NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
554699 |
2lx6   |
18661 | 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 H GLY 1 2.656 -1.556 1.028
2 HA2 GLY 1 HA3 GLY 1 3.738 -1.201 -1.427
3 HA3 GLY 1 HA2 GLY 1 5.215 -1.316 -0.445
4 H ALA 2 H ALA 2 2.043 -3.225 -0.435
5 HA ALA 2 HA ALA 2 3.400 -5.515 -1.629
6 HB1 ALA 2 HB1 ALA 2 4.073 -5.696 0.804
7 HB2 ALA 2 HB2 ALA 2 2.333 -5.692 1.255
8 HB3 ALA 2 HB3 ALA 2 3.034 -7.047 0.329
9 H PHE 3 H PHE 3 1.496 -7.486 -1.337
10 HA PHE 3 HA PHE 3 -0.446 -6.406 -3.078
11 HB2 PHE 3 HB2 PHE 3 -0.674 -9.036 -1.505
12 HB3 PHE 3 HB3 PHE 3 -1.541 -8.638 -3.008
13 HD1 PHE 3 HD1 PHE 3 -0.023 -7.898 -5.068
14 HD2 PHE 3 HD2 PHE 3 1.404 -10.251 -1.755
15 HE1 PHE 3 HE1 PHE 3 1.949 -8.581 -6.397
16 HE2 PHE 3 HE2 PHE 3 3.356 -10.953 -3.098
17 HZ PHE 3 HZ PHE 3 3.653 -10.099 -5.412
18 H VAL 4 H VAL 4 -0.620 -6.740 0.542
19 HA VAL 4 HA VAL 4 -3.246 -5.398 0.397
20 HB VAL 4 HB VAL 4 -3.807 -7.773 -0.011
21 HG11 VAL 4 HG11 VAL 4 -2.442 -8.383 2.689
22 HG12 VAL 4 HG12 VAL 4 -3.374 -9.541 1.701
23 HG13 VAL 4 HG13 VAL 4 -1.843 -8.878 1.078
24 HG21 VAL 4 HG21 VAL 4 -5.406 -6.370 1.344
25 HG22 VAL 4 HG22 VAL 4 -5.491 -8.101 1.761
26 HG23 VAL 4 HG23 VAL 4 -4.642 -6.974 2.849
27 H GLY 5 H GLY 5 -3.985 -4.532 2.514
28 HA2 GLY 5 HA3 GLY 5 -3.189 -5.016 4.964
29 HA3 GLY 5 HA2 GLY 5 -1.691 -4.247 4.393
30 H GLN 6 H GLN 6 -1.658 -1.890 4.363
31 HA GLN 6 HA GLN 6 -4.224 -0.439 4.407
32 HB2 GLN 6 HB2 GLN 6 -3.863 0.462 6.719
33 HB3 GLN 6 HB3 GLN 6 -3.908 -1.294 6.750
34 HG2 GLN 6 HG2 GLN 6 -2.119 -0.412 8.218
35 HG3 GLN 6 HG3 GLN 6 -1.463 -1.412 6.917
36 HE21 GLN 6 HE21 GLN 6 -2.296 2.134 7.550
37 HE22 GLN 6 HE22 GLN 6 -0.855 2.730 6.821
38 HA PRO 7 HA PRO 7 -1.922 2.336 2.073
39 HB2 PRO 7 HB2 PRO 7 -2.071 4.912 3.308
40 HB3 PRO 7 HB3 PRO 7 -3.360 4.180 2.312
41 HG2 PRO 7 HG2 PRO 7 -3.103 3.992 5.339
42 HG3 PRO 7 HG3 PRO 7 -4.540 4.515 4.401
43 HD2 PRO 7 HD2 PRO 7 -4.494 1.992 5.248
44 HD3 PRO 7 HD3 PRO 7 -4.815 2.181 3.493
45 H GLU 8 H GLU 8 0.394 2.499 1.881
46 HA GLU 8 HA GLU 8 1.955 2.190 4.302
47 HB2 GLU 8 HB2 GLU 8 2.796 2.771 1.403
48 HB3 GLU 8 HB3 GLU 8 3.953 2.554 2.744
49 HG2 GLU 8 HG2 GLU 8 3.190 0.270 3.150
50 HG3 GLU 8 HG3 GLU 8 1.813 0.467 2.041
51 H ALA 9 H ALA 9 1.656 4.948 1.860
52 HA ALA 9 HA ALA 9 2.967 6.712 3.837
53 HB1 ALA 9 HB1 ALA 9 2.747 8.474 2.121
54 HB2 ALA 9 HB2 ALA 9 3.546 7.011 1.472
55 HB3 ALA 9 HB3 ALA 9 1.853 7.365 1.045
56 H VAL 10 H VAL 10 -0.229 6.726 2.043
57 HA VAL 10 HA VAL 10 -1.774 7.254 4.327
58 HB VAL 10 HB VAL 10 -0.716 9.403 4.642
59 HG11 VAL 10 HG11 VAL 10 0.161 9.718 2.257
60 HG12 VAL 10 HG12 VAL 10 -1.470 10.314 1.810
61 HG13 VAL 10 HG13 VAL 10 -0.514 11.175 3.031
62 HG21 VAL 10 HG21 VAL 10 -2.648 10.922 4.545
63 HG22 VAL 10 HG22 VAL 10 -3.470 9.877 3.357
64 HG23 VAL 10 HG23 VAL 10 -3.188 9.289 5.020
65 H ASN 11 H ASN 11 -1.512 8.222 0.775
