHE 12 17.366 -0.085 0.947
74 HA PHE 12 HA PHE 12 19.890 1.406 0.612
75 HB2 PHE 12 HB2 PHE 12 18.535 3.304 0.438
76 HB3 PHE 12 HB1 PHE 12 17.448 2.073 -0.176
77 HD1 PHE 12 HD1 PHE 12 15.917 0.880 1.555
78 HD2 PHE 12 HD2 PHE 12 17.892 4.626 2.274
79 HE1 PHE 12 HE1 PHE 12 14.302 1.383 3.369
80 HE2 PHE 12 HE2 PHE 12 16.277 5.130 4.088
81 HZ PHE 12 HZ PHE 12 14.482 3.508 4.635
82 H ALA 13 HN ALA 13 17.366 0.825 3.078
83 HA ALA 13 HA ALA 13 18.876 2.143 5.175
84 HB1 ALA 13 HB1 ALA 13 17.150 0.642 6.575
85 HB2 ALA 13 HB2 ALA 13 16.362 0.546 4.999
86 HB3 ALA 13 HB3 ALA 13 16.643 2.117 5.750
87 H ARG 14 HN ARG 14 18.485 -1.207 4.082
88 HA ARG 14 HA ARG 14 19.956 -2.338 6.307
89 HB2 ARG 14 HB2 ARG 14 19.609 -4.382 5.288
90 HB3 ARG 14 HB1 ARG 14 18.337 -3.451 4.501
91 HG2 ARG 14 HG2 ARG 14 19.869 -2.975 2.618
92 HG3 ARG 14 HG1 ARG 14 21.103 -3.982 3.381
93 HD2 ARG 14 HD2 ARG 14 19.308 -5.835 3.407
94 HD3 ARG 14 HD1 ARG 14 18.436 -4.827 2.251
95 HE ARG 14 HE ARG 14 19.935 -5.631 0.634
96 HH11 ARG 14 HH11 ARG 14 22.281 -4.127 1.544
97 HH12 ARG 14 HH12 ARG 14 23.412 -5.368 1.967
98 HH21 ARG 14 HH21 ARG 14 21.015 -7.865 2.143
99 HH22 ARG 14 HH22 ARG 14 22.696 -7.482 2.308
100 H CGU 15 HN GLA 15 20.847 -1.795 2.862
101 HA CGU 15 HA GLA 15 23.516 -2.552 2.928
102 HB2 CGU 15 HB2 GLA 15 23.678 -0.171 1.561
103 HB3 CGU 15 HB3 GLA 15 21.964 -0.531 1.435
104 HG CGU 15 HG GLA 15 22.490 -2.772 0.562
105 H LEU 16 HN LEU 16 22.006 0.294 4.214
106 HA LEU 16 HA LEU 16 24.383 1.722 4.967
107 HB2 LEU 16 HB2 LEU 16 21.494 1.893 5.570
108 HB3 LEU 16 HB1 LEU 16 22.553 2.531 6.829
109 HG LEU 16 HG LEU 16 21.867 4.208 5.045
110 HD11 LEU 16 HD11 LEU 16 23.824 5.324 5.416
111 HD12 LEU 16 HD12 LEU 16 24.808 3.998 4.798
112 HD13 LEU 16 HD13 LEU 16 24.194 3.944 6.451
113 HD21 LEU 16 HD21 LEU 16 23.943 3.160 3.229
114 HD22 LEU 16 HD22 LEU 16 22.371 3.863 2.851
115 HD23 LEU 16 HD23 LEU 16 22.489 2.166 3.317
116 H ALA 17 HN ALA 17 22.421 -0.706 6.663
117 HA ALA 17 HA ALA 17 24.428 -0.661 8.874
118 HB1 ALA 17 HB1 ALA 17 21.562 -1.614 8.738
119 HB2 ALA 17 HB2 ALA 17 22.241 -0.360 9.775
120 HB3 ALA 17 HB3 ALA 17 22.634 -2.055 10.067
121 H ASN 18 HN ASN 18 24.022 -2.192 6.058
122 HA ASN 18 HA ASN 18 25.327 -4.649 7.065
123 HB2 ASN 18 HB2 ASN 18 22.730 -4.883 6.701
124 HB3 ASN 18 HB1 ASN 18 23.163 -4.891 4.992
125 HD21 ASN 18 HD21 ASN 18 23.767 -6.893 4.145
126 HD22 ASN 18 HD22 ASN 18 24.251 -8.236 5.076
127 HN1 NH2 19 H1 NH2 19 25.526 -2.030 5.198
128 HN2 NH2 19 H2 NH2 19 26.321 -2.631 3.841
Start of MODEL 3
1 H1 GLY 1 HT1 GLY 1 2.619 4.440 3.193
2 H2 GLY 1 HT2 GLY 1 1.192 3.706 2.635
3 H3 GLY 1 HT3 GLY 1 1.301 5.399 2.726
4 HA2 GLY 1 HA1 GLY 1 1.692 4.001 0.486
5 HA3 GLY 1 HA2 GLY 1 2.391 5.591 0.795
6 H GLU 2 HN GLU 2 3.093 2.201 1.749
7 HA GLU 2 HA GLU 2 5.988 2.819 1.529
8 HB2 GLU 2 HB2 GLU 2 4.519 0.384 2.581
9 HB3 GLU 2 HB1 GLU 2 6.275 0.558 2.557
10 HG2 GLU 2 HG2 GLU 2 5.497 1.201 4.755
11 HG3 GLU 2 HG1 GLU 2 6.014 2.661 3.913
12 H CGU 3 HN GLA 3 3.946 2.318 -0.750
13 HA CGU 3 HA GLA 3 4.820 -0.150 -2.012
14 HB2 CGU 3 HB2 GLA 3 3.788 1.954 -3.776
15 HB3 CGU 3 HB3 GLA 3 2.752 1.653 -2.388
16 HG CGU 3 HG GLA 3 3.805 -0.496 -4.246
17 H CGU 4 HN GLA 4 5.357 3.292 -2.743
18 HA CGU 4 HA GLA 4 7.189 3.092 -4.817
19 HB2 CGU 4 HB2 GLA 4 8.314 5.110 -3.317
20 HB3 CGU 4 HB3 GLA 4 6.663 5.076 -2.703
21 HG CGU 4 HG GLA 4 5.831 5.164 -5.056
22 H LEU 5 HN LEU 5 7.925 2.811 -1.334
23 HA LEU 5 HA LEU 5 10.755 2.353 -1.796
24 HB2 LEU 5 HB2 LEU 5 9.206 1.555 0.675
25 HB3 LEU 5 HB1 LEU 5 10.906 2.010 0.555
26 HG LEU 5 HG LEU 5 8.527 3.835 0.104
27 HD11 LEU 5 HD11 LEU 5 9.647 5.042 2.067
28 HD12 LEU 5 HD12 LEU 5 10.596 3.574 2.296
29 HD13 LEU 5 HD13 LEU 5 8.840 3.523 2.450
30 HD21 LEU 5 HD21 LEU 5 10.369 5.590 -0.034
31 HD22 LEU 5 HD22 LEU 5 10.265 4.497 -1.415
32 HD23 LEU 5 HD23 LEU 5 11.513 4.256 -0.192
33 H ALA 6 HN ALA 6 7.900 0.309 -1.500
34 HA ALA 6 HA ALA 6 9.446 -2.156 -1.251
35 HB1 ALA 6 HB1 ALA 6 6.599 -2.111 -2.196
36 HB2 ALA 6 HB2 ALA 6 6.956 -1.635 -0.536
37 HB3 ALA 6 HB3 ALA 6 7.396 -3.245 -1.105
38 H CGU 7 HN GLA 7 7.630 -0.553 -3.877
39 HA CGU 7 HA GLA 7 8.150 -2.558 -5.849
40 HB2 CGU 7 HB2 GLA 7 7.705 -0.668 -7.482
41 HB3 CGU 7 HB3 GLA 7 7.573 0.402 -6.088
42 HG CGU 7 HG GLA 7 5.764 -1.027 -5.176
43 H LYS 8 HN LYS 8 10.066 0.122 -4.632
44 HA LYS 8 HA LYS 8 12.151 -0.470 -6.686
45 HB2 LYS 8 HB2 LYS 8 11.573 1.932 -4.962
46 HB3 LYS 8 HB1 LYS 8 13.168 1.698 -5.679
47 HG2 LYS 8 HG2 LYS 8 11.895 3.034 -7.221
48 HG3 LYS 8 HG1 LYS 8 12.016 1.420 -7.916
49 HD2 LYS 8 HD2 LYS 8 9.787 0.889 -7.395
50 HD3 LYS 8 HD1 LYS 8 9.673 2.160 -6.176
51 HE2 LYS 8 HE2 LYS 8 8.483 2.633 -8.387
52 HE3 LYS 8 HE1 LYS 8 9.604 3.878 -7.836
53 HZ1 LYS 8 HZ1 LYS 8 10.537 3.663 -9.829
54 HZ2 LYS 8 HZ2 LYS 8 9.729 2.206 -10.161
55 HZ3 LYS 8 HZ3 LYS 8 11.175 2.195 -9.271
56 H ALA 9 HN ALA 9 11.900 0.283 -3.186
57 HA ALA 9 HA ALA 9 13.193 -0.493 -1.376
58 HB1 ALA 9 HB1 ALA 9 12.418 -2.702 -2.295
59 HB2 ALA 9 HB2 ALA 9 13.982 -2.768 -1.482
60 HB3 ALA 9 HB3 ALA 9 13.903 -2.769 -3.244
61 HA HYP 10 HA HYP 10 16.849 1.209 -4.106
62 HB2 HYP 10 HB2 HYP 10 16.878 3.310 -2.124
63 HB3 HYP 10 HB1 HYP 10 16.447 3.468 -3.841
64 HG HYP 10 HG HYP 10 14.727 3.795 -1.731
65 HD22 HYP 10 HD22 HYP 10 14.510 1.574 -1.053
66 HD23 HYP 10 HD21 HYP 10 13.285 1.579 -2.342
67 HD1 HYP 10 HD1 HYP 10 14.626 3.900 -4.294
68 H CGU 11 HN GLA 11 19.023 1.800 -2.723
69 HA CGU 11 HA GLA 11 19.853 -0.354 -1.211
70 HB2 CGU 11 HB2 GLA 11 21.635 1.031 -1.660
71 HB3 CGU 11 HB3 GLA 11 21.299 1.482 0.006
72 HG CGU 11 HG GLA 11 20.143 2.920 -2.371
73 H PHE 12 HN PHE 12 17.718 -0.578 -0.134
74 HA PHE 12 HA PHE 12 17.262 1.050 2.265
75 HB2 PHE 12 HB2 PHE 12 15.072 0.209 2.208
76 HB3 PHE 12 HB1 PHE 12 15.497 0.300 0.512
77 HD1 PHE 12 HD2 PHE 12 17.144 -2.061 0.040
78 HD2 PHE 12 HD1 PHE 12 13.666 -1.611 2.514
79 HE1 PHE 12 HE2 PHE 12 16.668 -4.480 -0.192
80 HE2 PHE 12 HE1 PHE 12 13.187 -4.033 2.281
