Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
585567 | 2mig RC | 19678 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ARG 1 HT1 ARG 1 5.845 9.618 1.340
2 H2 ARG 1 HT2 ARG 1 4.987 8.874 2.592
3 H3 ARG 1 HT3 ARG 1 4.295 10.160 1.741
4 HA ARG 1 HA ARG 1 3.363 8.046 1.068
5 HB2 ARG 1 HB2 ARG 1 3.425 9.851 -0.560
6 HB3 ARG 1 HB1 ARG 1 5.076 9.444 -0.995
7 HG2 ARG 1 HG2 ARG 1 3.461 8.682 -2.667
8 HG3 ARG 1 HG1 ARG 1 4.349 7.342 -1.946
9 HD2 ARG 1 HD2 ARG 1 1.966 6.832 -2.207
10 HD3 ARG 1 HD1 ARG 1 2.461 6.828 -0.515
11 HE ARG 1 HE ARG 1 1.543 9.326 -0.809
12 HH11 ARG 1 HH11 ARG 1 0.170 6.263 -1.803
13 HH12 ARG 1 HH12 ARG 1 -1.467 6.771 -1.550
14 HH21 ARG 1 HH21 ARG 1 -0.612 10.001 -0.482
15 HH22 ARG 1 HH22 ARG 1 -1.911 8.896 -0.804
16 H LYS 2 HN LYS 2 3.695 5.940 0.992
17 HA LYS 2 HA LYS 2 6.183 4.870 -0.083
18 HB2 LYS 2 HB2 LYS 2 6.713 5.072 2.268
19 HB3 LYS 2 HB1 LYS 2 5.187 4.328 2.722
20 HG2 LYS 2 HG2 LYS 2 5.939 2.224 1.672
21 HG3 LYS 2 HG1 LYS 2 7.493 2.984 1.328
22 HD2 LYS 2 HD2 LYS 2 6.321 2.704 4.093
23 HD3 LYS 2 HD1 LYS 2 7.475 1.574 3.390
24 HE2 LYS 2 HE2 LYS 2 7.993 4.521 3.713
25 HE3 LYS 2 HE1 LYS 2 8.449 3.309 4.905
26 HZ1 LYS 2 HZ1 LYS 2 9.848 2.248 3.276
27 HZ2 LYS 2 HZ2 LYS 2 10.278 3.879 3.402
28 HZ3 LYS 2 HZ3 LYS 2 9.370 3.344 2.082
29 H VAL 3 HN VAL 3 5.652 3.263 -1.434
30 HA VAL 3 HA VAL 3 3.042 1.969 -1.112
31 HB VAL 3 HB VAL 3 3.524 1.037 -3.424
32 HG11 VAL 3 HG11 VAL 3 3.366 4.032 -3.094
33 HG12 VAL 3 HG12 VAL 3 2.010 2.906 -3.047
34 HG13 VAL 3 HG13 VAL 3 2.917 3.131 -4.542
35 HG21 VAL 3 HG21 VAL 3 5.187 2.192 -4.781
36 HG22 VAL 3 HG22 VAL 3 5.957 1.377 -3.420
37 HG23 VAL 3 HG23 VAL 3 5.707 3.123 -3.380
38 HA PRO 4 HA PRO 4 5.662 -1.306 0.652
39 HB2 PRO 4 HB2 PRO 4 3.146 -2.303 1.755
40 HB3 PRO 4 HB1 PRO 4 4.581 -1.721 2.601
41 HG2 PRO 4 HG2 PRO 4 2.267 -0.337 2.593
42 HG3 PRO 4 HG1 PRO 4 3.850 0.464 2.619
43 HD2 PRO 4 HD2 PRO 4 2.009 -0.016 0.297
44 HD3 PRO 4 HD1 PRO 4 2.897 1.459 0.744
45 H THR 5 HN THR 5 4.343 -3.822 1.104
46 HA THR 5 HA THR 5 4.776 -4.967 -1.413
47 HB THR 5 HB THR 5 5.123 -6.208 0.689
48 HG1 THR 5 HG1 THR 5 3.435 -8.008 -0.283
49 HG21 THR 5 HG21 THR 5 2.107 -6.358 0.789
50 HG22 THR 5 HG22 THR 5 3.126 -5.437 1.895
51 HG23 THR 5 HG23 THR 5 3.225 -7.197 1.864
52 H GLY 6 HN GLY 6 1.987 -3.666 -0.009
53 HA2 GLY 6 HA2 GLY 6 0.100 -5.008 -1.733
54 HA3 GLY 6 HA1 GLY 6 -0.248 -3.665 -0.652
55 H SER 7 HN SER 7 2.407 -2.927 -2.487
56 HA SER 7 HA SER 7 2.853 -1.368 -4.041
57 HB2 SER 7 HB2 SER 7 1.569 -1.589 -6.221
58 HB3 SER 7 HB1 SER 7 2.387 -3.036 -5.645
59 HG SER 7 HG SER 7 -0.179 -2.836 -4.722
60 H ASN 8 HN ASN 8 0.613 -0.847 -2.031
61 HA ASN 8 HA ASN 8 0.227 1.856 -2.559
62 HB2 ASN 8 HB2 ASN 8 -1.278 0.938 -4.371
63 HB3 ASN 8 HB1 ASN 8 -2.271 0.233 -3.103
64 HD21 ASN 8 HD21 ASN 8 -2.988 2.183 -5.101
65 HD22 ASN 8 HD22 ASN 8 -3.540 3.581 -4.247
66 HA PRO 9 HA PRO 9 -0.734 0.988 1.755
67 HB2 PRO 9 HB2 PRO 9 -0.376 3.489 2.655
68 HB3 PRO 9 HB1 PRO 9 0.994 2.471 2.186
69 HG2 PRO 9 HG2 PRO 9 -0.418 4.581 0.574
70 HG3 PRO 9 HG1 PRO 9 1.325 4.378 0.852
71 HD2 PRO 9 HD2 PRO 9 0.162 3.470 -1.390
72 HD3 PRO 9 HD1 PRO 9 1.478 2.596 -0.608
73 H GLN 10 HN GLN 10 -3.028 0.978 0.222
74 HA GLN 10 HA GLN 10 -4.757 3.060 1.205
75 HB2 GLN 10 HB2 GLN 10 -6.587 1.890 0.207
76 HB3 GLN 10 HB1 GLN 10 -5.239 1.777 -0.911
77 HG2 GLN 10 HG2 GLN 10 -5.827 -0.415 1.034
78 HG3 GLN 10 HG1 GLN 10 -6.678 -0.300 -0.501
79 HE21 GLN 10 HE21 GLN 10 -4.799 -2.324 0.544
80 HE22 GLN 10 HE22 GLN 10 -3.543 -2.430 -0.641
81 H LYS 11 HN LYS 11 -3.515 0.085 2.293
82 HA LYS 11 HA LYS 11 -4.248 0.469 4.958
83 HB2 LYS 11 HB2 LYS 11 -5.850 -1.322 5.344
84 HB3 LYS 11 HB1 LYS 11 -6.515 -0.170 4.200
85 HG2 LYS 11 HG2 LYS 11 -5.912 -1.703 2.358
86 HG3 LYS 11 HG1 LYS 11 -5.347 -2.869 3.554
87 HD2 LYS 11 HD2 LYS 11 -7.609 -2.889 4.547
88 HD3 LYS 11 HD1 LYS 11 -8.153 -1.800 3.270
89 HE2 LYS 11 HE2 LYS 11 -8.760 -4.069 2.713
90 HE3 LYS 11 HE1 LYS 11 -7.521 -3.496 1.597
91 HZ1 LYS 11 HZ1 LYS 11 -5.866 -4.715 2.827
92 HZ2 LYS 11 HZ2 LYS 11 -7.110 -5.764 2.374
93 HZ3 LYS 11 HZ3 LYS 11 -7.010 -5.210 3.969
94 H ASN 12 HN ASN 12 -1.977 -0.086 3.462
95 HA ASN 12 HA ASN 12 -1.113 -2.632 4.577
96 HB2 ASN 12 HB2 ASN 12 -1.885 -3.157 2.281
97 HB3 ASN 12 HB1 ASN 12 -0.785 -1.940 1.644
98 HD21 ASN 12 HD21 ASN 12 -1.027 -5.044 3.207
99 HD22 ASN 12 HD22 ASN 12 0.570 -5.582 2.821
Start of MODEL 2
1 H1 ARG 1 HT1 ARG 1 8.698 3.965 -4.573
2 H2 ARG 1 HT2 ARG 1 9.369 5.386 -3.949
3 H3 ARG 1 HT3 ARG 1 8.718 5.375 -5.508
4 HA ARG 1 HA ARG 1 7.234 6.462 -3.958
5 HB2 ARG 1 HB2 ARG 1 6.253 3.776 -4.944
6 HB3 ARG 1 HB1 ARG 1 5.213 5.083 -4.401
7 HG2 ARG 1 HG2 ARG 1 6.027 6.495 -6.216
8 HG3 ARG 1 HG1 ARG 1 7.086 5.189 -6.756
9 HD2 ARG 1 HD2 ARG 1 5.170 3.782 -7.204
10 HD3 ARG 1 HD1 ARG 1 4.084 5.018 -6.575
11 HE ARG 1 HE ARG 1 5.664 6.046 -8.698
12 HH11 ARG 1 HH11 ARG 1 2.922 3.970 -8.050
13 HH12 ARG 1 HH12 ARG 1 2.163 4.279 -9.578
14 HH21 ARG 1 HH21 ARG 1 4.671 6.456 -10.711
15 HH22 ARG 1 HH22 ARG 1 3.163 5.691 -11.099
16 H LYS 2 HN LYS 2 5.921 6.348 -2.090
17 HA LYS 2 HA LYS 2 7.144 4.791 0.003
18 HB2 LYS 2 HB2 LYS 2 4.860 6.767 0.091
19 HB3 LYS 2 HB1 LYS 2 5.630 6.053 1.499
20 HG2 LYS 2 HG2 LYS 2 7.783 7.073 0.736
21 HG3 LYS 2 HG1 LYS 2 6.863 7.921 -0.506
22 HD2 LYS 2 HD2 LYS 2 6.975 9.494 1.194
23 HD3 LYS 2 HD1 LYS 2 5.409 8.740 1.477