66 HA ASN 11 HA ASN 11 -4.377 7.676 0.447
67 HB2 ASN 11 HB2 ASN 11 -3.177 9.378 -0.937
68 HB3 ASN 11 HB3 ASN 11 -2.134 8.118 -1.623
69 HD21 ASN 11 HD21 ASN 11 -3.370 6.231 -2.844
70 HD22 ASN 11 HD22 ASN 11 -4.746 6.730 -3.745
71 HA PRO 12 HA PRO 12 -3.206 3.264 0.122
72 HB2 PRO 12 HB2 PRO 12 -5.334 2.157 -1.219
73 HB3 PRO 12 HB3 PRO 12 -5.528 2.911 0.391
74 HG2 PRO 12 HG2 PRO 12 -5.971 4.320 -2.294
75 HG3 PRO 12 HG3 PRO 12 -7.189 4.105 -0.994
76 HD2 PRO 12 HD2 PRO 12 -5.757 6.403 -1.087
77 HD3 PRO 12 HD3 PRO 12 -5.909 5.594 0.514
78 H LEU 13 H LEU 13 -1.314 4.252 -1.223
79 HA LEU 13 HA LEU 13 -1.493 3.406 -4.080
80 HB2 LEU 13 HB2 LEU 13 0.910 4.505 -2.523
81 HB3 LEU 13 HB3 LEU 13 0.829 4.201 -4.272
82 HG LEU 13 HG LEU 13 -0.880 6.255 -2.727
83 HD11 LEU 13 HD11 LEU 13 1.535 6.885 -2.711
84 HD12 LEU 13 HD12 LEU 13 0.602 7.988 -3.752
85 HD13 LEU 13 HD13 LEU 13 1.604 6.704 -4.489
86 HD21 LEU 13 HD21 LEU 13 -2.034 5.540 -4.849
87 HD22 LEU 13 HD22 LEU 13 -0.531 5.836 -5.767
88 HD23 LEU 13 HD23 LEU 13 -1.412 7.193 -5.009
89 H GLY 14 H GLY 14 0.515 2.684 -1.049
90 HA2 GLY 14 HA3 GLY 14 1.008 -0.040 -2.207
91 HA3 GLY 14 HA2 GLY 14 2.003 0.804 -1.008
92 H ARG 15 H ARG 15 0.335 -1.867 -0.865
93 HA ARG 15 HA ARG 15 -1.143 -1.140 1.653
94 HB2 ARG 15 HB2 ARG 15 -1.737 -3.423 -0.309
95 HB3 ARG 15 HB3 ARG 15 -2.578 -2.986 1.196
96 HG2 ARG 15 HG2 ARG 15 -3.991 -2.079 -0.419
97 HG3 ARG 15 HG3 ARG 15 -3.053 -0.659 0.088
98 HD2 ARG 15 HD2 ARG 15 -3.300 -0.690 -2.414
99 HD3 ARG 15 HD3 ARG 15 -1.631 -0.886 -1.976
100 HE ARG 15 HE ARG 15 -1.550 -3.029 -2.824
101 HH11 ARG 15 HH11 ARG 15 -5.038 -2.081 -2.527
102 HH12 ARG 15 HH12 ARG 15 -5.551 -3.495 -3.428
103 HH21 ARG 15 HH21 ARG 15 -2.342 -4.794 -3.948
104 HH22 ARG 15 HH22 ARG 15 -4.073 -4.994 -4.214
105 H GLU 16 H GLU 16 0.716 -1.527 3.116
106 HA GLU 16 HA GLU 16 1.321 -4.480 3.391
107 HB2 GLU 16 HB2 GLU 16 3.014 -1.993 4.024
108 HB3 GLU 16 HB3 GLU 16 3.251 -3.488 4.957
109 HG2 GLU 16 HG2 GLU 16 3.956 -4.776 3.096
110 HG3 GLU 16 HG3 GLU 16 3.455 -3.519 1.941
111 H ILE 17 H ILE 17 1.284 -5.216 5.670
112 HA ILE 17 HA ILE 17 -0.084 -3.304 7.516
113 HB ILE 17 HB ILE 17 -0.379 -5.062 9.107
114 HG12 ILE 17 HG12 ILE 17 0.975 -7.033 7.150
115 HG13 ILE 17 HG13 ILE 17 1.678 -6.426 8.671
116 HG21 ILE 17 HG21 ILE 17 -2.132 -6.336 7.906
117 HG22 ILE 17 HG22 ILE 17 -2.069 -4.699 7.233
118 HG23 ILE 17 HG23 ILE 17 -1.304 -6.053 6.346
119 HD11 ILE 17 HD11 ILE 17 -0.250 -7.461 9.952
120 HD12 ILE 17 HD12 ILE 17 -0.808 -8.220 8.428
121 HD13 ILE 17 HD13 ILE 17 0.789 -8.631 9.090
122 H GLN 18 H GLN 18 1.145 -2.460 9.349
123 HA GLN 18 HA GLN 18 3.986 -3.348 9.503
124 HB2 GLN 18 HB2 GLN 18 3.102 -0.453 8.921
125 HB3 GLN 18 HB3 GLN 18 4.781 -0.996 9.198
126 HG2 GLN 18 HG2 GLN 18 4.601 -2.479 7.137
127 HG3 GLN 18 HG3 GLN 18 2.987 -1.785 6.815
128 HE21 GLN 18 HE21 GLN 18 2.852 0.701 6.545