81 HZ PHE 12 HZ PHE 12 14.689 -5.467 0.927
82 H ALA 13 HN ALA 13 17.974 -2.349 1.422
83 HA ALA 13 HA ALA 13 17.886 -3.236 4.180
84 HB1 ALA 13 HB1 ALA 13 17.547 -4.998 2.689
85 HB2 ALA 13 HB2 ALA 13 19.254 -5.203 3.082
86 HB3 ALA 13 HB3 ALA 13 18.784 -4.423 1.571
87 H ARG 14 HN ARG 14 20.451 -2.199 1.943
88 HA ARG 14 HA ARG 14 22.602 -2.822 3.779
89 HB2 ARG 14 HB2 ARG 14 24.033 -1.914 2.184
90 HB3 ARG 14 HB1 ARG 14 22.656 -2.371 1.183
91 HG2 ARG 14 HG2 ARG 14 21.758 -0.056 1.451
92 HG3 ARG 14 HG1 ARG 14 23.247 0.384 2.293
93 HD2 ARG 14 HD2 ARG 14 23.030 -0.639 -0.553
94 HD3 ARG 14 HD1 ARG 14 23.454 1.000 -0.058
95 HE ARG 14 HE ARG 14 25.281 -1.202 -0.207
96 HH11 ARG 14 HH21 ARG 14 25.612 1.921 0.119
97 HH12 ARG 14 HH22 ARG 14 26.634 1.946 1.517
98 HH21 ARG 14 HH11 ARG 14 26.070 -1.381 2.315
99 HH22 ARG 14 HH12 ARG 14 26.896 0.074 2.758
100 H CGU 15 HN GLA 15 21.136 0.316 2.788
101 HA CGU 15 HA GLA 15 22.499 2.029 4.499
102 HB2 CGU 15 HB2 GLA 15 19.930 2.940 4.794
103 HB3 CGU 15 HB3 GLA 15 19.778 1.971 3.336
104 HG CGU 15 HG GLA 15 21.678 3.186 2.334
105 H LEU 16 HN LEU 16 19.899 -0.172 5.215
106 HA LEU 16 HA LEU 16 19.631 0.623 8.009
107 HB2 LEU 16 HB2 LEU 16 18.333 -1.231 6.174
108 HB3 LEU 16 HB1 LEU 16 18.566 -1.944 7.770
109 HG LEU 16 HG LEU 16 16.405 -0.680 7.537
110 HD11 LEU 16 HD11 LEU 16 18.039 -0.876 9.671
111 HD12 LEU 16 HD12 LEU 16 16.503 -0.011 9.733
112 HD13 LEU 16 HD13 LEU 16 18.008 0.880 9.501
113 HD21 LEU 16 HD21 LEU 16 16.382 1.420 6.706
114 HD22 LEU 16 HD22 LEU 16 18.090 1.218 6.321
115 HD23 LEU 16 HD23 LEU 16 17.612 1.942 7.855
116 H ALA 17 HN ALA 17 21.801 -1.446 6.304
117 HA ALA 17 HA ALA 17 22.462 -2.935 8.787
118 HB1 ALA 17 HB1 ALA 17 22.471 -4.511 7.097
119 HB2 ALA 17 HB2 ALA 17 24.158 -4.006 7.027
120 HB3 ALA 17 HB3 ALA 17 22.994 -3.351 5.877
121 H ASN 18 HN ASN 18 23.363 -0.090 7.323
122 HA ASN 18 HA ASN 18 25.924 -0.090 8.810
123 HB2 ASN 18 HB2 ASN 18 26.204 -0.572 6.263
124 HB3 ASN 18 HB1 ASN 18 25.754 1.118 6.052
125 HD21 ASN 18 HD21 ASN 18 27.524 2.494 5.997
126 HD22 ASN 18 HD22 ASN 18 29.001 2.228 6.807
127 HN1 NH2 19 H1 NH2 19 22.976 1.141 8.503
128 HN2 NH2 19 H2 NH2 19 23.247 2.777 8.793
Start of MODEL 4
1 H1 GLY 1 HT1 GLY 1 1.516 6.117 0.250
2 H2 GLY 1 HT2 GLY 1 0.290 6.578 -0.833
3 H3 GLY 1 HT3 GLY 1 1.910 6.966 -1.164
4 HA2 GLY 1 HA1 GLY 1 0.489 4.438 -1.492
5 HA3 GLY 1 HA2 GLY 1 1.746 5.160 -2.496
6 H GLU 2 HN GLU 2 1.248 2.560 -0.643
7 HA GLU 2 HA GLU 2 3.853 2.611 0.770
8 HB2 GLU 2 HB2 GLU 2 1.949 1.707 2.006
9 HB3 GLU 2 HB1 GLU 2 1.627 0.550 0.715
10 HG2 GLU 2 HG2 GLU 2 4.315 0.626 2.071
11 HG3 GLU 2 HG1 GLU 2 2.971 -0.265 2.786
12 H CGU 3 HN GLA 3 2.198 0.930 -1.879
13 HA CGU 3 HA GLA 3 4.211 -1.019 -2.422
14 HB2 CGU 3 HB2 GLA 3 2.848 0.123 -4.765
15 HB3 CGU 3 HB3 GLA 3 1.755 -0.346 -3.473
16 HG CGU 3 HG GLA 3 3.888 -2.127 -4.686
17 H CGU 4 HN GLA 4 3.590 2.113 -3.987
18 HA CGU 4 HA GLA 4 5.736 2.268 -5.724
19 HB2 CGU 4 HB2 GLA 4 5.735 4.817 -4.650
20 HB3 CGU 4 HB3 GLA 4 4.115 4.239 -4.268
21 HG CGU 4 HG GLA 4 3.854 3.546 -6.657
22 H LEU 5 HN LEU 5 5.845 2.981 -2.229
23 HA LEU 5 HA LEU 5 8.710 3.550 -2.336
24 HB2 LEU 5 HB2 LEU 5 6.970 3.048 0.094
25 HB3 LEU 5 HB1 LEU 5 8.537 3.857 0.060
26 HG LEU 5 HG LEU 5 6.109 4.851 -1.455
27 HD11 LEU 5 HD11 LEU 5 6.561 6.678 0.525
28 HD12 LEU 5 HD12 LEU 5 6.943 5.174 1.365
29 HD13 LEU 5 HD13 LEU 5 5.356 5.394 0.628
30 HD21 LEU 5 HD21 LEU 5 7.543 6.984 -1.369
31 HD22 LEU 5 HD22 LEU 5 8.107 5.700 -2.439
32 HD23 LEU 5 HD23 LEU 5 8.871 5.938 -0.868
33 H ALA 6 HN ALA 6 6.743 0.958 -0.820
34 HA ALA 6 HA ALA 6 8.949 -0.620 0.027
35 HB1 ALA 6 HB1 ALA 6 6.165 -0.818 0.134
36 HB2 ALA 6 HB2 ALA 6 7.320 -1.960 0.822
37 HB3 ALA 6 HB3 ALA 6 6.666 -2.232 -0.793
38 H CGU 7 HN GLA 7 7.845 0.014 -3.143
39 HA CGU 7 HA GLA 7 8.803 -2.538 -4.252
40 HB2 CGU 7 HB2 GLA 7 8.379 -1.245 -6.459
41 HB3 CGU 7 HB3 GLA 7 7.642 -0.019 -5.425
42 HG CGU 7 HG GLA 7 6.125 -1.747 -4.489
43 H LYS 8 HN LYS 8 10.035 0.681 -3.693
44 HA LYS 8 HA LYS 8 12.308 0.298 -5.521
45 HB2 LYS 8 HB2 LYS 8 12.427 2.449 -3.485
46 HB3 LYS 8 HB1 LYS 8 12.754 2.520 -5.214
47 HG2 LYS 8 HG2 LYS 8 10.015 2.419 -3.915
48 HG3 LYS 8 HG1 LYS 8 10.748 3.824 -4.679
49 HD2 LYS 8 HD2 LYS 8 9.852 1.260 -6.021
50 HD3 LYS 8 HD1 LYS 8 9.250 2.885 -6.290
51 HE2 LYS 8 HE2 LYS 8 11.630 3.494 -7.024
52 HE3 LYS 8 HE1 LYS 8 11.935 1.759 -7.083
53 HZ1 LYS 8 HZ1 LYS 8 9.993 3.327 -8.664
54 HZ2 LYS 8 HZ2 LYS 8 9.872 1.639 -8.513
55 HZ3 LYS 8 HZ3 LYS 8 11.249 2.335 -9.223
56 H ALA 9 HN ALA 9 11.957 0.718 -1.971
57 HA ALA 9 HA ALA 9 13.477 0.117 -0.254
58 HB1 ALA 9 HB1 ALA 9 12.447 -2.085 -1.221
59 HB2 ALA 9 HB2 ALA 9 13.850 -2.187 -0.155
60 HB3 ALA 9 HB3 ALA 9 14.056 -2.332 -1.902
61 HA HYP 10 HA HYP 10 16.986 1.484 -3.306
62 HB2 HYP 10 HB2 HYP 10 17.465 3.487 -1.282
63 HB3 HYP 10 HB1 HYP 10 16.850 3.757 -2.927
64 HG HYP 10 HG HYP 10 15.439 4.163 -0.612
65 HD22 HYP 10 HD22 HYP 10 15.075 1.951 0.019
66 HD23 HYP 10 HD21 HYP 10 13.712 2.132 -1.108
67 HD1 HYP 10 HD1 HYP 10 13.644 3.608 -2.355
68 H CGU 11 HN GLA 11 19.357 1.810 -2.167
69 HA CGU 11 HA GLA 11 20.127 -0.482 -0.829
70 HB2 CGU 11 HB2 GLA 11 22.001 0.712 -1.386
71 HB3 CGU 11 HB3 GLA 11 21.845 1.223 0.291
72 HG CGU 11 HG GLA 11 20.749 2.705 -2.095
73 H PHE 12 HN PHE 12 18.131 -0.576 0.481
74 HA PHE 12 HA PHE 12 18.074 1.015 2.952
75 HB2 PHE 12 HB2 PHE 12 15.816 0.394 3.103
76 HB3 PHE 12 HB1 PHE 12 16.074 0.508 1.374
77 HD1 PHE 12 HD2 PHE 12 17.429 -1.980 0.674
78 HD2 PHE 12 HD1 PHE 12 14.268 -1.292 3.494
79 HE1 PHE 12 HE2 PHE 12 16.703 -4.332 0.428
80 HE2 PHE 12 HE1 PHE 12 13.537 -3.650 3.246
81 HZ PHE 12 HZ PHE 12 14.756 -5.169 1.714
82 H ALA 13 HN ALA 13 18.370 -2.401 1.946
83 HA ALA 13 HA ALA 13 18.493 -3.351 4.692
84 HB1 ALA 13 HB1 ALA 13 18.789 -4.546 1.974
85 HB2 ALA 13 HB2 ALA 13 17.798 -5.079 3.332
86 HB3 ALA 13 HB3 ALA 13 19.530 -5.407 3.323
87 H ARG 14 HN ARG 14 20.816 -2.331 2.243