24 HE2 LYS 2 HE2 LYS 2 7.949 7.928 2.878
25 HE3 LYS 2 HE1 LYS 2 6.817 9.115 3.513
26 HZ1 LYS 2 HZ1 LYS 2 6.354 7.021 4.509
27 HZ2 LYS 2 HZ2 LYS 2 6.304 6.236 3.016
28 HZ3 LYS 2 HZ3 LYS 2 5.096 7.345 3.425
29 H VAL 3 HN VAL 3 6.446 2.766 -1.055
30 HA VAL 3 HA VAL 3 3.812 1.966 -0.029
31 HB VAL 3 HB VAL 3 3.585 0.406 -1.967
32 HG11 VAL 3 HG11 VAL 3 2.431 2.574 -1.927
33 HG12 VAL 3 HG12 VAL 3 2.853 2.079 -3.565
34 HG13 VAL 3 HG13 VAL 3 3.809 3.312 -2.741
35 HG21 VAL 3 HG21 VAL 3 5.908 1.967 -3.097
36 HG22 VAL 3 HG22 VAL 3 4.924 0.803 -3.981
37 HG23 VAL 3 HG23 VAL 3 5.928 0.266 -2.635
38 HA PRO 4 HA PRO 4 6.475 -0.941 2.074
39 HB2 PRO 4 HB2 PRO 4 4.468 -2.246 3.385
40 HB3 PRO 4 HB1 PRO 4 5.139 -0.704 3.917
41 HG2 PRO 4 HG2 PRO 4 2.630 -1.260 2.401
42 HG3 PRO 4 HG1 PRO 4 2.920 -0.087 3.698
43 HD2 PRO 4 HD2 PRO 4 2.823 0.605 1.077
44 HD3 PRO 4 HD1 PRO 4 3.827 1.463 2.262
45 H THR 5 HN THR 5 3.406 -2.046 0.661
46 HA THR 5 HA THR 5 4.616 -3.938 -1.045
47 HB THR 5 HB THR 5 4.951 -5.164 1.085
48 HG1 THR 5 HG1 THR 5 3.449 -7.035 0.317
49 HG21 THR 5 HG21 THR 5 3.039 -4.297 2.333
50 HG22 THR 5 HG22 THR 5 3.013 -6.061 2.293
51 HG23 THR 5 HG23 THR 5 1.935 -5.140 1.244
52 H GLY 6 HN GLY 6 3.005 -5.084 -2.323
53 HA2 GLY 6 HA2 GLY 6 0.930 -5.361 -3.297
54 HA3 GLY 6 HA1 GLY 6 0.215 -4.534 -1.921
55 H SER 7 HN SER 7 -1.043 -3.788 -3.948
56 HA SER 7 HA SER 7 0.199 -1.676 -5.459
57 HB2 SER 7 HB2 SER 7 -2.737 -2.392 -5.274
58 HB3 SER 7 HB1 SER 7 -1.950 -1.459 -6.547
59 HG SER 7 HG SER 7 -0.965 -3.276 -7.288
60 H ASN 8 HN ASN 8 0.868 -0.530 -3.483
61 HA ASN 8 HA ASN 8 0.773 1.327 -2.179
62 HB2 ASN 8 HB2 ASN 8 -1.992 1.697 -3.356
63 HB3 ASN 8 HB1 ASN 8 -1.201 2.854 -2.292
64 HD21 ASN 8 HD21 ASN 8 -1.363 1.525 -5.461
65 HD22 ASN 8 HD22 ASN 8 -0.291 2.651 -6.217
66 HA PRO 9 HA PRO 9 -1.579 -0.095 1.359
67 HB2 PRO 9 HB2 PRO 9 -0.499 1.472 3.208
68 HB3 PRO 9 HB1 PRO 9 0.525 0.326 2.334
69 HG2 PRO 9 HG2 PRO 9 0.316 3.275 2.043
70 HG3 PRO 9 HG1 PRO 9 1.708 2.215 1.774
71 HD2 PRO 9 HD2 PRO 9 -0.124 3.235 -0.176
72 HD3 PRO 9 HD1 PRO 9 1.226 2.130 -0.437
73 H GLN 10 HN GLN 10 -2.907 1.689 -0.408
74 HA GLN 10 HA GLN 10 -3.950 3.860 1.150
75 HB2 GLN 10 HB2 GLN 10 -3.617 4.131 -1.254
76 HB3 GLN 10 HB1 GLN 10 -4.710 2.798 -1.579
77 HG2 GLN 10 HG2 GLN 10 -5.763 4.945 -1.999
78 HG3 GLN 10 HG1 GLN 10 -6.570 4.072 -0.698
79 HE21 GLN 10 HE21 GLN 10 -6.382 4.805 1.408
80 HE22 GLN 10 HE22 GLN 10 -5.871 6.421 1.764
81 H LYS 11 HN LYS 11 -4.523 0.580 0.858
82 HA LYS 11 HA LYS 11 -6.177 -0.863 1.432
83 HB2 LYS 11 HB2 LYS 11 -7.044 1.495 3.101
84 HB3 LYS 11 HB1 LYS 11 -7.875 -0.050 3.144
85 HG2 LYS 11 HG2 LYS 11 -6.440 -0.119 4.970
86 HG3 LYS 11 HG1 LYS 11 -5.604 -1.057 3.734
87 HD2 LYS 11 HD2 LYS 11 -3.990 0.352 4.768
88 HD3 LYS 11 HD1 LYS 11 -4.317 1.018 3.166
89 HE2 LYS 11 HE2 LYS 11 -5.776 2.692 4.124
90 HE3 LYS 11 HE1 LYS 11 -5.566 1.995 5.730
91 HZ1 LYS 11 HZ1 LYS 11 -3.274 2.605 5.712
92 HZ2 LYS 11 HZ2 LYS 11 -4.176 3.975 5.303
93 HZ3 LYS 11 HZ3 LYS 11 -3.355 3.115 4.100
94 H ASN 12 HN ASN 12 -6.538 1.081 -0.849
95 HA ASN 12 HA ASN 12 -9.324 0.488 -1.379
96 HB2 ASN 12 HB2 ASN 12 -9.356 2.680 -0.181
97 HB3 ASN 12 HB1 ASN 12 -8.320 3.348 -1.436
98 HD21 ASN 12 HD21 ASN 12 -11.501 2.199 -0.654
99 HD22 ASN 12 HD22 ASN 12 -12.292 2.836 -2.055
Start of MODEL 3
1 H1 ARG 1 HT1 ARG 1 9.540 4.017 4.726
2 H2 ARG 1 HT2 ARG 1 7.976 4.528 5.103
3 H3 ARG 1 HT3 ARG 1 8.848 5.312 3.886
4 HA ARG 1 HA ARG 1 8.831 3.323 2.542
5 HB2 ARG 1 HB2 ARG 1 7.065 2.226 4.741
6 HB3 ARG 1 HB1 ARG 1 7.410 1.431 3.212
7 HG2 ARG 1 HG2 ARG 1 9.752 1.235 3.821
8 HG3 ARG 1 HG1 ARG 1 9.442 2.084 5.336
9 HD2 ARG 1 HD2 ARG 1 7.901 0.301 6.009
10 HD3 ARG 1 HD1 ARG 1 8.231 -0.548 4.500
11 HE ARG 1 HE ARG 1 10.654 -0.067 5.840
12 HH11 ARG 1 HH11 ARG 1 7.758 -2.004 6.138
13 HH12 ARG 1 HH12 ARG 1 8.548 -3.281 7.004
14 HH21 ARG 1 HH21 ARG 1 11.696 -1.749 6.985
15 HH22 ARG 1 HH22 ARG 1 10.789 -3.140 7.476
16 H LYS 2 HN LYS 2 7.767 4.508 1.042
17 HA LYS 2 HA LYS 2 5.109 5.514 1.617
18 HB2 LYS 2 HB2 LYS 2 5.271 6.588 -0.603
19 HB3 LYS 2 HB1 LYS 2 6.612 6.999 0.454
20 HG2 LYS 2 HG2 LYS 2 8.021 5.370 -0.713
21 HG3 LYS 2 HG1 LYS 2 6.673 4.987 -1.784
22 HD2 LYS 2 HD2 LYS 2 8.147 6.536 -2.895
23 HD3 LYS 2 HD1 LYS 2 6.638 7.355 -2.514
24 HE2 LYS 2 HE2 LYS 2 8.468 8.808 -2.030
25 HE3 LYS 2 HE1 LYS 2 7.701 8.330 -0.523
26 HZ1 LYS 2 HZ1 LYS 2 10.108 8.261 -0.357
27 HZ2 LYS 2 HZ2 LYS 2 10.190 7.159 -1.637
28 HZ3 LYS 2 HZ3 LYS 2 9.456 6.712 -0.182
29 H VAL 3 HN VAL 3 6.541 2.830 0.078
30 HA VAL 3 HA VAL 3 3.873 1.886 -0.664
31 HB VAL 3 HB VAL 3 4.949 0.675 -2.633
32 HG11 VAL 3 HG11 VAL 3 3.441 2.554 -2.933
33 HG12 VAL 3 HG12 VAL 3 4.750 2.624 -4.111
34 HG13 VAL 3 HG13 VAL 3 4.774 3.682 -2.703
35 HG21 VAL 3 HG21 VAL 3 7.289 1.016 -2.002
36 HG22 VAL 3 HG22 VAL 3 7.092 2.757 -2.201
37 HG23 VAL 3 HG23 VAL 3 6.952 1.689 -3.597
38 HA PRO 4 HA PRO 4 6.302 -1.097 2.145
39 HB2 PRO 4 HB2 PRO 4 3.952 -1.687 3.535
40 HB3 PRO 4 HB1 PRO 4 5.224 -0.592 4.078
41 HG2 PRO 4 HG2 PRO 4 2.639 0.024 2.721
42 HG3 PRO 4 HG1 PRO 4 3.470 0.912 4.011
43 HD2 PRO 4 HD2 PRO 4 3.529 1.785 1.490
44 HD3 PRO 4 HD1 PRO 4 4.962 1.910 2.529
45 H THR 5 HN THR 5 2.844 -1.587 1.380
46 HA THR 5 HA THR 5 3.367 -4.313 0.583
47 HB THR 5 HB THR 5 0.795 -4.095 0.014
48 HG1 THR 5 HG1 THR 5 -0.156 -2.480 1.394