129 HE22 GLN 18 HE22 GLN 18 4.209 1.447 5.785
130 H GLY 19 H GLY 19 5.124 -2.245 11.433
131 HA2 GLY 19 HA3 GLY 19 3.354 -2.411 13.715
132 HA3 GLY 19 HA2 GLY 19 5.042 -1.838 13.743
Start of MODEL 2
1 H1 GLY 1 H GLY 1 2.661 -1.567 1.024
2 HA2 GLY 1 HA3 GLY 1 3.749 -1.211 -1.426
3 HA3 GLY 1 HA2 GLY 1 5.225 -1.334 -0.442
4 H ALA 2 H ALA 2 2.046 -3.228 -0.452
5 HA ALA 2 HA ALA 2 3.397 -5.523 -1.636
6 HB1 ALA 2 HB1 ALA 2 3.025 -7.055 0.321
7 HB2 ALA 2 HB2 ALA 2 4.067 -5.706 0.798
8 HB3 ALA 2 HB3 ALA 2 2.326 -5.700 1.248
9 H PHE 3 H PHE 3 1.494 -7.490 -1.354
10 HA PHE 3 HA PHE 3 -0.451 -6.413 -3.088
11 HB2 PHE 3 HB2 PHE 3 -0.681 -9.035 -1.503
12 HB3 PHE 3 HB3 PHE 3 -1.555 -8.641 -3.003
13 HD1 PHE 3 HD2 PHE 3 -0.047 -7.916 -5.074
14 HD2 PHE 3 HD1 PHE 3 1.394 -10.255 -1.758
15 HE1 PHE 3 HE2 PHE 3 1.914 -8.613 -6.412
16 HE2 PHE 3 HE1 PHE 3 3.334 -10.970 -3.110
17 HZ PHE 3 HZ PHE 3 3.618 -10.131 -5.430
18 H VAL 4 H VAL 4 -0.623 -6.742 0.535
19 HA VAL 4 HA VAL 4 -3.243 -5.391 0.390
20 HB VAL 4 HB VAL 4 -3.808 -7.765 -0.016
21 HG11 VAL 4 HG11 VAL 4 -3.382 -9.533 1.700
22 HG12 VAL 4 HG12 VAL 4 -1.850 -8.876 1.076
23 HG13 VAL 4 HG13 VAL 4 -2.448 -8.376 2.686
24 HG21 VAL 4 HG21 VAL 4 -5.495 -8.088 1.757
25 HG22 VAL 4 HG22 VAL 4 -4.645 -6.963 2.843
26 HG23 VAL 4 HG23 VAL 4 -5.407 -6.358 1.339
27 H GLY 5 H GLY 5 -3.979 -4.525 2.508
28 HA2 GLY 5 HA3 GLY 5 -3.184 -5.011 4.958
29 HA3 GLY 5 HA2 GLY 5 -1.686 -4.241 4.388
30 H GLN 6 H GLN 6 -1.650 -1.884 4.353
31 HA GLN 6 HA GLN 6 -4.217 -0.436 4.393
32 HB2 GLN 6 HB2 GLN 6 -3.856 0.478 6.704
33 HB3 GLN 6 HB3 GLN 6 -3.901 -1.279 6.740
34 HG2 GLN 6 HG2 GLN 6 -2.116 -0.397 8.204
35 HG3 GLN 6 HG3 GLN 6 -1.459 -1.400 6.905
36 HE21 GLN 6 HE21 GLN 6 -2.290 2.148 7.538
37 HE22 GLN 6 HE22 GLN 6 -0.846 2.739 6.809
38 HA PRO 7 HA PRO 7 -1.910 2.344 2.059
39 HB2 PRO 7 HB2 PRO 7 -2.059 4.914 3.306
40 HB3 PRO 7 HB3 PRO 7 -3.344 4.193 2.297
41 HG2 PRO 7 HG2 PRO 7 -3.108 3.988 5.327
42 HG3 PRO 7 HG3 PRO 7 -4.537 4.519 4.383
43 HD2 PRO 7 HD2 PRO 7 -4.498 1.991 5.218
44 HD3 PRO 7 HD3 PRO 7 -4.803 2.187 3.460
45 H GLU 8 H GLU 8 0.406 2.480 1.877
46 HA GLU 8 HA GLU 8 1.958 2.178 4.300
47 HB2 GLU 8 HB2 GLU 8 2.810 2.757 1.404
48 HB3 GLU 8 HB3 GLU 8 3.964 2.543 2.746
49 HG2 GLU 8 HG2 GLU 8 3.204 0.257 3.156
50 HG3 GLU 8 HG3 GLU 8 1.826 0.450 2.046
51 H ALA 9 H ALA 9 1.667 4.935 1.859
52 HA ALA 9 HA ALA 9 2.981 6.698 3.836
53 HB1 ALA 9 HB1 ALA 9 1.866 7.352 1.044
54 HB2 ALA 9 HB2 ALA 9 2.763 8.459 2.120
55 HB3 ALA 9 HB3 ALA 9 3.560 6.995 1.470
56 H VAL 10 H VAL 10 -0.215 6.715 2.043
57 HA VAL 10 HA VAL 10 -1.760 7.251 4.327
58 HB VAL 10 HB VAL 10 -0.695 9.395 4.642
59 HG11 VAL 10 HG11 VAL 10 0.181 9.708 2.255
60 HG12 VAL 10 HG12 VAL 10 -1.450 10.307 1.810
61 HG13 VAL 10 HG13 VAL 10 -0.491 11.168 3.029
62 HG21 VAL 10 HG21 VAL 10 -3.449 9.877 3.359
63 HG22 VAL 10 HG22 VAL 10 -3.166 9.288 5.023
64 HG23 VAL 10 HG23 VAL 10 -2.622 10.921 4.546