88 HA ARG 14 HA ARG 14 23.107 -3.330 3.770
89 HB2 ARG 14 HB2 ARG 14 24.438 -2.566 2.005
90 HB3 ARG 14 HB1 ARG 14 22.916 -2.918 1.185
91 HG2 ARG 14 HG2 ARG 14 22.261 -0.523 1.498
92 HG3 ARG 14 HG1 ARG 14 23.878 -0.208 2.137
93 HD2 ARG 14 HD2 ARG 14 23.915 0.356 -0.207
94 HD3 ARG 14 HD1 ARG 14 24.818 -1.145 -0.009
95 HE ARG 14 HE ARG 14 22.133 -1.849 -0.571
96 HH11 ARG 14 HH21 ARG 14 25.152 -1.381 -1.969
97 HH12 ARG 14 HH22 ARG 14 24.579 -1.307 -3.602
98 HH21 ARG 14 HH11 ARG 14 21.230 -1.261 -2.706
99 HH22 ARG 14 HH12 ARG 14 22.360 -1.237 -4.019
100 H CGU 15 HN GLA 15 21.902 -0.042 2.922
101 HA CGU 15 HA GLA 15 23.640 1.521 4.412
102 HB2 CGU 15 HB2 GLA 15 21.273 2.703 5.049
103 HB3 CGU 15 HB3 GLA 15 20.769 1.714 3.691
104 HG CGU 15 HG GLA 15 22.593 2.679 2.323
105 H LEU 16 HN LEU 16 20.939 -0.390 5.496
106 HA LEU 16 HA LEU 16 20.985 0.398 8.261
107 HB2 LEU 16 HB2 LEU 16 19.262 -1.053 6.804
108 HB3 LEU 16 HB1 LEU 16 20.160 -2.376 7.547
109 HG LEU 16 HG LEU 16 18.270 -1.801 8.973
110 HD11 LEU 16 HD11 LEU 16 20.635 -2.291 9.924
111 HD12 LEU 16 HD12 LEU 16 19.437 -1.597 11.015
112 HD13 LEU 16 HD13 LEU 16 20.681 -0.569 10.305
113 HD21 LEU 16 HD21 LEU 16 18.743 0.788 8.053
114 HD22 LEU 16 HD22 LEU 16 19.207 0.857 9.753
115 HD23 LEU 16 HD23 LEU 16 17.585 0.331 9.302
116 H ALA 17 HN ALA 17 22.790 -1.999 6.423
117 HA ALA 17 HA ALA 17 24.111 -2.890 8.946
118 HB1 ALA 17 HB1 ALA 17 25.020 -4.434 6.752
119 HB2 ALA 17 HB2 ALA 17 23.278 -4.254 6.548
120 HB3 ALA 17 HB3 ALA 17 23.923 -4.940 8.038
121 H ASN 18 HN ASN 18 24.533 -0.543 6.782
122 HA ASN 18 HA ASN 18 27.473 -0.598 7.099
123 HB2 ASN 18 HB2 ASN 18 26.632 -1.544 4.796
124 HB3 ASN 18 HB1 ASN 18 26.295 0.147 4.432
125 HD21 ASN 18 HD21 ASN 18 28.786 0.455 6.511
126 HD22 ASN 18 HD22 ASN 18 30.107 0.373 5.435
127 HN1 NH2 19 H1 NH2 19 24.701 0.929 7.699
128 HN2 NH2 19 H2 NH2 19 25.140 2.543 7.494
Start of MODEL 5
1 H1 GLY 1 HT1 GLY 1 0.144 -0.040 0.047
2 H2 GLY 1 HT2 GLY 1 -0.999 0.093 -1.203
3 H3 GLY 1 HT3 GLY 1 -1.178 1.009 0.217
4 HA2 GLY 1 HA1 GLY 1 0.314 1.597 -2.140
5 HA3 GLY 1 HA2 GLY 1 -0.142 2.663 -0.811
6 H GLU 2 HN GLU 2 1.637 -0.291 -0.200
7 HA GLU 2 HA GLU 2 3.883 1.349 0.819
8 HB2 GLU 2 HB2 GLU 2 4.668 -0.759 1.834
9 HB3 GLU 2 HB1 GLU 2 2.986 -0.446 2.261
10 HG2 GLU 2 HG2 GLU 2 2.258 -1.957 0.433
11 HG3 GLU 2 HG1 GLU 2 3.949 -2.300 0.062
12 H CGU 3 HN GLA 3 3.103 0.177 -2.116
13 HA CGU 3 HA GLA 3 5.514 -1.211 -2.901
14 HB2 CGU 3 HB2 GLA 3 4.139 0.286 -5.009
15 HB3 CGU 3 HB3 GLA 3 3.040 -0.683 -4.040
16 HG CGU 3 HG GLA 3 5.559 -1.695 -5.391
17 H CGU 4 HN GLA 4 4.327 2.091 -3.539
18 HA CGU 4 HA GLA 4 6.471 3.206 -4.866
19 HB2 CGU 4 HB2 GLA 4 5.923 5.191 -3.018
20 HB3 CGU 4 HB3 GLA 4 4.433 4.250 -3.020
21 HG CGU 4 HG GLA 4 4.395 4.394 -5.513
22 H LEU 5 HN LEU 5 6.282 2.687 -1.339
23 HA LEU 5 HA LEU 5 8.881 3.815 -0.805
24 HB2 LEU 5 HB2 LEU 5 7.436 1.733 0.852
25 HB3 LEU 5 HB1 LEU 5 8.622 2.914 1.409
26 HG LEU 5 HG LEU 5 5.935 3.635 0.205
27 HD11 LEU 5 HD11 LEU 5 6.219 2.455 2.614
28 HD12 LEU 5 HD12 LEU 5 5.021 3.712 2.308
29 HD13 LEU 5 HD13 LEU 5 6.555 4.125 3.073
30 HD21 LEU 5 HD21 LEU 5 8.342 5.122 1.013
31 HD22 LEU 5 HD22 LEU 5 6.857 5.745 1.732
32 HD23 LEU 5 HD23 LEU 5 7.006 5.626 -0.022
33 H ALA 6 HN ALA 6 7.784 0.401 -0.877
34 HA ALA 6 HA ALA 6 10.344 -0.769 -0.607
35 HB1 ALA 6 HB1 ALA 6 7.679 -1.640 -1.478
36 HB2 ALA 6 HB2 ALA 6 8.872 -2.489 -0.495
37 HB3 ALA 6 HB3 ALA 6 8.990 -2.528 -2.254
38 H CGU 7 HN GLA 7 8.563 0.061 -3.595
39 HA CGU 7 HA GLA 7 10.580 -0.836 -5.399
40 HB2 CGU 7 HB2 GLA 7 9.474 0.728 -7.024
41 HB3 CGU 7 HB3 GLA 7 8.480 1.323 -5.695
42 HG CGU 7 HG GLA 7 7.636 -0.974 -5.312
43 H LYS 8 HN LYS 8 10.044 2.357 -3.895
44 HA LYS 8 HA LYS 8 12.552 3.333 -5.142
45 HB2 LYS 8 HB2 LYS 8 10.313 4.654 -3.621
46 HB3 LYS 8 HB1 LYS 8 11.848 5.483 -3.875
47 HG2 LYS 8 HG2 LYS 8 10.455 6.127 -5.706
48 HG3 LYS 8 HG1 LYS 8 11.579 4.935 -6.356
49 HD2 LYS 8 HD2 LYS 8 9.896 3.178 -6.145
50 HD3 LYS 8 HD1 LYS 8 8.774 4.307 -5.390
51 HE2 LYS 8 HE2 LYS 8 8.212 4.064 -7.755
52 HE3 LYS 8 HE1 LYS 8 8.824 5.691 -7.461
53 HZ1 LYS 8 HZ1 LYS 8 9.902 3.619 -9.102
54 HZ2 LYS 8 HZ2 LYS 8 11.054 4.211 -8.002
55 HZ3 LYS 8 HZ3 LYS 8 10.272 5.274 -9.074
56 H ALA 9 HN ALA 9 12.384 1.276 -2.911
57 HA ALA 9 HA ALA 9 14.219 2.708 -1.016
58 HB1 ALA 9 HB1 ALA 9 13.334 1.217 0.777
59 HB2 ALA 9 HB2 ALA 9 12.116 0.625 -0.353
60 HB3 ALA 9 HB3 ALA 9 12.113 2.319 0.141
61 HA HYP 10 HA HYP 10 15.976 -1.130 -3.366
62 HB2 HYP 10 HB2 HYP 10 18.382 0.467 -3.430
63 HB3 HYP 10 HB1 HYP 10 17.365 0.012 -4.814
64 HG HYP 10 HG HYP 10 17.704 2.558 -3.860
65 HD22 HYP 10 HD22 HYP 10 16.487 2.399 -1.881
66 HD23 HYP 10 HD21 HYP 10 15.147 2.760 -2.993
67 HD1 HYP 10 HD1 HYP 10 16.746 2.355 -5.794
68 H CGU 11 HN GLA 11 18.277 -2.033 -2.438
69 HA CGU 11 HA GLA 11 18.103 -2.592 0.264
70 HB2 CGU 11 HB2 GLA 11 19.766 -3.862 -0.676
71 HB3 CGU 11 HB3 GLA 11 20.746 -2.598 0.055
72 HG CGU 11 HG GLA 11 19.779 -2.605 -2.800
73 H PHE 12 HN PHE 12 17.330 -0.407 0.826
74 HA PHE 12 HA PHE 12 19.370 1.666 1.287
75 HB2 PHE 12 HB2 PHE 12 17.542 3.140 1.479
76 HB3 PHE 12 HB1 PHE 12 16.951 1.961 0.325
77 HD1 PHE 12 HD1 PHE 12 15.739 -0.138 1.356
78 HD2 PHE 12 HD2 PHE 12 16.257 3.616 3.377
79 HE1 PHE 12 HE1 PHE 12 13.848 -0.689 2.861
80 HE2 PHE 12 HE2 PHE 12 14.366 3.065 4.883
81 HZ PHE 12 HZ PHE 12 13.162 0.913 4.627
82 H ALA 13 HN ALA 13 16.974 -0.247 3.129
83 HA ALA 13 HA ALA 13 17.798 0.785 5.693
84 HB1 ALA 13 HB1 ALA 13 16.701 -1.838 5.975
85 HB2 ALA 13 HB2 ALA 13 15.816 -1.016 4.691
86 HB3 ALA 13 HB3 ALA 13 15.918 -0.291 6.296
87 H ARG 14 HN ARG 14 18.749 -2.051 3.771
88 HA ARG 14 HA ARG 14 20.427 -3.139 5.886
89 HB2 ARG 14 HB2 ARG 14 20.979 -4.840 4.371
90 HB3 ARG 14 HB1 ARG 14 19.370 -4.362 3.830
91 HG2 ARG 14 HG2 ARG 14 20.443 -2.806 2.193
92 HG3 ARG 14 HG1 ARG 14 22.013 -3.469 2.656
93 HD2 ARG 14 HD2 ARG 14 21.284 -4.659 0.688
94 HD3 ARG 14 HD1 ARG 14 21.142 -5.755 2.060