49 HG21 THR 5 HG21 THR 5 0.273 -4.633 2.346
50 HG22 THR 5 HG22 THR 5 1.862 -4.048 2.838
51 HG23 THR 5 HG23 THR 5 1.727 -5.472 1.807
52 H GLY 6 HN GLY 6 1.690 -4.805 -1.512
53 HA2 GLY 6 HA2 GLY 6 3.165 -3.583 -3.684
54 HA3 GLY 6 HA1 GLY 6 2.021 -4.910 -3.813
55 H SER 7 HN SER 7 -0.301 -4.303 -3.487
56 HA SER 7 HA SER 7 -0.838 -2.119 -5.300
57 HB2 SER 7 HB2 SER 7 -2.745 -4.079 -4.002
58 HB3 SER 7 HB1 SER 7 -3.097 -3.033 -5.377
59 HG SER 7 HG SER 7 -1.516 -4.165 -6.561
60 H ASN 8 HN ASN 8 -1.155 -0.128 -4.605
61 HA ASN 8 HA ASN 8 -1.712 1.672 -3.325
62 HB2 ASN 8 HB2 ASN 8 -4.024 -0.167 -2.685
63 HB3 ASN 8 HB1 ASN 8 -3.975 1.536 -2.242
64 HD21 ASN 8 HD21 ASN 8 -5.760 0.015 -4.039
65 HD22 ASN 8 HD22 ASN 8 -5.691 0.838 -5.557
66 HA PRO 9 HA PRO 9 -0.141 -0.279 0.572
67 HB2 PRO 9 HB2 PRO 9 2.348 1.138 0.189
68 HB3 PRO 9 HB1 PRO 9 2.067 -0.602 0.193
69 HG2 PRO 9 HG2 PRO 9 2.803 0.746 -2.040
70 HG3 PRO 9 HG1 PRO 9 1.764 -0.693 -2.089
71 HD2 PRO 9 HD2 PRO 9 0.982 2.204 -2.124
72 HD3 PRO 9 HD1 PRO 9 0.441 0.892 -3.211
73 H GLN 10 HN GLN 10 -1.872 1.472 1.010
74 HA GLN 10 HA GLN 10 -1.016 3.989 1.963
75 HB2 GLN 10 HB2 GLN 10 -3.220 3.857 3.287
76 HB3 GLN 10 HB1 GLN 10 -3.306 3.848 1.535
77 HG2 GLN 10 HG2 GLN 10 -4.827 2.221 2.152
78 HG3 GLN 10 HG1 GLN 10 -3.387 1.290 1.755
79 HE21 GLN 10 HE21 GLN 10 -3.976 -0.454 3.014
80 HE22 GLN 10 HE22 GLN 10 -3.982 -0.398 4.745
81 H LYS 11 HN LYS 11 -0.870 0.826 3.210
82 HA LYS 11 HA LYS 11 1.152 1.301 4.990
83 HB2 LYS 11 HB2 LYS 11 0.225 1.215 7.194
84 HB3 LYS 11 HB1 LYS 11 -0.572 2.531 6.352
85 HG2 LYS 11 HG2 LYS 11 -2.526 1.087 5.982
86 HG3 LYS 11 HG1 LYS 11 -1.718 -0.207 6.871
87 HD2 LYS 11 HD2 LYS 11 -1.606 1.259 8.850
88 HD3 LYS 11 HD1 LYS 11 -2.468 2.509 7.954
89 HE2 LYS 11 HE2 LYS 11 -4.003 1.313 9.393
90 HE3 LYS 11 HE1 LYS 11 -4.381 0.982 7.702
91 HZ1 LYS 11 HZ1 LYS 11 -3.317 -1.137 7.870
92 HZ2 LYS 11 HZ2 LYS 11 -4.427 -1.006 9.138
93 HZ3 LYS 11 HZ3 LYS 11 -2.776 -0.813 9.438
94 H ASN 12 HN ASN 12 -1.711 -0.511 4.224
95 HA ASN 12 HA ASN 12 -0.143 -2.917 3.959
96 HB2 ASN 12 HB2 ASN 12 -0.877 -2.995 6.333
97 HB3 ASN 12 HB1 ASN 12 -2.547 -2.863 5.804
98 HD21 ASN 12 HD21 ASN 12 -0.076 -4.755 4.180
99 HD22 ASN 12 HD22 ASN 12 -0.778 -6.295 4.518
Start of MODEL 4
1 H1 ARG 1 HT1 ARG 1 5.475 8.637 -2.298
2 H2 ARG 1 HT2 ARG 1 5.987 9.358 -0.863
3 H3 ARG 1 HT3 ARG 1 4.616 9.944 -1.656
4 HA ARG 1 HA ARG 1 3.999 8.650 0.265
5 HB2 ARG 1 HB2 ARG 1 2.266 7.507 -0.757
6 HB3 ARG 1 HB1 ARG 1 2.751 8.590 -2.048
7 HG2 ARG 1 HG2 ARG 1 3.583 5.705 -1.801
8 HG3 ARG 1 HG1 ARG 1 2.283 6.307 -2.825
9 HD2 ARG 1 HD2 ARG 1 5.195 7.055 -3.050
10 HD3 ARG 1 HD1 ARG 1 4.346 5.916 -4.086
11 HE ARG 1 HE ARG 1 3.212 8.581 -3.994
12 HH11 ARG 1 HH11 ARG 1 5.365 6.366 -5.637
13 HH12 ARG 1 HH12 ARG 1 5.380 7.272 -7.114
14 HH21 ARG 1 HH21 ARG 1 3.211 9.767 -5.937
15 HH22 ARG 1 HH22 ARG 1 4.148 9.215 -7.289
16 H LYS 2 HN LYS 2 3.855 6.477 1.214
17 HA LYS 2 HA LYS 2 6.369 5.026 0.797
18 HB2 LYS 2 HB2 LYS 2 5.925 5.854 3.075
19 HB3 LYS 2 HB1 LYS 2 4.429 4.932 3.118
20 HG2 LYS 2 HG2 LYS 2 5.700 2.858 2.936
21 HG3 LYS 2 HG1 LYS 2 7.198 3.777 2.879
22 HD2 LYS 2 HD2 LYS 2 6.808 4.619 5.109
23 HD3 LYS 2 HD1 LYS 2 5.241 3.817 5.171
24 HE2 LYS 2 HE2 LYS 2 6.847 2.531 6.396
25 HE3 LYS 2 HE1 LYS 2 6.367 1.645 4.953
26 HZ1 LYS 2 HZ1 LYS 2 8.405 2.367 3.874
27 HZ2 LYS 2 HZ2 LYS 2 8.753 1.540 5.305
28 HZ3 LYS 2 HZ3 LYS 2 8.864 3.221 5.259
29 H VAL 3 HN VAL 3 6.365 3.055 -0.085
30 HA VAL 3 HA VAL 3 3.791 1.659 -0.312
31 HB VAL 3 HB VAL 3 4.187 2.668 -2.443
32 HG11 VAL 3 HG11 VAL 3 6.560 3.099 -2.291
33 HG12 VAL 3 HG12 VAL 3 6.197 2.230 -3.780
34 HG13 VAL 3 HG13 VAL 3 6.908 1.376 -2.412
35 HG21 VAL 3 HG21 VAL 3 4.284 0.706 -3.908
36 HG22 VAL 3 HG22 VAL 3 3.254 0.431 -2.504
37 HG23 VAL 3 HG23 VAL 3 4.874 -0.264 -2.559
38 HA PRO 4 HA PRO 4 6.776 -1.406 1.426
39 HB2 PRO 4 HB2 PRO 4 5.037 -2.412 3.258
40 HB3 PRO 4 HB1 PRO 4 6.090 -1.032 3.586
41 HG2 PRO 4 HG2 PRO 4 3.187 -1.076 2.879
42 HG3 PRO 4 HG1 PRO 4 4.047 -0.041 4.031
43 HD2 PRO 4 HD2 PRO 4 3.308 0.762 1.532
44 HD3 PRO 4 HD1 PRO 4 4.693 1.430 2.404
45 H THR 5 HN THR 5 3.267 -1.821 1.025
46 HA THR 5 HA THR 5 3.713 -4.474 -0.127
47 HB THR 5 HB THR 5 1.020 -3.292 0.504
48 HG1 THR 5 HG1 THR 5 2.965 -4.311 2.301
49 HG21 THR 5 HG21 THR 5 0.439 -5.638 0.900
50 HG22 THR 5 HG22 THR 5 2.105 -6.108 0.566
51 HG23 THR 5 HG23 THR 5 1.112 -5.414 -0.716
52 H GLY 6 HN GLY 6 3.273 -4.888 -2.248
53 HA2 GLY 6 HA2 GLY 6 2.703 -2.686 -4.014
54 HA3 GLY 6 HA1 GLY 6 2.939 -4.367 -4.478
55 H SER 7 HN SER 7 0.590 -2.464 -2.598
56 HA SER 7 HA SER 7 -1.568 -3.436 -4.291
57 HB2 SER 7 HB2 SER 7 -1.600 -3.860 -1.289
58 HB3 SER 7 HB1 SER 7 -2.898 -4.264 -2.411
59 HG SER 7 HG SER 7 -0.591 -5.382 -3.223
60 H ASN 8 HN ASN 8 -0.321 -0.901 -3.880
61 HA ASN 8 HA ASN 8 -0.692 1.287 -3.402
62 HB2 ASN 8 HB2 ASN 8 -2.628 0.803 -4.922
63 HB3 ASN 8 HB1 ASN 8 -3.618 0.522 -3.494
64 HD21 ASN 8 HD21 ASN 8 -3.934 2.507 -5.589
65 HD22 ASN 8 HD22 ASN 8 -3.890 4.052 -4.810
66 HA PRO 9 HA PRO 9 -1.625 0.669 1.047
67 HB2 PRO 9 HB2 PRO 9 0.822 0.798 2.060
68 HB3 PRO 9 HB1 PRO 9 0.304 -0.652 1.188
69 HG2 PRO 9 HG2 PRO 9 2.038 1.593 0.269
70 HG3 PRO 9 HG1 PRO 9 2.198 -0.145 -0.046
71 HD2 PRO 9 HD2 PRO 9 1.049 1.755 -1.758
72 HD3 PRO 9 HD1 PRO 9 0.885 -0.007 -1.895
73 H GLN 10 HN GLN 10 -1.751 3.075 -0.620