65 H ASN 11 H ASN 11 -1.494 8.215 0.774
66 HA ASN 11 HA ASN 11 -4.361 7.678 0.449
67 HB2 ASN 11 HB2 ASN 11 -3.157 9.380 -0.932
68 HB3 ASN 11 HB3 ASN 11 -2.119 8.117 -1.623
69 HD21 ASN 11 HD21 ASN 11 -3.364 6.237 -2.846
70 HD22 ASN 11 HD22 ASN 11 -4.739 6.746 -3.745
71 HA PRO 12 HA PRO 12 -3.203 3.263 0.114
72 HB2 PRO 12 HB2 PRO 12 -5.333 2.166 -1.234
73 HB3 PRO 12 HB3 PRO 12 -5.526 2.914 0.378
74 HG2 PRO 12 HG2 PRO 12 -5.962 4.334 -2.303
75 HG3 PRO 12 HG3 PRO 12 -7.182 4.117 -1.005
76 HD2 PRO 12 HD2 PRO 12 -5.744 6.413 -1.087
77 HD3 PRO 12 HD3 PRO 12 -5.899 5.598 0.511
78 H LEU 13 H LEU 13 -1.305 4.244 -1.223
79 HA LEU 13 HA LEU 13 -1.482 3.398 -4.083
80 HB2 LEU 13 HB2 LEU 13 0.918 4.504 -2.528
81 HB3 LEU 13 HB3 LEU 13 0.835 4.200 -4.276
82 HG LEU 13 HG LEU 13 -0.877 6.248 -2.731
83 HD11 LEU 13 HD11 LEU 13 0.598 7.987 -3.765
84 HD12 LEU 13 HD12 LEU 13 1.601 6.705 -4.503
85 HD13 LEU 13 HD13 LEU 13 1.537 6.887 -2.725
86 HD21 LEU 13 HD21 LEU 13 -0.535 5.826 -5.773
87 HD22 LEU 13 HD22 LEU 13 -1.418 7.183 -5.015
88 HD23 LEU 13 HD23 LEU 13 -2.035 5.529 -4.849
89 H GLY 14 H GLY 14 0.532 2.688 -1.052
90 HA2 GLY 14 HA3 GLY 14 1.030 -0.039 -2.203
91 HA3 GLY 14 HA2 GLY 14 2.020 0.808 -1.003
92 H ARG 15 H ARG 15 0.338 -1.862 -0.871
93 HA ARG 15 HA ARG 15 -1.137 -1.135 1.648
94 HB2 ARG 15 HB2 ARG 15 -1.734 -3.414 -0.314
95 HB3 ARG 15 HB3 ARG 15 -2.576 -2.979 1.191
96 HG2 ARG 15 HG2 ARG 15 -3.985 -2.071 -0.424
97 HG3 ARG 15 HG3 ARG 15 -3.051 -0.650 0.090
98 HD2 ARG 15 HD2 ARG 15 -3.295 -0.676 -2.413
99 HD3 ARG 15 HD3 ARG 15 -1.626 -0.865 -1.972
100 HE ARG 15 HE ARG 15 -1.534 -3.004 -2.828
101 HH11 ARG 15 HH11 ARG 15 -5.027 -2.073 -2.535
102 HH12 ARG 15 HH12 ARG 15 -5.532 -3.487 -3.441
103 HH21 ARG 15 HH21 ARG 15 -2.316 -4.769 -3.958
104 HH22 ARG 15 HH22 ARG 15 -4.046 -4.977 -4.228
105 H GLU 16 H GLU 16 0.713 -1.527 3.118
106 HA GLU 16 HA GLU 16 1.308 -4.482 3.392
107 HB2 GLU 16 HB2 GLU 16 3.017 -2.005 4.018
108 HB3 GLU 16 HB3 GLU 16 3.247 -3.497 4.957
109 HG2 GLU 16 HG2 GLU 16 3.940 -4.794 3.093
110 HG3 GLU 16 HG3 GLU 16 3.447 -3.535 1.937
111 H ILE 17 H ILE 17 1.253 -5.221 5.668
112 HA ILE 17 HA ILE 17 -0.103 -3.302 7.512
113 HB ILE 17 HB ILE 17 -0.397 -5.052 9.108
114 HG12 ILE 17 HG12 ILE 17 0.990 -7.022 7.175
115 HG13 ILE 17 HG13 ILE 17 1.667 -6.402 8.705
116 HG21 ILE 17 HG21 ILE 17 -2.079 -4.713 7.225
117 HG22 ILE 17 HG22 ILE 17 -1.302 -6.067 6.348
118 HG23 ILE 17 HG23 ILE 17 -2.134 -6.347 7.907
119 HD11 ILE 17 HD11 ILE 17 -0.274 -7.449 9.959
120 HD12 ILE 17 HD12 ILE 17 -0.798 -8.221 8.429
121 HD13 ILE 17 HD13 ILE 17 0.791 -8.615 9.122
122 H GLN 18 H GLN 18 1.131 -2.447 9.341
123 HA GLN 18 HA GLN 18 3.977 -3.324 9.485
124 HB2 GLN 18 HB2 GLN 18 3.073 -0.432 8.906
125 HB3 GLN 18 HB3 GLN 18 4.756 -0.968 9.172
126 HG2 GLN 18 HG2 GLN 18 4.571 -2.450 7.111
127 HG3 GLN 18 HG3 GLN 18 2.950 -1.764 6.800