95 HE ARG 14 HE ARG 14 18.652 -4.400 1.705
96 HH11 ARG 14 HH21 ARG 14 19.625 -7.431 1.771
97 HH12 ARG 14 HH22 ARG 14 18.830 -7.994 0.339
98 HH21 ARG 14 HH11 ARG 14 18.088 -4.809 -0.819
99 HH22 ARG 14 HH12 ARG 14 17.961 -6.509 -1.129
100 H CGU 15 HN GLA 15 21.166 -1.523 2.754
101 HA CGU 15 HA GLA 15 23.922 -1.353 2.890
102 HB2 CGU 15 HB2 GLA 15 23.335 1.201 2.155
103 HB3 CGU 15 HB3 GLA 15 21.782 0.435 1.875
104 HG CGU 15 HG GLA 15 22.899 -1.296 0.498
105 H LEU 16 HN LEU 16 21.543 0.492 4.638
106 HA LEU 16 HA LEU 16 23.327 2.318 5.954
107 HB2 LEU 16 HB2 LEU 16 20.663 2.197 5.792
108 HB3 LEU 16 HB1 LEU 16 20.851 1.398 7.351
109 HG LEU 16 HG LEU 16 20.600 3.767 7.762
110 HD11 LEU 16 HD11 LEU 16 23.572 3.288 7.957
111 HD12 LEU 16 HD12 LEU 16 22.434 2.388 8.961
112 HD13 LEU 16 HD13 LEU 16 22.521 4.145 9.084
113 HD21 LEU 16 HD21 LEU 16 23.062 4.562 6.331
114 HD22 LEU 16 HD22 LEU 16 21.518 5.402 6.464
115 HD23 LEU 16 HD23 LEU 16 21.717 4.102 5.289
116 H ALA 17 HN ALA 17 22.285 -0.963 6.722
117 HA ALA 17 HA ALA 17 23.944 -0.870 9.204
118 HB1 ALA 17 HB1 ALA 17 22.350 -3.289 8.698
119 HB2 ALA 17 HB2 ALA 17 21.385 -1.819 8.837
120 HB3 ALA 17 HB3 ALA 17 22.457 -2.298 10.153
121 H ASN 18 HN ASN 18 24.494 -1.442 6.125
122 HA ASN 18 HA ASN 18 26.470 -3.571 6.689
123 HB2 ASN 18 HB2 ASN 18 24.208 -4.453 5.684
124 HB3 ASN 18 HB1 ASN 18 24.806 -3.737 4.189
125 HD21 ASN 18 HD21 ASN 18 24.916 -6.557 6.086
126 HD22 ASN 18 HD22 ASN 18 26.283 -7.281 5.364
127 HN1 NH2 19 H1 NH2 19 25.927 -0.544 5.704
128 HN2 NH2 19 H2 NH2 19 27.047 -0.381 4.455
Start of MODEL 6
1 H1 GLY 1 HT1 GLY 1 -0.714 -0.312 -0.501
2 H2 GLY 1 HT2 GLY 1 -1.587 1.123 -0.763
3 H3 GLY 1 HT3 GLY 1 -0.256 1.116 0.293
4 HA2 GLY 1 HA1 GLY 1 0.162 0.318 -2.500
5 HA3 GLY 1 HA2 GLY 1 -0.012 2.032 -2.119
6 H GLU 2 HN GLU 2 1.413 -0.446 -0.024
7 HA GLU 2 HA GLU 2 3.682 1.157 0.625
8 HB2 GLU 2 HB2 GLU 2 4.608 -0.909 1.610
9 HB3 GLU 2 HB1 GLU 2 2.908 -0.712 2.040
10 HG2 GLU 2 HG2 GLU 2 2.230 -2.291 0.331
11 HG3 GLU 2 HG1 GLU 2 3.878 -2.391 -0.290
12 H CGU 3 HN GLA 3 2.987 0.000 -2.328
13 HA CGU 3 HA GLA 3 5.543 -1.172 -3.098
14 HB2 CGU 3 HB2 GLA 3 3.928 0.079 -5.214
15 HB3 CGU 3 HB3 GLA 3 3.025 -1.053 -4.219
16 HG CGU 3 HG GLA 3 5.653 -1.634 -5.612
17 H CGU 4 HN GLA 4 3.923 1.906 -3.849
18 HA CGU 4 HA GLA 4 5.939 3.227 -5.223
19 HB2 CGU 4 HB2 GLA 4 5.018 5.233 -3.563
20 HB3 CGU 4 HB3 GLA 4 3.689 4.077 -3.528
21 HG CGU 4 HG GLA 4 3.712 4.023 -6.014
22 H LEU 5 HN LEU 5 5.668 2.939 -1.673
23 HA LEU 5 HA LEU 5 8.144 4.416 -1.235
24 HB2 LEU 5 HB2 LEU 5 6.670 2.613 0.704
25 HB3 LEU 5 HB1 LEU 5 7.809 3.900 1.102
26 HG LEU 5 HG LEU 5 5.173 4.327 -0.335
27 HD11 LEU 5 HD11 LEU 5 5.950 4.874 2.548
28 HD12 LEU 5 HD12 LEU 5 4.850 3.605 2.009
29 HD13 LEU 5 HD13 LEU 5 4.411 5.301 1.799
30 HD21 LEU 5 HD21 LEU 5 7.454 6.073 0.518
31 HD22 LEU 5 HD22 LEU 5 5.822 6.735 0.593
32 HD23 LEU 5 HD23 LEU 5 6.468 6.156 -0.942
33 H ALA 6 HN ALA 6 7.180 0.982 -1.068
34 HA ALA 6 HA ALA 6 9.791 0.027 -0.333
35 HB1 ALA 6 HB1 ALA 6 7.776 -1.337 -0.009
36 HB2 ALA 6 HB2 ALA 6 8.926 -2.188 -1.043
37 HB3 ALA 6 HB3 ALA 6 7.519 -1.395 -1.753
38 H CGU 7 HN GLA 7 8.388 0.994 -3.364
39 HA CGU 7 HA GLA 7 10.299 -0.449 -5.023
40 HB2 CGU 7 HB2 GLA 7 9.419 1.289 -6.764
41 HB3 CGU 7 HB3 GLA 7 8.246 1.697 -5.510
42 HG CGU 7 HG GLA 7 7.689 -0.773 -5.372
43 H LYS 8 HN LYS 8 10.191 2.675 -3.439
44 HA LYS 8 HA LYS 8 12.720 3.453 -4.819
45 HB2 LYS 8 HB2 LYS 8 10.559 4.977 -3.402
46 HB3 LYS 8 HB1 LYS 8 12.185 5.659 -3.472
47 HG2 LYS 8 HG2 LYS 8 11.059 6.501 -5.399
48 HG3 LYS 8 HG1 LYS 8 12.108 5.214 -5.990
49 HD2 LYS 8 HD2 LYS 8 10.290 3.675 -6.164
50 HD3 LYS 8 HD1 LYS 8 9.221 4.727 -5.236
51 HE2 LYS 8 HE2 LYS 8 8.758 4.828 -7.683
52 HE3 LYS 8 HE1 LYS 8 9.246 6.390 -7.026
53 HZ1 LYS 8 HZ1 LYS 8 10.344 5.452 -9.182
54 HZ2 LYS 8 HZ2 LYS 8 11.311 4.595 -8.079
55 HZ3 LYS 8 HZ3 LYS 8 11.274 6.293 -8.038
56 H ALA 9 HN ALA 9 12.562 1.396 -2.690
57 HA ALA 9 HA ALA 9 14.430 2.712 -0.755
58 HB1 ALA 9 HB1 ALA 9 11.988 1.057 -0.157
59 HB2 ALA 9 HB2 ALA 9 12.512 2.573 0.579
60 HB3 ALA 9 HB3 ALA 9 13.355 1.071 0.957
61 HA HYP 10 HA HYP 10 15.776 -1.379 -3.014
62 HB2 HYP 10 HB2 HYP 10 18.271 0.045 -3.313
63 HB3 HYP 10 HB1 HYP 10 17.147 -0.422 -4.608
64 HG HYP 10 HG HYP 10 17.705 2.149 -3.839
65 HD22 HYP 10 HD22 HYP 10 16.598 2.189 -1.788
66 HD23 HYP 10 HD21 HYP 10 15.221 2.577 -2.842
67 HD1 HYP 10 HD1 HYP 10 15.988 2.628 -5.156
68 H CGU 11 HN GLA 11 18.077 -2.371 -2.158
69 HA CGU 11 HA GLA 11 18.028 -2.762 0.575
70 HB2 CGU 11 HB2 GLA 11 19.555 -4.178 -0.393
71 HB3 CGU 11 HB3 GLA 11 20.642 -2.948 0.239
72 HG CGU 11 HG GLA 11 19.550 -3.008 -2.572
73 H PHE 12 HN PHE 12 17.418 -0.485 1.028
74 HA PHE 12 HA PHE 12 19.631 1.442 1.267
75 HB2 PHE 12 HB2 PHE 12 17.972 3.092 1.318
76 HB3 PHE 12 HB1 PHE 12 17.257 1.879 0.280
77 HD1 PHE 12 HD2 PHE 12 16.223 -0.154 2.059
78 HD2 PHE 12 HD1 PHE 12 16.315 4.106 2.580
79 HE1 PHE 12 HE2 PHE 12 14.287 -0.301 3.595
80 HE2 PHE 12 HE1 PHE 12 14.374 3.960 4.114
81 HZ PHE 12 HZ PHE 12 13.359 1.755 4.622
82 H ALA 13 HN ALA 13 17.250 -0.243 3.329
83 HA ALA 13 HA ALA 13 18.248 1.020 5.756
84 HB1 ALA 13 HB1 ALA 13 16.371 -1.291 5.217
85 HB2 ALA 13 HB2 ALA 13 15.969 0.314 5.829
86 HB3 ALA 13 HB3 ALA 13 16.844 -0.827 6.850
87 H ARG 14 HN ARG 14 18.855 -1.953 3.963
88 HA ARG 14 HA ARG 14 20.454 -3.143 6.100
89 HB2 ARG 14 HB2 ARG 14 20.759 -4.963 4.655
90 HB3 ARG 14 HB1 ARG 14 19.197 -4.333 4.133
91 HG2 ARG 14 HG2 ARG 14 20.393 -2.980 2.396
92 HG3 ARG 14 HG1 ARG 14 21.886 -3.813 2.845
93 HD2 ARG 14 HD2 ARG 14 19.380 -5.006 1.648
94 HD3 ARG 14 HD1 ARG 14 21.019 -5.040 0.996
95 HE ARG 14 HE ARG 14 19.940 -6.901 2.925
96 HH11 ARG 14 HH11 ARG 14 22.412 -5.088 3.871
97 HH12 ARG 14 HH12 ARG 14 23.669 -6.266 3.691
98 HH21 ARG 14 HH21 ARG 14 21.710 -8.471 1.870
99 HH22 ARG 14 HH22 ARG 14 23.271 -8.182 2.561
100 H CGU 15 HN GLA 15 21.259 -1.791 2.857