74 HA GLN 10 HA GLN 10 -0.514 5.139 1.024
75 HB2 GLN 10 HB2 GLN 10 -0.535 5.258 -1.489
76 HB3 GLN 10 HB1 GLN 10 -2.280 5.450 -1.414
77 HG2 GLN 10 HG2 GLN 10 -1.346 7.402 0.294
78 HG3 GLN 10 HG1 GLN 10 -0.172 7.401 -1.022
79 HE21 GLN 10 HE21 GLN 10 -3.497 7.886 -0.142
80 HE22 GLN 10 HE22 GLN 10 -3.977 8.685 -1.605
81 H LYS 11 HN LYS 11 -2.834 3.281 1.747
82 HA LYS 11 HA LYS 11 -4.587 3.384 3.178
83 HB2 LYS 11 HB2 LYS 11 -3.504 5.194 4.353
84 HB3 LYS 11 HB1 LYS 11 -4.036 6.356 3.153
85 HG2 LYS 11 HG2 LYS 11 -6.082 4.807 4.663
86 HG3 LYS 11 HG1 LYS 11 -5.248 6.138 5.462
87 HD2 LYS 11 HD2 LYS 11 -6.707 6.367 2.831
88 HD3 LYS 11 HD1 LYS 11 -7.401 6.794 4.395
89 HE2 LYS 11 HE2 LYS 11 -5.519 8.415 4.691
90 HE3 LYS 11 HE1 LYS 11 -5.024 8.061 3.037
91 HZ1 LYS 11 HZ1 LYS 11 -7.177 8.850 2.267
92 HZ2 LYS 11 HZ2 LYS 11 -6.380 10.052 3.145
93 HZ3 LYS 11 HZ3 LYS 11 -7.648 9.189 3.853
94 H ASN 12 HN ASN 12 -4.779 6.024 0.794
95 HA ASN 12 HA ASN 12 -7.609 5.380 0.377
96 HB2 ASN 12 HB2 ASN 12 -6.972 7.755 0.758
97 HB3 ASN 12 HB1 ASN 12 -5.983 7.699 -0.696
98 HD21 ASN 12 HD21 ASN 12 -7.110 9.260 -1.763
99 HD22 ASN 12 HD22 ASN 12 -8.726 9.043 -2.339
Start of MODEL 5
1 H1 ARG 1 HT1 ARG 1 8.390 5.810 3.668
2 H2 ARG 1 HT2 ARG 1 7.838 4.954 5.018
3 H3 ARG 1 HT3 ARG 1 6.734 5.577 3.902
4 HA ARG 1 HA ARG 1 8.746 3.505 3.314
5 HB2 ARG 1 HB2 ARG 1 7.086 2.565 4.791
6 HB3 ARG 1 HB1 ARG 1 5.783 3.270 3.843
7 HG2 ARG 1 HG2 ARG 1 6.001 0.886 3.403
8 HG3 ARG 1 HG1 ARG 1 6.354 1.833 1.957
9 HD2 ARG 1 HD2 ARG 1 8.801 1.646 2.631
10 HD3 ARG 1 HD1 ARG 1 8.281 0.416 3.779
11 HE ARG 1 HE ARG 1 7.294 -0.197 1.205
12 HH11 ARG 1 HH11 ARG 1 10.264 -0.146 3.050
13 HH12 ARG 1 HH12 ARG 1 11.033 -1.380 2.102
14 HH21 ARG 1 HH21 ARG 1 8.307 -1.816 -0.063
15 HH22 ARG 1 HH22 ARG 1 9.924 -2.316 0.326
16 H LYS 2 HN LYS 2 5.601 4.760 2.224
17 HA LYS 2 HA LYS 2 4.692 5.033 0.177
18 HB2 LYS 2 HB2 LYS 2 6.587 6.524 -0.291
19 HB3 LYS 2 HB1 LYS 2 7.559 5.148 -0.787
20 HG2 LYS 2 HG2 LYS 2 6.717 6.371 -2.710
21 HG3 LYS 2 HG1 LYS 2 6.048 4.740 -2.657
22 HD2 LYS 2 HD2 LYS 2 4.002 5.658 -1.624
23 HD3 LYS 2 HD1 LYS 2 4.666 7.283 -1.801
24 HE2 LYS 2 HE2 LYS 2 4.773 6.918 -4.239
25 HE3 LYS 2 HE1 LYS 2 4.043 5.332 -3.998
26 HZ1 LYS 2 HZ1 LYS 2 2.771 7.914 -3.279
27 HZ2 LYS 2 HZ2 LYS 2 2.074 6.381 -3.118
28 HZ3 LYS 2 HZ3 LYS 2 2.408 6.999 -4.654
29 H VAL 3 HN VAL 3 3.687 3.114 0.083
30 HA VAL 3 HA VAL 3 3.063 1.119 -0.793
31 HB VAL 3 HB VAL 3 5.564 1.286 -2.485
32 HG11 VAL 3 HG11 VAL 3 4.728 -0.993 -2.308
33 HG12 VAL 3 HG12 VAL 3 4.438 -0.350 -3.925
34 HG13 VAL 3 HG13 VAL 3 3.113 -0.452 -2.768
35 HG21 VAL 3 HG21 VAL 3 2.718 2.056 -3.133
36 HG22 VAL 3 HG22 VAL 3 4.071 2.069 -4.263
37 HG23 VAL 3 HG23 VAL 3 4.063 3.169 -2.886
38 HA PRO 4 HA PRO 4 5.533 -1.130 2.297
39 HB2 PRO 4 HB2 PRO 4 3.072 -2.766 2.325
40 HB3 PRO 4 HB1 PRO 4 3.910 -1.975 3.664
41 HG2 PRO 4 HG2 PRO 4 1.574 -1.042 2.741
42 HG3 PRO 4 HG1 PRO 4 2.854 0.049 3.305
43 HD2 PRO 4 HD2 PRO 4 2.075 -0.669 0.504
44 HD3 PRO 4 HD1 PRO 4 2.530 0.908 1.180
45 H THR 5 HN THR 5 3.285 -2.828 0.101
46 HA THR 5 HA THR 5 5.353 -4.084 -1.340
47 HB THR 5 HB THR 5 5.705 -5.461 0.588
48 HG1 THR 5 HG1 THR 5 5.797 -6.598 -1.357
49 HG21 THR 5 HG21 THR 5 2.754 -6.101 0.509
50 HG22 THR 5 HG22 THR 5 3.579 -5.145 1.739
51 HG23 THR 5 HG23 THR 5 3.940 -6.862 1.568
52 H GLY 6 HN GLY 6 4.397 -3.790 -3.235
53 HA2 GLY 6 HA2 GLY 6 3.066 -4.392 -5.016
54 HA3 GLY 6 HA1 GLY 6 2.196 -5.482 -3.951
55 H SER 7 HN SER 7 0.988 -4.000 -2.151
56 HA SER 7 HA SER 7 -0.938 -2.528 -3.761
57 HB2 SER 7 HB2 SER 7 -1.684 -4.314 -2.191
58 HB3 SER 7 HB1 SER 7 -1.075 -3.349 -0.847
59 HG SER 7 HG SER 7 -2.719 -2.007 -1.039
60 H ASN 8 HN ASN 8 -1.541 -0.417 -3.384
61 HA ASN 8 HA ASN 8 0.396 1.199 -1.918
62 HB2 ASN 8 HB2 ASN 8 -1.765 1.936 -3.895
63 HB3 ASN 8 HB1 ASN 8 -0.806 3.126 -3.027
64 HD21 ASN 8 HD21 ASN 8 0.098 3.964 -4.874
65 HD22 ASN 8 HD22 ASN 8 1.260 3.107 -5.824
66 HA PRO 9 HA PRO 9 -2.602 1.547 1.346
67 HB2 PRO 9 HB2 PRO 9 -1.042 2.749 3.126
68 HB3 PRO 9 HB1 PRO 9 -0.671 1.103 2.590
69 HG2 PRO 9 HG2 PRO 9 0.560 3.697 1.741
70 HG3 PRO 9 HG1 PRO 9 1.346 2.152 2.107
71 HD2 PRO 9 HD2 PRO 9 0.727 3.046 -0.442
72 HD3 PRO 9 HD1 PRO 9 0.999 1.351 -0.001
73 H GLN 10 HN GLN 10 -3.502 3.154 -0.426
74 HA GLN 10 HA GLN 10 -3.390 5.910 0.019
75 HB2 GLN 10 HB2 GLN 10 -4.460 4.940 -1.938
76 HB3 GLN 10 HB1 GLN 10 -5.656 4.147 -0.932
77 HG2 GLN 10 HG2 GLN 10 -5.496 7.082 -0.712
78 HG3 GLN 10 HG1 GLN 10 -6.091 6.437 -2.238
79 HE21 GLN 10 HE21 GLN 10 -7.277 4.081 -0.996
80 HE22 GLN 10 HE22 GLN 10 -8.696 4.631 -0.177
81 H LYS 11 HN LYS 11 -5.129 3.317 1.578
82 HA LYS 11 HA LYS 11 -5.196 4.018 4.116
83 HB2 LYS 11 HB2 LYS 11 -7.085 5.346 4.720
84 HB3 LYS 11 HB1 LYS 11 -6.196 6.246 3.505
85 HG2 LYS 11 HG2 LYS 11 -7.831 5.485 1.809
86 HG3 LYS 11 HG1 LYS 11 -8.749 4.702 3.100
87 HD2 LYS 11 HD2 LYS 11 -8.970 6.886 4.225
88 HD3 LYS 11 HD1 LYS 11 -8.123 7.648 2.879
89 HE2 LYS 11 HE2 LYS 11 -10.476 7.967 2.575
90 HE3 LYS 11 HE1 LYS 11 -9.911 6.818 1.365
91 HZ1 LYS 11 HZ1 LYS 11 -11.288 6.112 3.901
92 HZ2 LYS 11 HZ2 LYS 11 -10.771 5.015 2.723
93 HZ3 LYS 11 HZ3 LYS 11 -12.000 6.122 2.367
94 H ASN 12 HN ASN 12 -7.121 2.968 1.454
95 HA ASN 12 HA ASN 12 -8.188 0.780 3.094
96 HB2 ASN 12 HB2 ASN 12 -9.690 2.581 1.206
97 HB3 ASN 12 HB1 ASN 12 -10.255 0.949 1.531
98 HD21 ASN 12 HD21 ASN 12 -9.494 0.842 4.258