128 HE21 GLN 18 HE21 GLN 18 2.810 0.728 6.551
129 HE22 GLN 18 HE22 GLN 18 4.159 1.475 5.776
130 H GLY 19 H GLY 19 5.120 -2.198 11.404
131 HA2 GLY 19 HA3 GLY 19 3.363 -2.408 13.692
132 HA3 GLY 19 HA2 GLY 19 5.047 -1.819 13.718
Start of MODEL 3
1 H1 GLY 1 H GLY 1 2.601 -1.555 1.031
2 HA2 GLY 1 HA3 GLY 1 3.497 -1.205 -1.491
3 HA3 GLY 1 HA2 GLY 1 5.046 -1.297 -0.625
4 H ALA 2 H ALA 2 2.012 -3.399 -0.129
5 HA ALA 2 HA ALA 2 3.398 -5.577 -1.574
6 HB1 ALA 2 HB1 ALA 2 3.037 -7.125 0.374
7 HB2 ALA 2 HB2 ALA 2 4.048 -5.753 0.853
8 HB3 ALA 2 HB3 ALA 2 2.313 -5.783 1.308
9 H PHE 3 H PHE 3 1.357 -7.549 -1.139
10 HA PHE 3 HA PHE 3 -0.465 -6.396 -3.038
11 HB2 PHE 3 HB2 PHE 3 -0.744 -9.088 -1.610
12 HB3 PHE 3 HB3 PHE 3 -1.484 -8.622 -3.161
13 HD1 PHE 3 HD2 PHE 3 0.189 -7.761 -5.048
14 HD2 PHE 3 HD1 PHE 3 1.368 -10.265 -1.750
15 HE1 PHE 3 HE2 PHE 3 2.302 -8.305 -6.211
16 HE2 PHE 3 HE1 PHE 3 3.465 -10.824 -2.929
17 HZ PHE 3 HZ PHE 3 3.958 -9.820 -5.146
18 H VAL 4 H VAL 4 -0.718 -6.794 0.556
19 HA VAL 4 HA VAL 4 -3.338 -5.465 0.378
20 HB VAL 4 HB VAL 4 -3.931 -7.820 -0.031
21 HG11 VAL 4 HG11 VAL 4 -1.962 -8.964 1.008
22 HG12 VAL 4 HG12 VAL 4 -2.528 -8.483 2.635
23 HG13 VAL 4 HG13 VAL 4 -3.488 -9.619 1.649
24 HG21 VAL 4 HG21 VAL 4 -4.712 -7.044 2.850
25 HG22 VAL 4 HG22 VAL 4 -5.504 -6.427 1.367
26 HG23 VAL 4 HG23 VAL 4 -5.590 -8.160 1.774
27 H GLY 5 H GLY 5 -4.049 -4.551 2.484
28 HA2 GLY 5 HA3 GLY 5 -3.226 -5.014 4.943
29 HA3 GLY 5 HA2 GLY 5 -1.730 -4.264 4.333
30 H GLN 6 H GLN 6 -1.680 -1.911 4.291
31 HA GLN 6 HA GLN 6 -4.237 -0.448 4.448
32 HB2 GLN 6 HB2 GLN 6 -3.815 0.362 6.784
33 HB3 GLN 6 HB3 GLN 6 -3.795 -1.391 6.757
34 HG2 GLN 6 HG2 GLN 6 -1.977 -0.530 8.163
35 HG3 GLN 6 HG3 GLN 6 -1.347 -1.430 6.776
36 HE21 GLN 6 HE21 GLN 6 -2.273 2.045 7.623
37 HE22 GLN 6 HE22 GLN 6 -0.887 2.727 6.861
38 HA PRO 7 HA PRO 7 -1.996 2.364 2.110
39 HB2 PRO 7 HB2 PRO 7 -2.124 4.938 3.321
40 HB3 PRO 7 HB3 PRO 7 -3.459 4.179 2.412
41 HG2 PRO 7 HG2 PRO 7 -3.030 4.004 5.430
42 HG3 PRO 7 HG3 PRO 7 -4.516 4.532 4.577
43 HD2 PRO 7 HD2 PRO 7 -4.388 2.009 5.429
44 HD3 PRO 7 HD3 PRO 7 -4.847 2.196 3.701
45 H GLU 8 H GLU 8 0.314 2.594 1.846
46 HA GLU 8 HA GLU 8 1.944 2.219 4.222
47 HB2 GLU 8 HB2 GLU 8 2.708 2.830 1.312
48 HB3 GLU 8 HB3 GLU 8 3.896 2.579 2.620
49 HG2 GLU 8 HG2 GLU 8 3.082 0.299 3.030
50 HG3 GLU 8 HG3 GLU 8 1.705 0.538 1.928
51 H ALA 9 H ALA 9 1.631 5.025 1.830
52 HA ALA 9 HA ALA 9 2.940 6.745 3.857
53 HB1 ALA 9 HB1 ALA 9 2.761 8.539 2.171
54 HB2 ALA 9 HB2 ALA 9 3.568 7.085 1.513
55 HB3 ALA 9 HB3 ALA 9 1.886 7.454 1.056
56 H VAL 10 H VAL 10 -0.222 6.830 2.000
57 HA VAL 10 HA VAL 10 -1.796 7.309 4.282
58 HB VAL 10 HB VAL 10 -0.739 9.442 4.651
59 HG11 VAL 10 HG11 VAL 10 -1.445 10.421 1.828
60 HG12 VAL 10 HG12 VAL 10 -0.498 11.245 3.079
61 HG13 VAL 10 HG13 VAL 10 0.175 9.800 2.281
62 HG21 VAL 10 HG21 VAL 10 -2.663 10.976 4.550