101 HA CGU 15 HA GLA 15 24.031 -1.877 2.978
102 HB2 CGU 15 HB2 GLA 15 23.667 0.646 2.018
103 HB3 CGU 15 HB3 GLA 15 22.054 -0.011 1.786
104 HG CGU 15 HG GLA 15 23.013 -1.931 0.567
105 H LEU 16 HN LEU 16 21.818 0.310 4.540
106 HA LEU 16 HA LEU 16 23.643 2.147 5.697
107 HB2 LEU 16 HB2 LEU 16 21.000 2.031 5.729
108 HB3 LEU 16 HB1 LEU 16 21.264 1.205 7.265
109 HG LEU 16 HG LEU 16 21.002 3.615 7.638
110 HD11 LEU 16 HD11 LEU 16 23.944 3.165 7.984
111 HD12 LEU 16 HD12 LEU 16 22.820 2.087 8.815
112 HD13 LEU 16 HD13 LEU 16 22.772 3.823 9.126
113 HD21 LEU 16 HD21 LEU 16 22.035 5.207 6.377
114 HD22 LEU 16 HD22 LEU 16 22.253 3.897 5.217
115 HD23 LEU 16 HD23 LEU 16 23.556 4.315 6.330
116 H ALA 17 HN ALA 17 22.638 -1.075 6.769
117 HA ALA 17 HA ALA 17 24.441 -0.846 9.124
118 HB1 ALA 17 HB1 ALA 17 21.967 -2.216 8.581
119 HB2 ALA 17 HB2 ALA 17 22.816 -2.042 10.117
120 HB3 ALA 17 HB3 ALA 17 23.197 -3.391 9.047
121 H ASN 18 HN ASN 18 24.934 -1.502 6.032
122 HA ASN 18 HA ASN 18 27.053 -3.482 6.627
123 HB2 ASN 18 HB2 ASN 18 24.858 -4.555 5.702
124 HB3 ASN 18 HB1 ASN 18 25.336 -3.815 4.175
125 HD21 ASN 18 HD21 ASN 18 28.242 -4.304 5.561
126 HD22 ASN 18 HD22 ASN 18 28.587 -5.884 5.018
127 HN1 NH2 19 H1 NH2 19 26.309 -0.528 5.548
128 HN2 NH2 19 H2 NH2 19 27.410 -0.339 4.286
Start of MODEL 7
1 H1 GLY 1 HT1 GLY 1 -0.284 -0.119 -0.224
2 H2 GLY 1 HT2 GLY 1 -0.704 1.518 -0.050
3 H3 GLY 1 HT3 GLY 1 0.634 0.888 0.786
4 HA2 GLY 1 HA1 GLY 1 0.762 0.530 -2.073
5 HA3 GLY 1 HA2 GLY 1 0.781 2.213 -1.548
6 H GLU 2 HN GLU 2 2.124 -0.785 -0.126
7 HA GLU 2 HA GLU 2 4.546 0.600 0.687
8 HB2 GLU 2 HB2 GLU 2 3.534 -1.372 1.894
9 HB3 GLU 2 HB1 GLU 2 4.061 -2.389 0.553
10 HG2 GLU 2 HG2 GLU 2 6.389 -1.779 0.948
11 HG3 GLU 2 HG1 GLU 2 5.907 -0.650 2.215
12 H CGU 3 HN GLA 3 3.526 -0.474 -2.293
13 HA CGU 3 HA GLA 3 5.930 -1.703 -3.312
14 HB2 CGU 3 HB2 GLA 3 4.306 -0.163 -5.222
15 HB3 CGU 3 HB3 GLA 3 3.384 -1.308 -4.262
16 HG CGU 3 HG GLA 3 5.888 -1.957 -5.846
17 H CGU 4 HN GLA 4 4.576 1.564 -3.701
18 HA CGU 4 HA GLA 4 6.853 2.656 -5.034
19 HB2 CGU 4 HB2 GLA 4 4.365 3.600 -4.348
20 HB3 CGU 4 HB3 GLA 4 5.640 4.577 -5.055
21 HG CGU 4 HG GLA 4 5.262 4.169 -2.097
22 H LEU 5 HN LEU 5 5.929 2.596 -1.641
23 HA LEU 5 HA LEU 5 8.118 4.009 -0.550
24 HB2 LEU 5 HB2 LEU 5 6.875 1.536 0.689
25 HB3 LEU 5 HB1 LEU 5 7.666 2.868 1.532
26 HG LEU 5 HG LEU 5 5.126 3.103 -0.108
27 HD11 LEU 5 HD11 LEU 5 4.042 2.458 1.755
28 HD12 LEU 5 HD12 LEU 5 4.774 3.800 2.634
29 HD13 LEU 5 HD13 LEU 5 5.579 2.231 2.589
30 HD21 LEU 5 HD21 LEU 5 7.016 5.041 1.039
31 HD22 LEU 5 HD22 LEU 5 5.349 5.311 1.544
32 HD23 LEU 5 HD23 LEU 5 5.756 5.282 -0.170
33 H ALA 6 HN ALA 6 7.907 0.675 -1.679
34 HA ALA 6 HA ALA 6 10.635 0.069 -0.753
35 HB1 ALA 6 HB1 ALA 6 8.685 -1.529 -2.442
36 HB2 ALA 6 HB2 ALA 6 8.948 -1.711 -0.707
37 HB3 ALA 6 HB3 ALA 6 10.231 -2.130 -1.843
38 H CGU 7 HN GLA 7 8.968 0.281 -3.918
39 HA CGU 7 HA GLA 7 11.240 -0.055 -5.553
40 HB2 CGU 7 HB2 GLA 7 9.964 1.225 -7.268
41 HB3 CGU 7 HB3 GLA 7 8.805 1.684 -6.022
42 HG CGU 7 HG GLA 7 8.305 -0.705 -5.615
43 H LYS 8 HN LYS 8 10.252 2.700 -3.644
44 HA LYS 8 HA LYS 8 12.406 4.334 -4.909
45 HB2 LYS 8 HB2 LYS 8 9.923 5.021 -3.356
46 HB3 LYS 8 HB1 LYS 8 11.262 6.167 -3.435
47 HG2 LYS 8 HG2 LYS 8 9.850 6.733 -5.266
48 HG3 LYS 8 HG1 LYS 8 11.194 5.840 -5.976
49 HD2 LYS 8 HD2 LYS 8 9.858 3.796 -6.020
50 HD3 LYS 8 HD1 LYS 8 8.524 4.620 -5.214
51 HE2 LYS 8 HE2 LYS 8 9.661 5.396 -7.916
52 HE3 LYS 8 HE1 LYS 8 8.175 4.480 -7.670
53 HZ1 LYS 8 HZ1 LYS 8 8.719 7.307 -7.188
54 HZ2 LYS 8 HZ2 LYS 8 7.666 6.526 -6.107
55 HZ3 LYS 8 HZ3 LYS 8 7.312 6.556 -7.769
56 H ALA 9 HN ALA 9 12.801 2.127 -2.921
57 HA ALA 9 HA ALA 9 14.837 3.302 -1.329
58 HB1 ALA 9 HB1 ALA 9 13.492 2.894 0.916
59 HB2 ALA 9 HB2 ALA 9 12.106 3.268 -0.108
60 HB3 ALA 9 HB3 ALA 9 13.407 4.443 0.079
61 HA HYP 10 HA HYP 10 14.043 -1.471 -1.834
62 HB2 HYP 10 HB2 HYP 10 16.768 -1.450 -2.792
63 HB3 HYP 10 HB1 HYP 10 15.307 -1.805 -3.739
64 HG HYP 10 HG HYP 10 16.937 0.369 -4.088
65 HD22 HYP 10 HD22 HYP 10 16.385 1.579 -2.171
66 HD23 HYP 10 HD21 HYP 10 15.068 2.133 -3.229
67 HD1 HYP 10 HD1 HYP 10 15.368 0.957 -5.476
68 H CGU 11 HN GLA 11 15.932 -2.991 -0.770
69 HA CGU 11 HA GLA 11 16.310 -2.384 1.894
70 HB2 CGU 11 HB2 GLA 11 16.991 -4.541 1.506
71 HB3 CGU 11 HB3 GLA 11 18.558 -3.742 1.506
72 HG CGU 11 HG GLA 11 16.923 -4.263 -0.968
73 H PHE 12 HN PHE 12 16.690 -0.055 1.459
74 HA PHE 12 HA PHE 12 19.441 0.731 0.784
75 HB2 PHE 12 HB2 PHE 12 18.551 2.861 0.363
76 HB3 PHE 12 HB1 PHE 12 17.246 1.795 -0.111
77 HD1 PHE 12 HD2 PHE 12 15.985 1.011 2.398
78 HD2 PHE 12 HD1 PHE 12 17.633 4.802 1.241
79 HE1 PHE 12 HE2 PHE 12 14.491 2.150 4.010
80 HE2 PHE 12 HE1 PHE 12 16.137 5.943 2.855
81 HZ PHE 12 HZ PHE 12 14.564 4.617 4.239
82 H ALA 13 HN ALA 13 17.167 0.939 3.531
83 HA ALA 13 HA ALA 13 19.021 2.423 5.192
84 HB1 ALA 13 HB1 ALA 13 16.965 2.729 6.124
85 HB2 ALA 13 HB2 ALA 13 17.310 1.213 6.956
86 HB3 ALA 13 HB3 ALA 13 16.344 1.209 5.480
87 H ARG 14 HN ARG 14 18.338 -0.990 4.613
88 HA ARG 14 HA ARG 14 19.991 -1.869 6.866
89 HB2 ARG 14 HB2 ARG 14 19.395 -4.055 6.262
90 HB3 ARG 14 HB1 ARG 14 17.997 -3.126 5.726
91 HG2 ARG 14 HG2 ARG 14 19.054 -2.968 3.460
92 HG3 ARG 14 HG1 ARG 14 20.303 -4.084 4.020
93 HD2 ARG 14 HD2 ARG 14 17.336 -4.615 3.761
94 HD3 ARG 14 HD1 ARG 14 18.653 -5.428 2.917
95 HE ARG 14 HE ARG 14 17.649 -6.200 5.461
96 HH11 ARG 14 HH11 ARG 14 20.454 -6.008 3.504
97 HH12 ARG 14 HH12 ARG 14 21.459 -6.883 4.612
98 HH21 ARG 14 HH21 ARG 14 19.011 -7.130 7.054
99 HH22 ARG 14 HH22 ARG 14 20.645 -7.513 6.622
100 H CGU 15 HN GLA 15 20.310 -2.107 3.282
101 HA CGU 15 HA GLA 15 22.880 -3.145 3.106
102 HB2 CGU 15 HB2 GLA 15 23.020 -1.176 1.228
103 HB3 CGU 15 HB3 GLA 15 21.282 -1.250 1.477
104 HG CGU 15 HG GLA 15 21.337 -3.690 1.083
105 H LEU 16 HN LEU 16 21.864 0.095 3.871
106 HA LEU 16 HA LEU 16 24.409 1.378 3.911
107 HB2 LEU 16 HB2 LEU 16 22.211 2.562 4.043
108 HB3 LEU 16 HB1 LEU 16 22.034 1.982 5.699