99 HD22 ASN 12 HD22 ASN 12 -10.529 1.913 5.134
Start of MODEL 6
1 H1 ARG 1 HT1 ARG 1 5.987 8.893 -0.542
2 H2 ARG 1 HT2 ARG 1 4.836 8.246 0.511
3 H3 ARG 1 HT3 ARG 1 5.442 7.306 -0.758
4 HA ARG 1 HA ARG 1 7.631 7.326 0.213
5 HB2 ARG 1 HB2 ARG 1 6.242 8.942 2.347
6 HB3 ARG 1 HB1 ARG 1 7.774 8.127 2.617
7 HG2 ARG 1 HG2 ARG 1 8.804 9.445 0.853
8 HG3 ARG 1 HG1 ARG 1 7.265 10.251 0.545
9 HD2 ARG 1 HD2 ARG 1 7.272 11.190 2.770
10 HD3 ARG 1 HD1 ARG 1 8.742 10.306 3.171
11 HE ARG 1 HE ARG 1 9.401 11.807 0.979
12 HH11 ARG 1 HH11 ARG 1 8.134 12.492 4.167
13 HH12 ARG 1 HH12 ARG 1 8.877 14.055 4.270
14 HH21 ARG 1 HH21 ARG 1 10.407 13.859 1.115
15 HH22 ARG 1 HH22 ARG 1 10.184 14.830 2.535
16 H LYS 2 HN LYS 2 4.413 6.642 1.256
17 HA LYS 2 HA LYS 2 5.403 4.280 2.705
18 HB2 LYS 2 HB2 LYS 2 2.717 5.650 2.920
19 HB3 LYS 2 HB1 LYS 2 3.188 4.200 3.790
20 HG2 LYS 2 HG2 LYS 2 5.000 5.500 4.871
21 HG3 LYS 2 HG1 LYS 2 4.376 6.947 4.081
22 HD2 LYS 2 HD2 LYS 2 3.363 7.068 6.156
23 HD3 LYS 2 HD1 LYS 2 2.126 6.256 5.202
24 HE2 LYS 2 HE2 LYS 2 4.152 4.830 6.913
25 HE3 LYS 2 HE1 LYS 2 2.545 5.284 7.462
26 HZ1 LYS 2 HZ1 LYS 2 1.650 3.915 5.611
27 HZ2 LYS 2 HZ2 LYS 2 2.490 3.029 6.772
28 HZ3 LYS 2 HZ3 LYS 2 3.221 3.376 5.293
29 H VAL 3 HN VAL 3 5.675 3.613 0.310
30 HA VAL 3 HA VAL 3 3.214 2.173 -0.429
31 HB VAL 3 HB VAL 3 5.284 3.202 -2.384
32 HG11 VAL 3 HG11 VAL 3 4.206 1.146 -3.125
33 HG12 VAL 3 HG12 VAL 3 3.672 2.515 -4.100
34 HG13 VAL 3 HG13 VAL 3 2.622 1.862 -2.846
35 HG21 VAL 3 HG21 VAL 3 3.582 4.782 -3.120
36 HG22 VAL 3 HG22 VAL 3 3.974 5.032 -1.420
37 HG23 VAL 3 HG23 VAL 3 2.484 4.203 -1.868
38 HA PRO 4 HA PRO 4 6.563 -0.925 0.154
39 HB2 PRO 4 HB2 PRO 4 5.532 -2.288 2.199
40 HB3 PRO 4 HB1 PRO 4 6.344 -0.743 2.460
41 HG2 PRO 4 HG2 PRO 4 3.427 -1.365 2.398
42 HG3 PRO 4 HG1 PRO 4 4.314 -0.242 3.444
43 HD2 PRO 4 HD2 PRO 4 2.892 0.449 1.142
44 HD3 PRO 4 HD1 PRO 4 4.103 1.457 1.953
45 H THR 5 HN THR 5 5.501 -3.479 1.032
46 HA THR 5 HA THR 5 4.697 -4.573 -1.417
47 HB THR 5 HB THR 5 4.262 -5.790 1.314
48 HG1 THR 5 HG1 THR 5 6.370 -5.710 1.456
49 HG21 THR 5 HG21 THR 5 3.218 -6.998 -0.554
50 HG22 THR 5 HG22 THR 5 4.560 -7.912 0.139
51 HG23 THR 5 HG23 THR 5 4.773 -7.049 -1.385
52 H GLY 6 HN GLY 6 2.778 -4.560 -2.408
53 HA2 GLY 6 HA2 GLY 6 0.392 -5.359 -1.885
54 HA3 GLY 6 HA1 GLY 6 0.382 -3.975 -0.803
55 H SER 7 HN SER 7 -1.567 -3.858 -2.504
56 HA SER 7 HA SER 7 -0.841 -2.663 -5.020
57 HB2 SER 7 HB2 SER 7 -3.361 -2.319 -5.180
58 HB3 SER 7 HB1 SER 7 -2.819 -3.989 -5.032
59 HG SER 7 HG SER 7 -3.755 -2.348 -2.908
60 H ASN 8 HN ASN 8 0.444 -0.951 -4.096
61 HA ASN 8 HA ASN 8 0.877 1.143 -3.351
62 HB2 ASN 8 HB2 ASN 8 -1.820 1.552 -4.632
63 HB3 ASN 8 HB1 ASN 8 -0.890 2.887 -3.957
64 HD21 ASN 8 HD21 ASN 8 1.017 3.525 -4.961
65 HD22 ASN 8 HD22 ASN 8 1.420 3.025 -6.568
66 HA PRO 9 HA PRO 9 -1.571 0.616 0.561
67 HB2 PRO 9 HB2 PRO 9 1.024 0.262 1.833
68 HB3 PRO 9 HB1 PRO 9 -0.355 -0.837 1.806
69 HG2 PRO 9 HG2 PRO 9 1.955 -1.372 0.501
70 HG3 PRO 9 HG1 PRO 9 0.376 -1.920 -0.086
71 HD2 PRO 9 HD2 PRO 9 2.008 0.436 -0.971
72 HD3 PRO 9 HD1 PRO 9 1.123 -0.754 -1.954
73 H GLN 10 HN GLN 10 -0.970 2.999 -0.698
74 HA GLN 10 HA GLN 10 0.655 4.685 0.974
75 HB2 GLN 10 HB2 GLN 10 -0.101 6.481 -0.498
76 HB3 GLN 10 HB1 GLN 10 0.388 5.087 -1.454
77 HG2 GLN 10 HG2 GLN 10 -1.602 4.990 -2.416
78 HG3 GLN 10 HG1 GLN 10 -2.395 4.877 -0.846
79 HE21 GLN 10 HE21 GLN 10 -3.078 6.802 0.188
80 HE22 GLN 10 HE22 GLN 10 -3.345 8.249 -0.725
81 H LYS 11 HN LYS 11 -1.825 3.223 1.989
82 HA LYS 11 HA LYS 11 -3.929 5.062 2.305
83 HB2 LYS 11 HB2 LYS 11 -3.244 2.477 3.674
84 HB3 LYS 11 HB1 LYS 11 -4.618 3.442 4.193
85 HG2 LYS 11 HG2 LYS 11 -5.405 1.758 2.694
86 HG3 LYS 11 HG1 LYS 11 -5.516 3.316 1.878
87 HD2 LYS 11 HD2 LYS 11 -2.978 2.341 1.245
88 HD3 LYS 11 HD1 LYS 11 -4.048 0.944 1.129
89 HE2 LYS 11 HE2 LYS 11 -4.539 3.601 -0.212
90 HE3 LYS 11 HE1 LYS 11 -3.799 2.207 -0.997
91 HZ1 LYS 11 HZ1 LYS 11 -5.832 0.953 -0.564
92 HZ2 LYS 11 HZ2 LYS 11 -6.137 2.321 -1.506
93 HZ3 LYS 11 HZ3 LYS 11 -6.539 2.318 0.134
94 H ASN 12 HN ASN 12 -3.469 6.938 3.142
95 HA ASN 12 HA ASN 12 -1.928 7.153 5.608
96 HB2 ASN 12 HB2 ASN 12 -1.415 8.610 3.642
97 HB3 ASN 12 HB1 ASN 12 -3.016 9.316 3.784
98 HD21 ASN 12 HD21 ASN 12 -0.396 10.556 3.943
99 HD22 ASN 12 HD22 ASN 12 -0.326 11.350 5.477
Start of MODEL 7
1 H1 ARG 1 HT1 ARG 1 10.709 7.474 -0.040
2 H2 ARG 1 HT2 ARG 1 9.033 7.505 0.160
3 H3 ARG 1 HT3 ARG 1 9.804 6.073 -0.307
4 HA ARG 1 HA ARG 1 10.921 5.906 1.784
5 HB2 ARG 1 HB2 ARG 1 11.121 8.352 2.143
6 HB3 ARG 1 HB1 ARG 1 9.407 8.427 2.502
7 HG2 ARG 1 HG2 ARG 1 10.722 8.494 4.534
8 HG3 ARG 1 HG1 ARG 1 9.747 7.027 4.470
9 HD2 ARG 1 HD2 ARG 1 12.605 7.058 3.556
10 HD3 ARG 1 HD1 ARG 1 12.184 6.833 5.252
11 HE ARG 1 HE ARG 1 10.672 4.979 3.944
12 HH11 ARG 1 HH11 ARG 1 14.086 5.720 4.070
13 HH12 ARG 1 HH12 ARG 1 14.582 4.083 3.791
14 HH21 ARG 1 HH21 ARG 1 11.320 2.817 3.572
15 HH22 ARG 1 HH22 ARG 1 13.012 2.430 3.496
16 H LYS 2 HN LYS 2 7.971 5.888 0.390
17 HA LYS 2 HA LYS 2 6.882 4.218 2.522
18 HB2 LYS 2 HB2 LYS 2 4.669 5.237 2.319
19 HB3 LYS 2 HB1 LYS 2 5.856 6.415 2.844
20 HG2 LYS 2 HG2 LYS 2 5.994 7.208 0.484
21 HG3 LYS 2 HG1 LYS 2 4.650 6.135 0.109
22 HD2 LYS 2 HD2 LYS 2 4.558 8.324 2.178
23 HD3 LYS 2 HD1 LYS 2 3.975 8.494 0.526
24 HE2 LYS 2 HE2 LYS 2 2.045 8.014 1.696