63 HG22 VAL 10 HG22 VAL 10 -3.469 9.955 3.331
64 HG23 VAL 10 HG23 VAL 10 -3.217 9.338 4.989
65 H ASN 11 H ASN 11 -1.506 8.358 0.754
66 HA ASN 11 HA ASN 11 -4.360 7.862 0.378
67 HB2 ASN 11 HB2 ASN 11 -3.089 9.489 -1.024
68 HB3 ASN 11 HB3 ASN 11 -2.065 8.186 -1.657
69 HD21 ASN 11 HD21 ASN 11 -3.315 6.309 -2.870
70 HD22 ASN 11 HD22 ASN 11 -4.657 6.821 -3.814
71 HA PRO 12 HA PRO 12 -3.326 3.413 0.149
72 HB2 PRO 12 HB2 PRO 12 -5.480 2.341 -1.190
73 HB3 PRO 12 HB3 PRO 12 -5.668 3.145 0.396
74 HG2 PRO 12 HG2 PRO 12 -6.023 4.498 -2.334
75 HG3 PRO 12 HG3 PRO 12 -7.269 4.356 -1.050
76 HD2 PRO 12 HD2 PRO 12 -5.754 6.602 -1.174
77 HD3 PRO 12 HD3 PRO 12 -5.966 5.840 0.442
78 H LEU 13 H LEU 13 -1.407 4.372 -1.232
79 HA LEU 13 HA LEU 13 -1.587 3.470 -4.064
80 HB2 LEU 13 HB2 LEU 13 0.850 4.473 -2.486
81 HB3 LEU 13 HB3 LEU 13 0.784 4.137 -4.229
82 HG LEU 13 HG LEU 13 -0.833 6.313 -2.762
83 HD11 LEU 13 HD11 LEU 13 1.613 6.805 -2.712
84 HD12 LEU 13 HD12 LEU 13 0.770 7.937 -3.797
85 HD13 LEU 13 HD13 LEU 13 1.707 6.578 -4.482
86 HD21 LEU 13 HD21 LEU 13 -0.451 5.804 -5.786
87 HD22 LEU 13 HD22 LEU 13 -1.264 7.230 -5.081
88 HD23 LEU 13 HD23 LEU 13 -1.988 5.621 -4.896
89 H GLY 14 H GLY 14 0.316 2.703 -0.984
90 HA2 GLY 14 HA3 GLY 14 0.851 0.002 -2.168
91 HA3 GLY 14 HA2 GLY 14 1.815 0.841 -0.946
92 H ARG 15 H ARG 15 0.548 -1.845 -0.694
93 HA ARG 15 HA ARG 15 -1.184 -1.281 1.697
94 HB2 ARG 15 HB2 ARG 15 -1.554 -3.580 -0.315
95 HB3 ARG 15 HB3 ARG 15 -2.526 -3.151 1.111
96 HG2 ARG 15 HG2 ARG 15 -3.852 -2.278 -0.582
97 HG3 ARG 15 HG3 ARG 15 -2.918 -0.837 -0.123
98 HD2 ARG 15 HD2 ARG 15 -2.971 -0.943 -2.598
99 HD3 ARG 15 HD3 ARG 15 -1.357 -1.347 -2.102
100 HE ARG 15 HE ARG 15 -1.542 -3.511 -2.865
101 HH11 ARG 15 HH11 ARG 15 -4.873 -2.082 -2.726
102 HH12 ARG 15 HH12 ARG 15 -5.540 -3.421 -3.643
103 HH21 ARG 15 HH21 ARG 15 -2.527 -5.163 -4.011
104 HH22 ARG 15 HH22 ARG 15 -4.257 -5.126 -4.347
105 H GLU 16 H GLU 16 0.781 -1.527 3.123
106 HA GLU 16 HA GLU 16 1.466 -4.457 3.457
107 HB2 GLU 16 HB2 GLU 16 3.116 -1.930 4.001
108 HB3 GLU 16 HB3 GLU 16 3.412 -3.414 4.935
109 HG2 GLU 16 HG2 GLU 16 4.116 -4.694 3.079
110 HG3 GLU 16 HG3 GLU 16 3.510 -3.499 1.913
111 H ILE 17 H ILE 17 1.141 -5.247 5.650
112 HA ILE 17 HA ILE 17 -0.049 -3.296 7.548
113 HB ILE 17 HB ILE 17 -0.204 -5.107 9.182
114 HG12 ILE 17 HG12 ILE 17 0.543 -7.102 6.943
115 HG13 ILE 17 HG13 ILE 17 1.664 -6.588 8.230
116 HG21 ILE 17 HG21 ILE 17 -2.207 -6.167 8.165
117 HG22 ILE 17 HG22 ILE 17 -2.117 -4.490 7.603
118 HG23 ILE 17 HG23 ILE 17 -1.582 -5.814 6.529
119 HD11 ILE 17 HD11 ILE 17 -0.980 -8.111 8.660
120 HD12 ILE 17 HD12 ILE 17 0.674 -8.739 8.827
121 HD13 ILE 17 HD13 ILE 17 0.081 -7.498 9.965
122 H GLN 18 H GLN 18 1.166 -2.507 9.394
123 HA GLN 18 HA GLN 18 3.966 -3.470 9.645
124 HB2 GLN 18 HB2 GLN 18 3.199 -0.552 8.969
125 HB3 GLN 18 HB3 GLN 18 4.840 -1.124 9.381
126 HG2 GLN 18 HG2 GLN 18 4.805 -2.627 7.336