109 HG LEU 16 HG LEU 16 24.144 3.123 6.315
110 HD11 LEU 16 HD11 LEU 16 24.166 3.608 3.376
111 HD12 LEU 16 HD12 LEU 16 25.514 3.338 4.482
112 HD13 LEU 16 HD13 LEU 16 24.742 4.921 4.403
113 HD21 LEU 16 HD21 LEU 16 23.127 5.180 6.594
114 HD22 LEU 16 HD22 LEU 16 21.718 4.242 6.096
115 HD23 LEU 16 HD23 LEU 16 22.570 5.246 4.923
116 H ALA 17 HN ALA 17 22.857 -0.731 6.254
117 HA ALA 17 HA ALA 17 25.062 -0.177 8.180
118 HB1 ALA 17 HB1 ALA 17 23.526 -1.733 9.644
119 HB2 ALA 17 HB2 ALA 17 22.301 -1.324 8.443
120 HB3 ALA 17 HB3 ALA 17 23.070 -0.048 9.387
121 H ASN 18 HN ASN 18 24.596 -2.165 5.654
122 HA ASN 18 HA ASN 18 26.344 -4.238 6.837
123 HB2 ASN 18 HB2 ASN 18 23.798 -4.874 6.852
124 HB3 ASN 18 HB1 ASN 18 24.024 -5.082 5.117
125 HD21 ASN 18 HD21 ASN 18 27.009 -5.729 6.376
126 HD22 ASN 18 HD22 ASN 18 26.873 -7.415 6.598
127 HN1 NH2 19 H1 NH2 19 25.987 -1.948 4.618
128 HN2 NH2 19 H2 NH2 19 26.708 -2.650 3.269
Start of MODEL 8
1 H1 GLY 1 HT1 GLY 1 3.361 5.640 2.024
2 H2 GLY 1 HT2 GLY 1 4.549 6.850 2.134
3 H3 GLY 1 HT3 GLY 1 4.870 5.284 2.712
4 HA2 GLY 1 HA1 GLY 1 4.106 5.509 -0.091
5 HA3 GLY 1 HA2 GLY 1 5.702 6.113 0.354
6 H GLU 2 HN GLU 2 4.213 3.542 2.191
7 HA GLU 2 HA GLU 2 6.389 1.788 2.082
8 HB2 GLU 2 HB2 GLU 2 4.402 1.524 3.579
9 HB3 GLU 2 HB1 GLU 2 3.470 0.968 2.189
10 HG2 GLU 2 HG2 GLU 2 4.992 -0.919 1.877
11 HG3 GLU 2 HG1 GLU 2 6.017 -0.340 3.192
12 H CGU 3 HN GLA 3 4.324 2.671 -0.468
13 HA CGU 3 HA GLA 3 4.594 0.164 -1.973
14 HB2 CGU 3 HB2 GLA 3 3.866 2.576 -3.475
15 HB3 CGU 3 HB3 GLA 3 2.847 2.300 -2.071
16 HG CGU 3 HG GLA 3 3.476 0.234 -4.200
17 H CGU 4 HN GLA 4 5.742 3.513 -2.370
18 HA CGU 4 HA GLA 4 7.514 2.890 -4.543
19 HB2 CGU 4 HB2 GLA 4 6.671 5.209 -3.262
20 HB3 CGU 4 HB3 GLA 4 7.832 5.132 -4.577
21 HG CGU 4 HG GLA 4 8.544 4.877 -1.668
22 H LEU 5 HN LEU 5 7.976 3.181 -1.067
23 HA LEU 5 HA LEU 5 10.779 2.681 -0.993
24 HB2 LEU 5 HB2 LEU 5 8.763 1.728 1.062
25 HB3 LEU 5 HB1 LEU 5 10.469 2.082 1.331
26 HG LEU 5 HG LEU 5 8.452 4.136 0.392
27 HD11 LEU 5 HD11 LEU 5 7.724 4.170 2.529
28 HD12 LEU 5 HD12 LEU 5 9.319 4.772 2.978
29 HD13 LEU 5 HD13 LEU 5 8.979 3.043 3.039
30 HD21 LEU 5 HD21 LEU 5 11.358 4.170 1.190
31 HD22 LEU 5 HD22 LEU 5 10.370 5.620 1.365
32 HD23 LEU 5 HD23 LEU 5 10.593 4.892 -0.224
33 H ALA 6 HN ALA 6 8.032 0.491 -1.269
34 HA ALA 6 HA ALA 6 9.758 -1.886 -1.054
35 HB1 ALA 6 HB1 ALA 6 7.530 -2.084 -0.130
36 HB2 ALA 6 HB2 ALA 6 7.607 -3.105 -1.567
37 HB3 ALA 6 HB3 ALA 6 6.804 -1.537 -1.642
38 H CGU 7 HN GLA 7 7.642 -0.446 -3.560
39 HA CGU 7 HA GLA 7 8.317 -2.142 -5.691
40 HB2 CGU 7 HB2 GLA 7 7.829 -0.155 -7.165
41 HB3 CGU 7 HB3 GLA 7 7.734 0.830 -5.707
42 HG CGU 7 HG GLA 7 5.924 -0.637 -4.853
43 H LYS 8 HN LYS 8 10.097 0.631 -4.383
44 HA LYS 8 HA LYS 8 12.267 0.108 -6.361
45 HB2 LYS 8 HB2 LYS 8 11.546 2.481 -4.650
46 HB3 LYS 8 HB1 LYS 8 13.169 2.314 -5.321
47 HG2 LYS 8 HG2 LYS 8 11.968 3.577 -6.937
48 HG3 LYS 8 HG1 LYS 8 12.017 1.939 -7.587
49 HD2 LYS 8 HD2 LYS 8 9.762 1.504 -6.715
50 HD3 LYS 8 HD1 LYS 8 9.709 3.123 -6.017
51 HE2 LYS 8 HE2 LYS 8 9.984 2.482 -8.969
52 HE3 LYS 8 HE1 LYS 8 8.525 3.076 -8.176
53 HZ1 LYS 8 HZ1 LYS 8 9.933 5.011 -7.432
54 HZ2 LYS 8 HZ2 LYS 8 9.570 4.950 -9.091
55 HZ3 LYS 8 HZ3 LYS 8 11.106 4.481 -8.536
56 H ALA 9 HN ALA 9 11.808 0.739 -2.870
57 HA ALA 9 HA ALA 9 13.268 0.246 -1.063
58 HB1 ALA 9 HB1 ALA 9 13.986 -2.299 -1.343
59 HB2 ALA 9 HB2 ALA 9 12.786 -2.246 -2.635
60 HB3 ALA 9 HB3 ALA 9 12.320 -1.849 -0.981
61 HA HYP 10 HA HYP 10 16.999 0.835 -4.101
62 HB2 HYP 10 HB2 HYP 10 17.559 3.108 -2.410
63 HB3 HYP 10 HB1 HYP 10 17.065 3.144 -4.115
64 HG HYP 10 HG HYP 10 15.575 4.056 -1.997
65 HD22 HYP 10 HD22 HYP 10 14.934 2.032 -1.049
66 HD23 HYP 10 HD21 HYP 10 13.685 2.128 -2.310
67 HD1 HYP 10 HD1 HYP 10 15.207 3.440 -4.633
68 H CGU 11 HN GLA 11 19.328 1.148 -2.861
69 HA CGU 11 HA GLA 11 19.794 -0.946 -1.123
70 HB2 CGU 11 HB2 GLA 11 21.794 -0.004 -1.755
71 HB3 CGU 11 HB3 GLA 11 21.612 0.712 -0.158
72 HG CGU 11 HG GLA 11 20.739 2.014 -2.731
73 H PHE 12 HN PHE 12 17.719 -0.645 0.040
74 HA PHE 12 HA PHE 12 17.767 1.274 2.279
75 HB2 PHE 12 HB2 PHE 12 15.438 1.066 2.311
76 HB3 PHE 12 HB1 PHE 12 15.796 0.856 0.609
77 HD1 PHE 12 HD2 PHE 12 16.670 -1.854 0.280
78 HD2 PHE 12 HD1 PHE 12 13.692 -0.305 2.955
79 HE1 PHE 12 HE2 PHE 12 15.570 -4.072 0.339
80 HE2 PHE 12 HE1 PHE 12 12.589 -2.524 3.015
81 HZ PHE 12 HZ PHE 12 13.527 -4.409 1.705
82 H ALA 13 HN ALA 13 17.517 -2.232 1.653
83 HA ALA 13 HA ALA 13 17.348 -2.905 4.468
84 HB1 ALA 13 HB1 ALA 13 18.155 -4.619 2.097
85 HB2 ALA 13 HB2 ALA 13 16.511 -4.430 2.706
86 HB3 ALA 13 HB3 ALA 13 17.736 -5.216 3.703
87 H ARG 14 HN ARG 14 19.933 -2.447 2.126
88 HA ARG 14 HA ARG 14 21.978 -3.527 3.920
89 HB2 ARG 14 HB2 ARG 14 23.514 -3.090 2.201
90 HB3 ARG 14 HB1 ARG 14 22.026 -3.404 1.311
91 HG2 ARG 14 HG2 ARG 14 21.588 -0.941 1.272
92 HG3 ARG 14 HG1 ARG 14 23.176 -0.693 2.007
93 HD2 ARG 14 HD2 ARG 14 23.453 -0.448 -0.376
94 HD3 ARG 14 HD1 ARG 14 24.177 -1.987 0.085
95 HE ARG 14 HE ARG 14 21.455 -2.443 -0.647
96 HH11 ARG 14 HH21 ARG 14 23.793 -0.693 -2.316
97 HH12 ARG 14 HH22 ARG 14 23.792 -1.703 -3.723
98 HH21 ARG 14 HH11 ARG 14 21.752 -4.124 -2.314
99 HH22 ARG 14 HH12 ARG 14 22.638 -3.644 -3.723
100 H CGU 15 HN GLA 15 21.260 -0.225 2.643
101 HA CGU 15 HA GLA 15 23.055 1.244 4.193
102 HB2 CGU 15 HB2 GLA 15 20.841 2.805 4.407
103 HB3 CGU 15 HB3 GLA 15 20.342 1.754 3.092
104 HG CGU 15 HG GLA 15 22.424 2.299 1.875
105 H LEU 16 HN LEU 16 19.970 -0.133 5.056
106 HA LEU 16 HA LEU 16 19.597 0.883 7.653
107 HB2 LEU 16 HB2 LEU 16 17.910 -0.513 6.617
108 HB3 LEU 16 HB1 LEU 16 19.011 -1.891 6.584
109 HG LEU 16 HG LEU 16 18.673 -0.681 9.249
110 HD11 LEU 16 HD11 LEU 16 16.368 -2.102 7.887
111 HD12 LEU 16 HD12 LEU 16 16.383 -0.410 8.388
112 HD13 LEU 16 HD13 LEU 16 16.444 -1.690 9.600
113 HD21 LEU 16 HD21 LEU 16 18.620 -3.011 9.911
114 HD22 LEU 16 HD22 LEU 16 19.875 -2.829 8.685