25 HE3 LYS 2 HE1 LYS 2 2.514 6.436 1.077
26 HZ1 LYS 2 HZ1 LYS 2 3.351 5.817 3.193
27 HZ2 LYS 2 HZ2 LYS 2 1.822 6.479 3.457
28 HZ3 LYS 2 HZ3 LYS 2 3.205 7.386 3.799
29 H VAL 3 HN VAL 3 4.432 3.653 1.318
30 HA VAL 3 HA VAL 3 3.456 2.281 -0.205
31 HB VAL 3 HB VAL 3 5.650 3.085 -2.128
32 HG11 VAL 3 HG11 VAL 3 4.470 1.060 -2.798
33 HG12 VAL 3 HG12 VAL 3 4.065 2.404 -3.866
34 HG13 VAL 3 HG13 VAL 3 2.923 1.891 -2.625
35 HG21 VAL 3 HG21 VAL 3 2.938 4.312 -1.640
36 HG22 VAL 3 HG22 VAL 3 3.956 4.664 -3.036
37 HG23 VAL 3 HG23 VAL 3 4.512 5.073 -1.417
38 HA PRO 4 HA PRO 4 6.512 -1.013 0.737
39 HB2 PRO 4 HB2 PRO 4 4.935 -2.472 2.352
40 HB3 PRO 4 HB1 PRO 4 5.804 -1.050 2.939
41 HG2 PRO 4 HG2 PRO 4 2.926 -1.338 2.190
42 HG3 PRO 4 HG1 PRO 4 3.656 -0.425 3.523
43 HD2 PRO 4 HD2 PRO 4 2.822 0.665 1.125
44 HD3 PRO 4 HD1 PRO 4 4.008 1.405 2.216
45 H THR 5 HN THR 5 5.630 -3.571 0.928
46 HA THR 5 HA THR 5 4.887 -4.255 -1.693
47 HB THR 5 HB THR 5 6.149 -5.806 -0.326
48 HG1 THR 5 HG1 THR 5 5.122 -7.604 -1.020
49 HG21 THR 5 HG21 THR 5 5.106 -7.036 1.534
50 HG22 THR 5 HG22 THR 5 3.674 -6.017 1.394
51 HG23 THR 5 HG23 THR 5 5.219 -5.310 1.866
52 H GLY 6 HN GLY 6 2.966 -4.597 -2.651
53 HA2 GLY 6 HA2 GLY 6 0.600 -5.436 -2.121
54 HA3 GLY 6 HA1 GLY 6 0.567 -4.057 -1.032
55 H SER 7 HN SER 7 -1.382 -3.933 -2.708
56 HA SER 7 HA SER 7 -0.600 -2.691 -5.215
57 HB2 SER 7 HB2 SER 7 -3.398 -3.064 -4.134
58 HB3 SER 7 HB1 SER 7 -2.914 -2.822 -5.813
59 HG SER 7 HG SER 7 -1.589 -4.925 -4.974
60 H ASN 8 HN ASN 8 0.438 -1.059 -3.538
61 HA ASN 8 HA ASN 8 0.566 1.095 -2.830
62 HB2 ASN 8 HB2 ASN 8 -0.479 1.830 -4.866
63 HB3 ASN 8 HB1 ASN 8 -2.070 1.346 -4.292
64 HD21 ASN 8 HD21 ASN 8 -3.220 2.698 -3.014
65 HD22 ASN 8 HD22 ASN 8 -2.709 4.302 -2.607
66 HA PRO 9 HA PRO 9 -1.577 0.477 0.990
67 HB2 PRO 9 HB2 PRO 9 -0.184 2.133 2.530
68 HB3 PRO 9 HB1 PRO 9 0.601 0.725 1.792
69 HG2 PRO 9 HG2 PRO 9 0.622 3.589 0.889
70 HG3 PRO 9 HG1 PRO 9 1.979 2.460 1.036
71 HD2 PRO 9 HD2 PRO 9 0.681 2.976 -1.322
72 HD3 PRO 9 HD1 PRO 9 1.513 1.449 -0.971
73 H GLN 10 HN GLN 10 -3.341 1.837 -0.501
74 HA GLN 10 HA GLN 10 -3.878 4.391 0.780
75 HB2 GLN 10 HB2 GLN 10 -5.725 4.648 -0.701
76 HB3 GLN 10 HB1 GLN 10 -4.397 4.002 -1.647
77 HG2 GLN 10 HG2 GLN 10 -6.516 2.218 -0.507
78 HG3 GLN 10 HG1 GLN 10 -6.747 3.067 -2.033
79 HE21 GLN 10 HE21 GLN 10 -5.096 0.496 -0.405
80 HE22 GLN 10 HE22 GLN 10 -4.375 -0.202 -1.813
81 H LYS 11 HN LYS 11 -4.422 1.177 1.460
82 HA LYS 11 HA LYS 11 -6.226 1.780 3.620
83 HB2 LYS 11 HB2 LYS 11 -7.993 0.206 2.911
84 HB3 LYS 11 HB1 LYS 11 -7.849 1.565 1.806
85 HG2 LYS 11 HG2 LYS 11 -6.522 0.147 0.290
86 HG3 LYS 11 HG1 LYS 11 -6.778 -1.213 1.378
87 HD2 LYS 11 HD2 LYS 11 -9.196 -1.024 1.033
88 HD3 LYS 11 HD1 LYS 11 -8.928 0.332 -0.064
89 HE2 LYS 11 HE2 LYS 11 -9.263 -1.715 -1.328
90 HE3 LYS 11 HE1 LYS 11 -7.613 -1.132 -1.534
91 HZ1 LYS 11 HZ1 LYS 11 -7.605 -3.494 -1.181
92 HZ2 LYS 11 HZ2 LYS 11 -8.492 -3.337 0.248
93 HZ3 LYS 11 HZ3 LYS 11 -6.913 -2.742 0.166
94 H ASN 12 HN ASN 12 -3.602 0.804 3.395
95 HA ASN 12 HA ASN 12 -3.889 -1.985 4.261
96 HB2 ASN 12 HB2 ASN 12 -3.023 -2.155 2.052
97 HB3 ASN 12 HB1 ASN 12 -1.886 -0.843 2.316
98 HD21 ASN 12 HD21 ASN 12 -2.612 -4.181 2.960
99 HD22 ASN 12 HD22 ASN 12 -1.027 -4.639 3.469
Start of MODEL 8
1 H1 ARG 1 HT1 ARG 1 5.606 5.575 5.289
2 H2 ARG 1 HT2 ARG 1 4.456 4.621 4.495
3 H3 ARG 1 HT3 ARG 1 4.537 6.277 4.181
4 HA ARG 1 HA ARG 1 6.659 6.068 3.171
5 HB2 ARG 1 HB2 ARG 1 7.593 3.763 2.809
6 HB3 ARG 1 HB1 ARG 1 7.643 4.325 4.469
7 HG2 ARG 1 HG2 ARG 1 5.455 3.027 4.770
8 HG3 ARG 1 HG1 ARG 1 5.874 2.247 3.243
9 HD2 ARG 1 HD2 ARG 1 7.591 2.314 5.724
10 HD3 ARG 1 HD1 ARG 1 6.637 0.939 5.171
11 HE ARG 1 HE ARG 1 8.183 1.360 3.048
12 HH11 ARG 1 HH11 ARG 1 9.013 1.280 6.456
13 HH12 ARG 1 HH12 ARG 1 10.612 0.674 6.184
14 HH21 ARG 1 HH21 ARG 1 10.286 0.544 2.689
15 HH22 ARG 1 HH22 ARG 1 11.337 0.250 4.038
16 H LYS 2 HN LYS 2 6.996 5.187 0.933
17 HA LYS 2 HA LYS 2 4.713 5.863 -0.499
18 HB2 LYS 2 HB2 LYS 2 7.378 4.777 -1.245
19 HB3 LYS 2 HB1 LYS 2 6.113 4.775 -2.465
20 HG2 LYS 2 HG2 LYS 2 7.493 6.761 -2.649
21 HG3 LYS 2 HG1 LYS 2 5.844 7.189 -2.198
22 HD2 LYS 2 HD2 LYS 2 6.559 7.391 0.144
23 HD3 LYS 2 HD1 LYS 2 8.214 7.012 -0.337
24 HE2 LYS 2 HE2 LYS 2 6.574 9.378 -1.202
25 HE3 LYS 2 HE1 LYS 2 7.911 9.404 -0.061
26 HZ1 LYS 2 HZ1 LYS 2 8.685 10.146 -2.181
27 HZ2 LYS 2 HZ2 LYS 2 8.065 8.781 -2.959
28 HZ3 LYS 2 HZ3 LYS 2 9.361 8.625 -1.887
29 H VAL 3 HN VAL 3 6.281 2.684 -0.953
30 HA VAL 3 HA VAL 3 3.638 1.473 -0.948
31 HB VAL 3 HB VAL 3 4.309 0.127 -3.023
32 HG11 VAL 3 HG11 VAL 3 2.550 1.813 -3.038
33 HG12 VAL 3 HG12 VAL 3 3.469 1.849 -4.543
34 HG13 VAL 3 HG13 VAL 3 3.749 3.077 -3.308
35 HG21 VAL 3 HG21 VAL 3 6.207 2.453 -3.353
36 HG22 VAL 3 HG22 VAL 3 5.841 1.234 -4.576
37 HG23 VAL 3 HG23 VAL 3 6.668 0.771 -3.089
38 HA PRO 4 HA PRO 4 6.667 -1.276 1.178
39 HB2 PRO 4 HB2 PRO 4 5.325 -1.572 3.480
40 HB3 PRO 4 HB1 PRO 4 6.334 -0.154 3.170
41 HG2 PRO 4 HG2 PRO 4 3.363 -0.443 2.987
42 HG3 PRO 4 HG1 PRO 4 4.318 0.896 3.644
43 HD2 PRO 4 HD2 PRO 4 3.203 0.884 1.131
44 HD3 PRO 4 HD1 PRO 4 4.624 1.844 1.582
45 H THR 5 HN THR 5 3.196 -1.436 0.708
46 HA THR 5 HA THR 5 3.383 -4.330 0.403
47 HB THR 5 HB THR 5 2.670 -4.036 2.715
48 HG1 THR 5 HG1 THR 5 1.285 -5.608 2.471
49 HG21 THR 5 HG21 THR 5 0.360 -2.445 1.596
50 HG22 THR 5 HG22 THR 5 1.693 -1.802 2.556