127 HG3 GLN 18 HG3 GLN 18 3.216 -1.942 6.896
128 HE21 GLN 18 HE21 GLN 18 3.077 0.440 6.363
129 HE22 GLN 18 HE22 GLN 18 4.502 1.206 5.768
130 H GLY 19 H GLY 19 5.059 -2.374 11.613
131 HA2 GLY 19 HA3 GLY 19 3.196 -2.450 13.817
132 HA3 GLY 19 HA2 GLY 19 4.890 -1.901 13.904
Start of MODEL 4
1 H1 GLY 1 H GLY 1 2.637 -1.573 1.042
2 HA2 GLY 1 HA3 GLY 1 3.641 -1.214 -1.444
3 HA3 GLY 1 HA2 GLY 1 5.148 -1.318 -0.507
4 H ALA 2 H ALA 2 2.031 -3.323 -0.278
5 HA ALA 2 HA ALA 2 3.411 -5.547 -1.607
6 HB1 ALA 2 HB1 ALA 2 4.083 -5.732 0.818
7 HB2 ALA 2 HB2 ALA 2 2.346 -5.762 1.279
8 HB3 ALA 2 HB3 ALA 2 3.067 -7.101 0.342
9 H PHE 3 H PHE 3 1.447 -7.534 -1.243
10 HA PHE 3 HA PHE 3 -0.444 -6.415 -3.054
11 HB2 PHE 3 HB2 PHE 3 -0.698 -9.074 -1.547
12 HB3 PHE 3 HB3 PHE 3 -1.513 -8.642 -3.070
13 HD1 PHE 3 HD2 PHE 3 0.073 -7.851 -5.058
14 HD2 PHE 3 HD1 PHE 3 1.392 -10.275 -1.752
15 HE1 PHE 3 HE2 PHE 3 2.109 -8.473 -6.320
16 HE2 PHE 3 HE1 PHE 3 3.408 -10.915 -3.028
17 HZ PHE 3 HZ PHE 3 3.792 -9.991 -5.302
18 H VAL 4 H VAL 4 -0.648 -6.760 0.556
19 HA VAL 4 HA VAL 4 -3.265 -5.418 0.391
20 HB VAL 4 HB VAL 4 -3.848 -7.784 -0.008
21 HG11 VAL 4 HG11 VAL 4 -1.889 -8.910 1.068
22 HG12 VAL 4 HG12 VAL 4 -2.476 -8.411 2.682
23 HG13 VAL 4 HG13 VAL 4 -3.421 -9.561 1.699
24 HG21 VAL 4 HG21 VAL 4 -5.435 -6.374 1.358
25 HG22 VAL 4 HG22 VAL 4 -5.528 -8.104 1.777
26 HG23 VAL 4 HG23 VAL 4 -4.664 -6.980 2.857
27 H GLY 5 H GLY 5 -3.992 -4.527 2.505
28 HA2 GLY 5 HA3 GLY 5 -3.176 -5.000 4.958
29 HA3 GLY 5 HA2 GLY 5 -1.685 -4.230 4.366
30 H GLN 6 H GLN 6 -1.661 -1.876 4.325
31 HA GLN 6 HA GLN 6 -4.231 -0.438 4.413
32 HB2 GLN 6 HB2 GLN 6 -3.846 0.442 6.734
33 HB3 GLN 6 HB3 GLN 6 -3.858 -1.314 6.750
34 HG2 GLN 6 HG2 GLN 6 -2.063 -0.437 8.187
35 HG3 GLN 6 HG3 GLN 6 -1.416 -1.400 6.852
36 HE21 GLN 6 HE21 GLN 6 -2.288 2.119 7.572
37 HE22 GLN 6 HE22 GLN 6 -0.872 2.749 6.823
38 HA PRO 7 HA PRO 7 -1.964 2.368 2.079
39 HB2 PRO 7 HB2 PRO 7 -2.101 4.943 3.315
40 HB3 PRO 7 HB3 PRO 7 -3.407 4.206 2.349
41 HG2 PRO 7 HG2 PRO 7 -3.091 4.001 5.378
42 HG3 PRO 7 HG3 PRO 7 -4.544 4.537 4.474
43 HD2 PRO 7 HD2 PRO 7 -4.464 2.008 5.305
44 HD3 PRO 7 HD3 PRO 7 -4.836 2.205 3.559
45 H GLU 8 H GLU 8 0.353 2.529 1.864
46 HA GLU 8 HA GLU 8 1.937 2.196 4.268
47 HB2 GLU 8 HB2 GLU 8 2.755 2.790 1.368
48 HB3 GLU 8 HB3 GLU 8 3.921 2.551 2.697
49 HG2 GLU 8 HG2 GLU 8 3.122 0.270 3.100
50 HG3 GLU 8 HG3 GLU 8 1.755 0.489 1.982
51 H ALA 9 H ALA 9 1.641 4.974 1.847
52 HA ALA 9 HA ALA 9 2.961 6.716 3.841
53 HB1 ALA 9 HB1 ALA 9 2.763 8.490 2.137
54 HB2 ALA 9 HB2 ALA 9 3.559 7.028 1.483
55 HB3 ALA 9 HB3 ALA 9 1.871 7.394 1.046
56 H VAL 10 H VAL 10 -0.223 6.772 2.025
57 HA VAL 10 HA VAL 10 -1.775 7.287 4.310
58 HB VAL 10 HB VAL 10 -0.707 9.424 4.648
59 HG11 VAL 10 HG11 VAL 10 -0.486 11.211 3.053
60 HG12 VAL 10 HG12 VAL 10 0.181 9.757 2.267
61 HG13 VAL 10 HG13 VAL 10 -1.444 10.368 1.822