115 HD23 LEU 16 HD23 LEU 16 18.311 -3.523 8.252
116 H ALA 17 HN ALA 17 21.794 -1.646 6.543
117 HA ALA 17 HA ALA 17 22.740 -2.003 9.354
118 HB1 ALA 17 HB1 ALA 17 22.183 -4.118 8.425
119 HB2 ALA 17 HB2 ALA 17 23.941 -4.017 8.305
120 HB3 ALA 17 HB3 ALA 17 22.941 -3.723 6.882
121 H ASN 18 HN ASN 18 23.418 0.001 6.966
122 HA ASN 18 HA ASN 18 26.298 0.078 7.630
123 HB2 ASN 18 HB2 ASN 18 25.756 -1.223 5.414
124 HB3 ASN 18 HB1 ASN 18 25.451 0.385 4.762
125 HD21 ASN 18 HD21 ASN 18 27.884 -1.875 5.084
126 HD22 ASN 18 HD22 ASN 18 29.235 -0.834 5.039
127 HN1 NH2 19 H1 NH2 19 23.473 1.604 7.681
128 HN2 NH2 19 H2 NH2 19 23.915 3.179 7.274
Start of MODEL 9
1 H1 GLY 1 HT1 GLY 1 0.527 5.193 1.787
2 H2 GLY 1 HT2 GLY 1 1.783 6.301 2.070
3 H3 GLY 1 HT3 GLY 1 1.927 4.694 2.604
4 HA2 GLY 1 HA1 GLY 1 1.526 4.264 0.017
5 HA3 GLY 1 HA2 GLY 1 2.349 5.822 -0.038
6 H GLU 2 HN GLU 2 2.698 2.436 0.675
7 HA GLU 2 HA GLU 2 5.601 2.909 1.227
8 HB2 GLU 2 HB2 GLU 2 3.861 0.596 2.150
9 HB3 GLU 2 HB1 GLU 2 5.581 0.786 2.489
10 HG2 GLU 2 HG2 GLU 2 3.554 2.887 3.272
11 HG3 GLU 2 HG1 GLU 2 3.968 1.543 4.334
12 H CGU 3 HN GLA 3 3.781 2.271 -1.266
13 HA CGU 3 HA GLA 3 4.777 -0.294 -2.208
14 HB2 CGU 3 HB2 GLA 3 3.927 1.621 -4.255
15 HB3 CGU 3 HB3 GLA 3 2.760 1.459 -2.951
16 HG CGU 3 HG GLA 3 3.957 -0.842 -4.519
17 H CGU 4 HN GLA 4 5.388 3.081 -3.185
18 HA CGU 4 HA GLA 4 7.415 2.714 -5.041
19 HB2 CGU 4 HB2 GLA 4 8.401 4.852 -3.605
20 HB3 CGU 4 HB3 GLA 4 6.696 4.869 -3.168
21 HG CGU 4 HG GLA 4 6.093 4.799 -5.572
22 H LEU 5 HN LEU 5 7.784 2.711 -1.497
23 HA LEU 5 HA LEU 5 10.649 2.214 -1.633
24 HB2 LEU 5 HB2 LEU 5 8.825 1.719 0.731
25 HB3 LEU 5 HB1 LEU 5 10.553 2.071 0.756
26 HG LEU 5 HG LEU 5 8.468 3.993 -0.312
27 HD11 LEU 5 HD11 LEU 5 9.910 4.242 2.328
28 HD12 LEU 5 HD12 LEU 5 8.366 3.397 2.210
29 HD13 LEU 5 HD13 LEU 5 8.473 5.103 1.775
30 HD21 LEU 5 HD21 LEU 5 11.397 3.906 -0.190
31 HD22 LEU 5 HD22 LEU 5 10.728 5.373 0.525
32 HD23 LEU 5 HD23 LEU 5 10.346 4.952 -1.144
33 H ALA 6 HN ALA 6 7.744 0.229 -1.233
34 HA ALA 6 HA ALA 6 9.245 -2.200 -0.669
35 HB1 ALA 6 HB1 ALA 6 6.414 -2.118 -1.704
36 HB2 ALA 6 HB2 ALA 6 6.792 -1.658 -0.044
37 HB3 ALA 6 HB3 ALA 6 7.152 -3.288 -0.610
38 H CGU 7 HN GLA 7 8.133 -0.570 -3.556
39 HA CGU 7 HA GLA 7 8.589 -2.954 -5.231
40 HB2 CGU 7 HB2 GLA 7 8.000 -1.392 -7.104
41 HB3 CGU 7 HB3 GLA 7 7.821 -0.106 -5.911
42 HG CGU 7 HG GLA 7 6.087 -1.437 -4.748
43 H LYS 8 HN LYS 8 10.162 0.132 -4.494
44 HA LYS 8 HA LYS 8 12.350 -0.538 -6.387
45 HB2 LYS 8 HB2 LYS 8 11.556 1.941 -4.880
46 HB3 LYS 8 HB1 LYS 8 13.190 1.778 -5.525
47 HG2 LYS 8 HG2 LYS 8 11.920 2.869 -7.230
48 HG3 LYS 8 HG1 LYS 8 12.112 1.200 -7.762
49 HD2 LYS 8 HD2 LYS 8 9.876 0.651 -6.897
50 HD3 LYS 8 HD1 LYS 8 9.679 2.311 -6.330
51 HE2 LYS 8 HE2 LYS 8 9.844 3.148 -8.623
52 HE3 LYS 8 HE1 LYS 8 10.136 1.515 -9.221
53 HZ1 LYS 8 HZ1 LYS 8 7.670 2.546 -7.939
54 HZ2 LYS 8 HZ2 LYS 8 7.950 0.898 -8.242
55 HZ3 LYS 8 HZ3 LYS 8 7.851 1.997 -9.533
56 H ALA 9 HN ALA 9 11.746 -0.054 -2.926
57 HA ALA 9 HA ALA 9 13.175 -0.412 -1.072
58 HB1 ALA 9 HB1 ALA 9 12.705 -2.694 -1.408
59 HB2 ALA 9 HB2 ALA 9 14.468 -2.639 -1.375
60 HB3 ALA 9 HB3 ALA 9 13.618 -2.756 -2.916
61 HA HYP 10 HA HYP 10 16.700 1.524 -3.757
62 HB2 HYP 10 HB2 HYP 10 16.651 3.545 -1.694
63 HB3 HYP 10 HB1 HYP 10 16.171 3.745 -3.393
64 HG HYP 10 HG HYP 10 14.486 3.888 -1.235
65 HD22 HYP 10 HD22 HYP 10 14.418 1.637 -0.642
66 HD23 HYP 10 HD21 HYP 10 13.162 1.619 -1.901
67 HD1 HYP 10 HD1 HYP 10 12.958 3.971 -2.793
68 H CGU 11 HN GLA 11 18.865 2.180 -2.397
69 HA CGU 11 HA GLA 11 19.836 0.021 -0.972
70 HB2 CGU 11 HB2 GLA 11 21.543 1.501 -1.401
71 HB3 CGU 11 HB3 GLA 11 21.201 1.913 0.274
72 HG CGU 11 HG GLA 11 19.982 3.324 -2.090
73 H PHE 12 HN PHE 12 17.750 -0.358 0.143
74 HA PHE 12 HA PHE 12 17.291 1.152 2.634
75 HB2 PHE 12 HB2 PHE 12 15.122 0.274 2.542
76 HB3 PHE 12 HB1 PHE 12 15.529 0.357 0.839
77 HD1 PHE 12 HD1 PHE 12 16.752 -1.762 -0.144
78 HD2 PHE 12 HD2 PHE 12 14.373 -1.757 3.431
79 HE1 PHE 12 HE1 PHE 12 16.436 -4.213 -0.352
80 HE2 PHE 12 HE2 PHE 12 14.056 -4.207 3.225
81 HZ PHE 12 HZ PHE 12 15.088 -5.436 1.334
82 H ALA 13 HN ALA 13 17.863 -2.198 1.531
83 HA ALA 13 HA ALA 13 18.000 -3.275 4.209
84 HB1 ALA 13 HB1 ALA 13 18.672 -4.265 1.461
85 HB2 ALA 13 HB2 ALA 13 17.548 -4.931 2.645
86 HB3 ALA 13 HB3 ALA 13 19.284 -5.153 2.856
87 H ARG 14 HN ARG 14 20.314 -1.723 2.087
88 HA ARG 14 HA ARG 14 22.603 -2.651 3.689
89 HB2 ARG 14 HB2 ARG 14 23.970 -1.681 2.069
90 HB3 ARG 14 HB1 ARG 14 22.543 -2.096 1.121
91 HG2 ARG 14 HG2 ARG 14 21.673 0.210 1.508
92 HG3 ARG 14 HG1 ARG 14 23.199 0.615 2.301
93 HD2 ARG 14 HD2 ARG 14 22.887 -0.335 -0.564
94 HD3 ARG 14 HD1 ARG 14 23.273 1.309 -0.052
95 HE ARG 14 HE ARG 14 25.199 -0.718 -0.402
96 HH11 ARG 14 HH21 ARG 14 24.608 2.177 1.200
97 HH12 ARG 14 HH22 ARG 14 25.946 2.048 2.293
98 HH21 ARG 14 HH11 ARG 14 26.734 -1.197 1.359
99 HH22 ARG 14 HH12 ARG 14 27.148 0.135 2.386
100 H CGU 15 HN GLA 15 21.156 0.558 2.916
101 HA CGU 15 HA GLA 15 22.649 2.146 4.654
102 HB2 CGU 15 HB2 GLA 15 20.132 3.153 5.050
103 HB3 CGU 15 HB3 GLA 15 19.907 2.260 3.555
104 HG CGU 15 HG GLA 15 21.895 3.421 2.602
105 H LEU 16 HN LEU 16 19.974 0.022 5.354
106 HA LEU 16 HA LEU 16 19.838 0.712 8.186
107 HB2 LEU 16 HB2 LEU 16 18.530 -1.269 6.387
108 HB3 LEU 16 HB1 LEU 16 18.574 -1.659 8.107
109 HG LEU 16 HG LEU 16 17.584 0.556 8.621
110 HD11 LEU 16 HD11 LEU 16 18.080 0.899 5.733
111 HD12 LEU 16 HD12 LEU 16 17.950 2.114 7.005
112 HD13 LEU 16 HD13 LEU 16 16.492 1.450 6.268
113 HD21 LEU 16 HD21 LEU 16 16.277 -1.646 7.890
114 HD22 LEU 16 HD22 LEU 16 15.786 -0.627 6.537
115 HD23 LEU 16 HD23 LEU 16 15.413 -0.138 8.190
116 H ALA 17 HN ALA 17 21.585 -1.640 6.266
117 HA ALA 17 HA ALA 17 22.631 -2.871 8.776
118 HB1 ALA 17 HB1 ALA 17 22.284 -3.853 5.968
119 HB2 ALA 17 HB2 ALA 17 21.925 -4.670 7.490
120 HB3 ALA 17 HB3 ALA 17 23.593 -4.528 6.937
121 H ASN 18 HN ASN 18 23.395 -0.415 6.806