51 HG23 THR 5 HG23 THR 5 0.554 -2.938 3.279
52 H GLY 6 HN GLY 6 2.141 -5.116 -1.205
53 HA2 GLY 6 HA2 GLY 6 0.757 -5.151 -3.029
54 HA3 GLY 6 HA1 GLY 6 -0.238 -3.977 -2.183
55 H SER 7 HN SER 7 -0.664 -2.894 -4.149
56 HA SER 7 HA SER 7 1.577 -1.575 -5.447
57 HB2 SER 7 HB2 SER 7 -0.326 -2.554 -6.770
58 HB3 SER 7 HB1 SER 7 -1.377 -1.328 -6.065
59 HG SER 7 HG SER 7 -0.225 -0.987 -8.236
60 H ASN 8 HN ASN 8 -0.492 -1.098 -2.910
61 HA ASN 8 HA ASN 8 0.445 1.524 -2.339
62 HB2 ASN 8 HB2 ASN 8 -1.292 2.142 -3.979
63 HB3 ASN 8 HB1 ASN 8 -2.487 1.232 -3.061
64 HD21 ASN 8 HD21 ASN 8 -0.591 4.121 -3.220
65 HD22 ASN 8 HD22 ASN 8 -1.386 4.963 -1.937
66 HA PRO 9 HA PRO 9 -0.574 -0.343 1.621
67 HB2 PRO 9 HB2 PRO 9 0.214 1.741 3.165
68 HB3 PRO 9 HB1 PRO 9 1.359 0.621 2.419
69 HG2 PRO 9 HG2 PRO 9 0.492 3.335 1.487
70 HG3 PRO 9 HG1 PRO 9 2.128 2.656 1.570
71 HD2 PRO 9 HD2 PRO 9 0.758 2.735 -0.740
72 HD3 PRO 9 HD1 PRO 9 1.836 1.387 -0.343
73 H GLN 10 HN GLN 10 -2.803 0.294 0.411
74 HA GLN 10 HA GLN 10 -4.187 2.441 1.755
75 HB2 GLN 10 HB2 GLN 10 -6.156 1.577 0.411
76 HB3 GLN 10 HB1 GLN 10 -4.789 2.171 -0.513
77 HG2 GLN 10 HG2 GLN 10 -5.511 0.224 -1.603
78 HG3 GLN 10 HG1 GLN 10 -4.044 -0.224 -0.743
79 HE21 GLN 10 HE21 GLN 10 -7.193 0.184 0.749
80 HE22 GLN 10 HE22 GLN 10 -7.403 -1.475 1.188
81 H LYS 11 HN LYS 11 -3.246 -0.432 2.773
82 HA LYS 11 HA LYS 11 -5.316 -1.994 3.587
83 HB2 LYS 11 HB2 LYS 11 -2.755 -1.336 5.036
84 HB3 LYS 11 HB1 LYS 11 -3.857 -2.601 5.563
85 HG2 LYS 11 HG2 LYS 11 -2.562 -2.506 2.845
86 HG3 LYS 11 HG1 LYS 11 -1.936 -3.416 4.223
87 HD2 LYS 11 HD2 LYS 11 -3.310 -5.102 3.764
88 HD3 LYS 11 HD1 LYS 11 -4.703 -4.027 3.899
89 HE2 LYS 11 HE2 LYS 11 -4.481 -3.399 1.571
90 HE3 LYS 11 HE1 LYS 11 -3.027 -4.387 1.421
91 HZ1 LYS 11 HZ1 LYS 11 -4.330 -6.350 1.840
92 HZ2 LYS 11 HZ2 LYS 11 -5.015 -5.495 0.553
93 HZ3 LYS 11 HZ3 LYS 11 -5.727 -5.428 2.085
94 H ASN 12 HN ASN 12 -7.134 -1.393 4.459
95 HA ASN 12 HA ASN 12 -7.197 0.766 6.419
96 HB2 ASN 12 HB2 ASN 12 -8.721 0.983 4.534
97 HB3 ASN 12 HB1 ASN 12 -9.407 -0.604 4.869
98 HD21 ASN 12 HD21 ASN 12 -9.153 2.701 5.961
99 HD22 ASN 12 HD22 ASN 12 -10.512 2.657 7.032
Start of MODEL 9
1 H1 ARG 1 HT1 ARG 1 9.822 7.642 2.021
2 H2 ARG 1 HT2 ARG 1 9.691 8.303 0.469
3 H3 ARG 1 HT3 ARG 1 11.150 7.611 0.974
4 HA ARG 1 HA ARG 1 9.915 6.179 -0.545
5 HB2 ARG 1 HB2 ARG 1 10.062 4.142 0.816
6 HB3 ARG 1 HB1 ARG 1 11.450 5.186 1.095
7 HG2 ARG 1 HG2 ARG 1 10.422 5.986 3.163
8 HG3 ARG 1 HG1 ARG 1 9.042 4.925 2.882
9 HD2 ARG 1 HD2 ARG 1 10.502 2.979 3.005
10 HD3 ARG 1 HD1 ARG 1 11.898 4.030 3.248
11 HE ARG 1 HE ARG 1 9.961 4.595 5.204
12 HH11 ARG 1 HH11 ARG 1 12.213 2.068 4.325
13 HH12 ARG 1 HH12 ARG 1 12.411 1.509 5.955
14 HH21 ARG 1 HH21 ARG 1 10.229 3.866 7.345
15 HH22 ARG 1 HH22 ARG 1 11.284 2.527 7.665
16 H LYS 2 HN LYS 2 8.113 4.677 -0.759
17 HA LYS 2 HA LYS 2 5.866 4.998 1.030
18 HB2 LYS 2 HB2 LYS 2 4.274 5.687 -0.672
19 HB3 LYS 2 HB1 LYS 2 5.554 6.882 -0.546
20 HG2 LYS 2 HG2 LYS 2 5.633 4.732 -2.631
21 HG3 LYS 2 HG1 LYS 2 4.723 6.222 -2.876
22 HD2 LYS 2 HD2 LYS 2 6.739 7.537 -2.587
23 HD3 LYS 2 HD1 LYS 2 7.660 6.081 -2.215
24 HE2 LYS 2 HE2 LYS 2 8.000 6.855 -4.521
25 HE3 LYS 2 HE1 LYS 2 7.322 5.234 -4.425
26 HZ1 LYS 2 HZ1 LYS 2 6.232 6.571 -6.122
27 HZ2 LYS 2 HZ2 LYS 2 5.779 7.710 -4.960
28 HZ3 LYS 2 HZ3 LYS 2 5.144 6.146 -4.900
29 H VAL 3 HN VAL 3 4.076 3.525 0.406
30 HA VAL 3 HA VAL 3 3.258 1.489 -0.151
31 HB VAL 3 HB VAL 3 5.209 1.647 -2.458
32 HG11 VAL 3 HG11 VAL 3 3.717 0.033 -3.558
33 HG12 VAL 3 HG12 VAL 3 2.782 -0.099 -2.068
34 HG13 VAL 3 HG13 VAL 3 4.462 -0.633 -2.105
35 HG21 VAL 3 HG21 VAL 3 3.275 2.430 -3.752
36 HG22 VAL 3 HG22 VAL 3 3.666 3.529 -2.429
37 HG23 VAL 3 HG23 VAL 3 2.298 2.428 -2.283
38 HA PRO 4 HA PRO 4 6.671 -0.702 2.133
39 HB2 PRO 4 HB2 PRO 4 4.717 -2.179 3.480
40 HB3 PRO 4 HB1 PRO 4 5.548 -0.754 4.111
41 HG2 PRO 4 HG2 PRO 4 2.862 -0.975 2.832
42 HG3 PRO 4 HG1 PRO 4 3.387 0.056 4.176
43 HD2 PRO 4 HD2 PRO 4 3.041 1.056 1.723
44 HD3 PRO 4 HD1 PRO 4 4.370 1.613 2.758
45 H THR 5 HN THR 5 3.555 -2.102 1.123
46 HA THR 5 HA THR 5 4.717 -3.676 -0.927
47 HB THR 5 HB THR 5 5.498 -5.090 0.884
48 HG1 THR 5 HG1 THR 5 3.511 -6.791 0.255
49 HG21 THR 5 HG21 THR 5 2.619 -5.232 1.784
50 HG22 THR 5 HG22 THR 5 3.932 -4.419 2.633
51 HG23 THR 5 HG23 THR 5 3.953 -6.173 2.453
52 H GLY 6 HN GLY 6 3.167 -4.091 -2.402
53 HA2 GLY 6 HA2 GLY 6 0.837 -5.001 -2.661
54 HA3 GLY 6 HA1 GLY 6 0.367 -3.754 -1.517
55 H SER 7 HN SER 7 -1.074 -3.513 -3.591
56 HA SER 7 HA SER 7 0.162 -2.195 -5.801
57 HB2 SER 7 HB2 SER 7 -1.841 -3.593 -6.097
58 HB3 SER 7 HB1 SER 7 -2.765 -2.462 -5.111
59 HG SER 7 HG SER 7 -1.912 -2.263 -7.740
60 H ASN 8 HN ASN 8 -1.683 -1.207 -3.035
61 HA ASN 8 HA ASN 8 -0.677 1.470 -3.187
62 HB2 ASN 8 HB2 ASN 8 -3.000 2.508 -3.249
63 HB3 ASN 8 HB1 ASN 8 -2.389 1.867 -4.766
64 HD21 ASN 8 HD21 ASN 8 -4.387 1.597 -5.660
65 HD22 ASN 8 HD22 ASN 8 -5.510 0.397 -5.127
66 HA PRO 9 HA PRO 9 -2.052 -0.122 0.980
67 HB2 PRO 9 HB2 PRO 9 0.332 -0.595 2.103
68 HB3 PRO 9 HB1 PRO 9 -0.405 -1.762 0.998
69 HG2 PRO 9 HG2 PRO 9 1.763 0.227 0.489
70 HG3 PRO 9 HG1 PRO 9 1.624 -1.445 -0.078
71 HD2 PRO 9 HD2 PRO 9 0.985 0.786 -1.578
72 HD3 PRO 9 HD1 PRO 9 0.353 -0.846 -1.874
73 H GLN 10 HN GLN 10 -2.062 2.496 0.188
74 HA GLN 10 HA GLN 10 -0.575 4.219 1.844