122 HA ASN 18 HA ASN 18 26.280 -0.690 7.380
123 HB2 ASN 18 HB2 ASN 18 25.634 -1.498 4.979
124 HB3 ASN 18 HB1 ASN 18 25.392 0.216 4.648
125 HD21 ASN 18 HD21 ASN 18 27.717 0.164 7.009
126 HD22 ASN 18 HD22 ASN 18 29.115 0.153 6.031
127 HN1 NH2 19 H1 NH2 19 23.596 0.974 7.854
128 HN2 NH2 19 H2 NH2 19 24.132 2.567 7.740
Start of MODEL 10
1 H1 GLY 1 HT1 GLY 1 -0.482 2.576 -1.191
2 H2 GLY 1 HT2 GLY 1 -0.419 1.067 -0.414
3 H3 GLY 1 HT3 GLY 1 -1.361 1.265 -1.813
4 HA2 GLY 1 HA1 GLY 1 0.415 0.328 -2.808
5 HA3 GLY 1 HA2 GLY 1 0.979 1.999 -2.791
6 H GLU 2 HN GLU 2 2.159 -0.919 -2.290
7 HA GLU 2 HA GLU 2 3.795 -0.077 0.070
8 HB2 GLU 2 HB2 GLU 2 2.252 -2.121 0.342
9 HB3 GLU 2 HB1 GLU 2 3.338 -2.943 -0.778
10 HG2 GLU 2 HG2 GLU 2 4.160 -3.479 1.392
11 HG3 GLU 2 HG1 GLU 2 5.243 -2.228 0.784
12 H CGU 3 HN GLA 3 3.847 -0.443 -3.208
13 HA CGU 3 HA GLA 3 6.589 -1.568 -3.360
14 HB2 CGU 3 HB2 GLA 3 5.348 -0.453 -5.794
15 HB3 CGU 3 HB3 GLA 3 4.424 -1.740 -5.037
16 HG CGU 3 HG GLA 3 7.352 -1.884 -5.804
17 H CGU 4 HN GLA 4 4.864 1.322 -4.511
18 HA CGU 4 HA GLA 4 7.039 2.851 -5.362
19 HB2 CGU 4 HB2 GLA 4 5.468 4.768 -4.165
20 HB3 CGU 4 HB3 GLA 4 4.316 3.458 -4.410
21 HG CGU 4 HG GLA 4 4.994 3.319 -6.786
22 H LEU 5 HN LEU 5 5.778 2.631 -2.022
23 HA LEU 5 HA LEU 5 7.751 4.444 -0.943
24 HB2 LEU 5 HB2 LEU 5 6.259 2.271 0.548
25 HB3 LEU 5 HB1 LEU 5 6.936 3.756 1.215
26 HG LEU 5 HG LEU 5 4.798 3.752 -0.923
27 HD11 LEU 5 HD11 LEU 5 4.595 3.603 2.075
28 HD12 LEU 5 HD12 LEU 5 3.659 2.739 0.856
29 HD13 LEU 5 HD13 LEU 5 3.357 4.451 1.149
30 HD21 LEU 5 HD21 LEU 5 4.767 6.017 0.816
31 HD22 LEU 5 HD22 LEU 5 5.183 5.974 -0.897
32 HD23 LEU 5 HD23 LEU 5 6.439 5.753 0.320
33 H ALA 6 HN ALA 6 7.649 0.979 -1.529
34 HA ALA 6 HA ALA 6 10.127 0.525 -0.002
35 HB1 ALA 6 HB1 ALA 6 9.784 -1.768 -0.404
36 HB2 ALA 6 HB2 ALA 6 8.853 -1.463 -1.871
37 HB3 ALA 6 HB3 ALA 6 8.143 -1.130 -0.292
38 H CGU 7 HN GLA 7 9.191 1.246 -3.263
39 HA CGU 7 HA GLA 7 11.634 0.204 -4.474
40 HB2 CGU 7 HB2 GLA 7 10.783 1.751 -6.412
41 HB3 CGU 7 HB3 GLA 7 9.322 1.868 -5.430
42 HG CGU 7 HG GLA 7 9.215 -0.630 -5.371
43 H LYS 8 HN LYS 8 10.484 3.372 -3.358
44 HA LYS 8 HA LYS 8 12.838 4.757 -4.336
45 HB2 LYS 8 HB2 LYS 8 11.747 6.643 -3.764
46 HB3 LYS 8 HB1 LYS 8 10.365 5.579 -3.542
47 HG2 LYS 8 HG2 LYS 8 12.314 6.368 -1.352
48 HG3 LYS 8 HG1 LYS 8 10.726 7.067 -1.607
49 HD2 LYS 8 HD2 LYS 8 9.926 4.559 -1.520
50 HD3 LYS 8 HD1 LYS 8 11.431 4.329 -0.632
51 HE2 LYS 8 HE2 LYS 8 9.387 6.447 0.077
52 HE3 LYS 8 HE1 LYS 8 9.439 4.854 0.831
53 HZ1 LYS 8 HZ1 LYS 8 11.794 5.345 1.413
54 HZ2 LYS 8 HZ2 LYS 8 10.660 6.339 2.195
55 HZ3 LYS 8 HZ3 LYS 8 11.549 6.937 0.878
56 H ALA 9 HN ALA 9 12.473 2.576 -1.862
57 HA ALA 9 HA ALA 9 15.083 3.220 -0.758
58 HB1 ALA 9 HB1 ALA 9 13.461 4.870 0.362
59 HB2 ALA 9 HB2 ALA 9 14.493 3.906 1.419
60 HB3 ALA 9 HB3 ALA 9 12.799 3.463 1.196
61 HA HYP 10 HA HYP 10 13.065 -1.194 -0.583
62 HB2 HYP 10 HB2 HYP 10 15.582 -1.998 -1.747
63 HB3 HYP 10 HB1 HYP 10 13.983 -2.058 -2.520
64 HG HYP 10 HG HYP 10 16.064 -0.441 -3.283
65 HD22 HYP 10 HD22 HYP 10 16.043 1.084 -1.519
66 HD23 HYP 10 HD21 HYP 10 14.792 1.835 -2.535
67 HD1 HYP 10 HD1 HYP 10 13.262 -0.042 -3.499
68 H CGU 11 HN GLA 11 14.614 -3.020 0.552
69 HA CGU 11 HA GLA 11 15.455 -2.151 3.033
70 HB2 CGU 11 HB2 GLA 11 15.209 -4.529 2.456
71 HB3 CGU 11 HB3 GLA 11 16.745 -4.164 3.220
72 HG CGU 11 HG GLA 11 17.969 -4.498 1.256
73 H PHE 12 HN PHE 12 16.383 -0.143 2.223
74 HA PHE 12 HA PHE 12 19.119 -0.233 1.162
75 HB2 PHE 12 HB2 PHE 12 18.773 1.993 0.524
76 HB3 PHE 12 HB1 PHE 12 17.179 1.289 0.356
77 HD1 PHE 12 HD2 PHE 12 16.124 1.191 3.071
78 HD2 PHE 12 HD1 PHE 12 18.539 4.199 1.189
79 HE1 PHE 12 HE2 PHE 12 15.231 2.885 4.639
80 HE2 PHE 12 HE1 PHE 12 17.645 5.897 2.758
81 HZ PHE 12 HZ PHE 12 15.990 5.239 4.484
82 H ALA 13 HN ALA 13 17.406 0.954 4.069
83 HA ALA 13 HA ALA 13 19.568 2.228 5.339
84 HB1 ALA 13 HB1 ALA 13 16.962 1.290 6.078
85 HB2 ALA 13 HB2 ALA 13 17.962 2.492 6.896
86 HB3 ALA 13 HB3 ALA 13 18.107 0.787 7.322
87 H ARG 14 HN ARG 14 18.739 -1.224 5.182
88 HA ARG 14 HA ARG 14 20.959 -1.959 6.951
89 HB2 ARG 14 HB2 ARG 14 20.238 -4.194 6.677
90 HB3 ARG 14 HB1 ARG 14 18.745 -3.256 6.614
91 HG2 ARG 14 HG2 ARG 14 18.961 -3.224 4.102
92 HG3 ARG 14 HG1 ARG 14 20.315 -4.347 4.264
93 HD2 ARG 14 HD2 ARG 14 17.474 -4.840 5.208
94 HD3 ARG 14 HD1 ARG 14 18.266 -5.610 3.832
95 HE ARG 14 HE ARG 14 19.811 -6.032 6.220
96 HH11 ARG 14 HH21 ARG 14 16.552 -6.629 5.673
97 HH12 ARG 14 HH22 ARG 14 16.649 -8.344 5.899
98 HH21 ARG 14 HH11 ARG 14 20.113 -8.397 6.046
99 HH22 ARG 14 HH12 ARG 14 18.666 -9.345 6.112
100 H CGU 15 HN GLA 15 20.236 -2.444 3.473
101 HA CGU 15 HA GLA 15 22.634 -3.615 2.647
102 HB2 CGU 15 HB2 GLA 15 22.222 -1.966 0.581
103 HB3 CGU 15 HB3 GLA 15 20.681 -1.733 1.385
104 HG CGU 15 HG GLA 15 20.278 -4.158 1.354
105 H LEU 16 HN LEU 16 21.830 -0.272 3.209
106 HA LEU 16 HA LEU 16 24.385 0.843 2.462
107 HB2 LEU 16 HB2 LEU 16 22.185 2.095 2.676
108 HB3 LEU 16 HB1 LEU 16 22.411 2.032 4.424
109 HG LEU 16 HG LEU 16 24.632 3.145 4.130
110 HD11 LEU 16 HD11 LEU 16 24.508 4.361 1.682
111 HD12 LEU 16 HD12 LEU 16 23.864 2.764 1.302
112 HD13 LEU 16 HD13 LEU 16 25.466 2.920 2.023
113 HD21 LEU 16 HD21 LEU 16 21.996 4.286 3.733
114 HD22 LEU 16 HD22 LEU 16 23.210 5.234 2.875
115 HD23 LEU 16 HD23 LEU 16 23.371 4.955 4.610
116 H ALA 17 HN ALA 17 23.108 -0.489 5.469
117 HA ALA 17 HA ALA 17 25.564 0.356 6.909
118 HB1 ALA 17 HB1 ALA 17 24.420 -0.212 8.924
119 HB2 ALA 17 HB2 ALA 17 23.221 -1.171 8.056
120 HB3 ALA 17 HB3 ALA 17 23.219 0.586 7.910
121 H ASN 18 HN ASN 18 24.805 -2.106 4.929
122 HA ASN 18 HA ASN 18 26.723 -3.912 6.270
123 HB2 ASN 18 HB2 ASN 18 24.209 -4.505 6.737
124 HB3 ASN 18 HB1 ASN 18 24.215 -5.057 5.063
125 HD21 ASN 18 HD21 ASN 18 27.345 -5.473 6.052
126 HD22 ASN 18 HD22 ASN 18 27.260 -7.083 6.610
127 HN1 NH2 19 H1 NH2 19 26.003 -2.125 3.679
128 HN2 NH2 19 H2 NH2 19 26.582 -3.089 2.428