75 HB2 GLN 10 HB2 GLN 10 -2.728 5.673 1.572
76 HB3 GLN 10 HB1 GLN 10 -1.754 5.314 0.152
77 HG2 GLN 10 HG2 GLN 10 -3.275 3.656 -0.588
78 HG3 GLN 10 HG1 GLN 10 -4.142 3.673 0.946
79 HE21 GLN 10 HE21 GLN 10 -5.651 5.224 1.327
80 HE22 GLN 10 HE22 GLN 10 -6.205 6.335 0.124
81 H LYS 11 HN LYS 11 -3.400 2.271 2.308
82 HA LYS 11 HA LYS 11 -3.409 1.982 5.022
83 HB2 LYS 11 HB2 LYS 11 -5.143 3.564 5.815
84 HB3 LYS 11 HB1 LYS 11 -3.683 4.393 5.296
85 HG2 LYS 11 HG2 LYS 11 -4.758 4.973 3.183
86 HG3 LYS 11 HG1 LYS 11 -6.222 4.130 3.694
87 HD2 LYS 11 HD2 LYS 11 -6.423 5.672 5.600
88 HD3 LYS 11 HD1 LYS 11 -4.982 6.526 5.049
89 HE2 LYS 11 HE2 LYS 11 -6.140 7.030 2.925
90 HE3 LYS 11 HE1 LYS 11 -7.589 6.251 3.560
91 HZ1 LYS 11 HZ1 LYS 11 -7.660 7.895 5.326
92 HZ2 LYS 11 HZ2 LYS 11 -7.680 8.653 3.814
93 HZ3 LYS 11 HZ3 LYS 11 -6.261 8.633 4.731
94 H ASN 12 HN ASN 12 -4.055 0.696 2.589
95 HA ASN 12 HA ASN 12 -6.824 -0.084 3.043
96 HB2 ASN 12 HB2 ASN 12 -7.093 1.558 1.324
97 HB3 ASN 12 HB1 ASN 12 -5.721 0.935 0.418
98 HD21 ASN 12 HD21 ASN 12 -9.045 0.391 1.330
99 HD22 ASN 12 HD22 ASN 12 -9.398 -0.765 0.093
Start of MODEL 10
1 H1 ARG 1 HT1 ARG 1 5.268 9.449 3.688
2 H2 ARG 1 HT2 ARG 1 6.521 8.462 4.243
3 H3 ARG 1 HT3 ARG 1 4.951 7.847 4.121
4 HA ARG 1 HA ARG 1 4.981 8.025 1.760
5 HB2 ARG 1 HB2 ARG 1 7.036 8.727 0.586
6 HB3 ARG 1 HB1 ARG 1 6.352 10.022 1.556
7 HG2 ARG 1 HG2 ARG 1 8.022 9.608 3.289
8 HG3 ARG 1 HG1 ARG 1 8.706 8.304 2.319
9 HD2 ARG 1 HD2 ARG 1 9.118 9.982 0.508
10 HD3 ARG 1 HD1 ARG 1 8.617 11.239 1.639
11 HE ARG 1 HE ARG 1 10.635 9.659 2.809
12 HH11 ARG 1 HH11 ARG 1 10.197 12.105 0.343
13 HH12 ARG 1 HH12 ARG 1 11.831 12.675 0.439
14 HH21 ARG 1 HH21 ARG 1 12.795 10.403 2.922
15 HH22 ARG 1 HH22 ARG 1 13.307 11.704 1.895
16 H LYS 2 HN LYS 2 5.097 5.943 3.462
17 HA LYS 2 HA LYS 2 7.460 4.357 3.118
18 HB2 LYS 2 HB2 LYS 2 4.707 3.760 4.177
19 HB3 LYS 2 HB1 LYS 2 5.884 2.481 3.933
20 HG2 LYS 2 HG2 LYS 2 6.099 3.014 6.172
21 HG3 LYS 2 HG1 LYS 2 7.429 3.890 5.419
22 HD2 LYS 2 HD2 LYS 2 6.142 5.941 5.481
23 HD3 LYS 2 HD1 LYS 2 4.753 5.078 6.138
24 HE2 LYS 2 HE2 LYS 2 7.418 5.514 7.459
25 HE3 LYS 2 HE1 LYS 2 5.860 6.192 7.925
26 HZ1 LYS 2 HZ1 LYS 2 6.356 4.384 9.371
27 HZ2 LYS 2 HZ2 LYS 2 6.677 3.342 8.081
28 HZ3 LYS 2 HZ3 LYS 2 5.100 3.885 8.355
29 H VAL 3 HN VAL 3 4.135 4.030 1.935
30 HA VAL 3 HA VAL 3 3.229 2.665 0.357
31 HB VAL 3 HB VAL 3 3.907 3.284 -1.957
32 HG11 VAL 3 HG11 VAL 3 3.451 5.502 0.030
33 HG12 VAL 3 HG12 VAL 3 2.224 4.552 -0.810
34 HG13 VAL 3 HG13 VAL 3 3.251 5.663 -1.713
35 HG21 VAL 3 HG21 VAL 3 5.942 5.036 -0.572
36 HG22 VAL 3 HG22 VAL 3 5.519 5.102 -2.282
37 HG23 VAL 3 HG23 VAL 3 6.297 3.665 -1.624
38 HA PRO 4 HA PRO 4 6.373 -0.687 0.179
39 HB2 PRO 4 HB2 PRO 4 4.983 -2.506 1.592
40 HB3 PRO 4 HB1 PRO 4 5.970 -1.270 2.378
41 HG2 PRO 4 HG2 PRO 4 3.013 -1.369 1.985
42 HG3 PRO 4 HG1 PRO 4 3.940 -0.824 3.393
43 HD2 PRO 4 HD2 PRO 4 2.834 0.857 1.511
44 HD3 PRO 4 HD1 PRO 4 4.215 1.275 2.542
45 H THR 5 HN THR 5 5.616 -3.183 -0.267
46 HA THR 5 HA THR 5 4.007 -2.984 -2.681
47 HB THR 5 HB THR 5 5.570 -5.350 -1.632
48 HG1 THR 5 HG1 THR 5 7.240 -4.609 -2.904
49 HG21 THR 5 HG21 THR 5 4.502 -4.724 -4.386
50 HG22 THR 5 HG22 THR 5 3.843 -5.924 -3.277
51 HG23 THR 5 HG23 THR 5 5.461 -6.136 -3.946
52 H GLY 6 HN GLY 6 1.907 -2.897 -2.001
53 HA2 GLY 6 HA2 GLY 6 0.743 -5.373 -1.057
54 HA3 GLY 6 HA1 GLY 6 0.604 -4.031 0.070
55 H SER 7 HN SER 7 0.401 -4.185 -3.455
56 HA SER 7 HA SER 7 -1.179 -3.564 -4.943
57 HB2 SER 7 HB2 SER 7 -2.521 -5.284 -3.729
58 HB3 SER 7 HB1 SER 7 -3.155 -4.009 -2.692
59 HG SER 7 HG SER 7 -3.876 -3.000 -4.728
60 H ASN 8 HN ASN 8 0.154 -1.520 -4.021
61 HA ASN 8 HA ASN 8 0.197 0.734 -3.828
62 HB2 ASN 8 HB2 ASN 8 -2.633 0.415 -4.818
63 HB3 ASN 8 HB1 ASN 8 -1.902 1.990 -4.536
64 HD21 ASN 8 HD21 ASN 8 -0.261 2.700 -5.886
65 HD22 ASN 8 HD22 ASN 8 0.064 1.955 -7.410
66 HA PRO 9 HA PRO 9 -1.847 0.890 0.280
67 HB2 PRO 9 HB2 PRO 9 0.441 0.308 1.742
68 HB3 PRO 9 HB1 PRO 9 -0.788 -0.866 1.271
69 HG2 PRO 9 HG2 PRO 9 1.911 -0.740 0.383
70 HG3 PRO 9 HG1 PRO 9 0.641 -1.832 -0.188
71 HD2 PRO 9 HD2 PRO 9 1.628 0.711 -1.372
72 HD3 PRO 9 HD1 PRO 9 0.940 -0.720 -2.172
73 H GLN 10 HN GLN 10 -1.735 3.149 -0.603
74 HA GLN 10 HA GLN 10 0.432 4.766 0.473
75 HB2 GLN 10 HB2 GLN 10 -0.577 5.303 -1.734
76 HB3 GLN 10 HB1 GLN 10 -2.120 5.582 -0.948
77 HG2 GLN 10 HG2 GLN 10 0.186 7.169 0.017
78 HG3 GLN 10 HG1 GLN 10 -0.433 7.540 -1.588
79 HE21 GLN 10 HE21 GLN 10 -1.044 7.641 1.816
80 HE22 GLN 10 HE22 GLN 10 -2.484 8.600 1.749
81 H LYS 11 HN LYS 11 -2.618 3.570 1.293
82 HA LYS 11 HA LYS 11 -3.723 3.770 3.380
83 HB2 LYS 11 HB2 LYS 11 -2.520 6.522 3.381
84 HB3 LYS 11 HB1 LYS 11 -3.951 6.170 4.337
85 HG2 LYS 11 HG2 LYS 11 -2.769 4.502 5.594
86 HG3 LYS 11 HG1 LYS 11 -1.350 4.675 4.557
87 HD2 LYS 11 HD2 LYS 11 -2.499 6.952 6.147
88 HD3 LYS 11 HD1 LYS 11 -1.257 5.872 6.791
89 HE2 LYS 11 HE2 LYS 11 0.135 6.471 4.785
90 HE3 LYS 11 HE1 LYS 11 -1.072 7.697 4.403
91 HZ1 LYS 11 HZ1 LYS 11 -0.656 8.678 6.601
92 HZ2 LYS 11 HZ2 LYS 11 0.716 8.685 5.619
93 HZ3 LYS 11 HZ3 LYS 11 0.578 7.550 6.864
94 H ASN 12 HN ASN 12 -3.695 5.673 0.565
95 HA ASN 12 HA ASN 12 -6.629 5.662 0.581
96 HB2 ASN 12 HB2 ASN 12 -5.908 7.979 0.860
97 HB3 ASN 12 HB1 ASN 12 -4.836 7.838 -0.530
98 HD21 ASN 12 HD21 ASN 12 -5.882 9.566 -1.536
99 HD22 ASN 12 HD22 ASN 12 -7.436 9.380 -2.272