62 HG21 VAL 10 HG21 VAL 10 -3.452 9.926 3.356
63 HG22 VAL 10 HG22 VAL 10 -3.181 9.324 5.016
64 HG23 VAL 10 HG23 VAL 10 -2.630 10.958 4.555
65 H ASN 11 H ASN 11 -1.501 8.290 0.768
66 HA ASN 11 HA ASN 11 -4.362 7.770 0.424
67 HB2 ASN 11 HB2 ASN 11 -3.133 9.441 -0.970
68 HB3 ASN 11 HB3 ASN 11 -2.100 8.162 -1.635
69 HD21 ASN 11 HD21 ASN 11 -3.344 6.280 -2.851
70 HD22 ASN 11 HD22 ASN 11 -4.707 6.788 -3.768
71 HA PRO 12 HA PRO 12 -3.254 3.342 0.135
72 HB2 PRO 12 HB2 PRO 12 -5.396 2.252 -1.206
73 HB3 PRO 12 HB3 PRO 12 -5.584 3.025 0.395
74 HG2 PRO 12 HG2 PRO 12 -5.993 4.417 -2.306
75 HG3 PRO 12 HG3 PRO 12 -7.222 4.230 -1.012
76 HD2 PRO 12 HD2 PRO 12 -5.751 6.506 -1.116
77 HD3 PRO 12 HD3 PRO 12 -5.928 5.715 0.491
78 H LEU 13 H LEU 13 -1.349 4.311 -1.222
79 HA LEU 13 HA LEU 13 -1.530 3.446 -4.070
80 HB2 LEU 13 HB2 LEU 13 0.889 4.506 -2.507
81 HB3 LEU 13 HB3 LEU 13 0.811 4.190 -4.254
82 HG LEU 13 HG LEU 13 -0.860 6.291 -2.736
83 HD11 LEU 13 HD11 LEU 13 1.570 6.867 -2.708
84 HD12 LEU 13 HD12 LEU 13 0.671 7.983 -3.765
85 HD13 LEU 13 HD13 LEU 13 1.649 6.670 -4.482
86 HD21 LEU 13 HD21 LEU 13 -0.497 5.842 -5.771
87 HD22 LEU 13 HD22 LEU 13 -1.352 7.226 -5.032
88 HD23 LEU 13 HD23 LEU 13 -2.015 5.589 -4.865
89 H GLY 14 H GLY 14 0.443 2.705 -1.024
90 HA2 GLY 14 HA3 GLY 14 0.953 -0.007 -2.197
91 HA3 GLY 14 HA2 GLY 14 1.932 0.830 -0.982
92 H ARG 15 H ARG 15 0.455 -1.856 -0.802
93 HA ARG 15 HA ARG 15 -1.147 -1.205 1.661
94 HB2 ARG 15 HB2 ARG 15 -1.643 -3.491 -0.330
95 HB3 ARG 15 HB3 ARG 15 -2.547 -3.054 1.138
96 HG2 ARG 15 HG2 ARG 15 -3.914 -2.151 -0.508
97 HG3 ARG 15 HG3 ARG 15 -2.963 -0.725 -0.039
98 HD2 ARG 15 HD2 ARG 15 -3.137 -0.810 -2.526
99 HD3 ARG 15 HD3 ARG 15 -1.487 -1.105 -2.069
100 HE ARG 15 HE ARG 15 -1.542 -3.270 -2.859
101 HH11 ARG 15 HH11 ARG 15 -4.962 -2.080 -2.626
102 HH12 ARG 15 HH12 ARG 15 -5.558 -3.469 -3.515
103 HH21 ARG 15 HH21 ARG 15 -2.440 -4.993 -3.968
104 HH22 ARG 15 HH22 ARG 15 -4.177 -5.079 -4.255
105 H GLU 16 H GLU 16 0.741 -1.539 3.119
106 HA GLU 16 HA GLU 16 1.366 -4.485 3.416
107 HB2 GLU 16 HB2 GLU 16 3.055 -1.990 4.018
108 HB3 GLU 16 HB3 GLU 16 3.306 -3.480 4.955
109 HG2 GLU 16 HG2 GLU 16 4.013 -4.768 3.096
110 HG3 GLU 16 HG3 GLU 16 3.470 -3.539 1.933
111 H ILE 17 H ILE 17 1.185 -5.251 5.657
112 HA ILE 17 HA ILE 17 -0.102 -3.310 7.517
113 HB ILE 17 HB ILE 17 -0.365 -5.066 9.129
114 HG12 ILE 17 HG12 ILE 17 0.846 -7.072 7.116
115 HG13 ILE 17 HG13 ILE 17 1.659 -6.466 8.581
116 HG21 ILE 17 HG21 ILE 17 -2.183 -6.297 7.978
117 HG22 ILE 17 HG22 ILE 17 -2.110 -4.660 7.305
118 HG23 ILE 17 HG23 ILE 17 -1.397 -6.026 6.395
119 HD11 ILE 17 HD11 ILE 17 -0.889 -8.189 8.527
120 HD12 ILE 17 HD12 ILE 17 0.739 -8.654 9.068
121 HD13 ILE 17 HD13 ILE 17 -0.189 -7.445 9.999
122 H GLN 18 H GLN 18 1.124 -2.502 9.373
123 HA GLN 18 HA GLN 18 3.952 -3.413 9.548
124 HB2 GLN 18 HB2 GLN 18 3.106 -0.503 8.958
125 HB3 GLN 18 HB3 GLN 18 4.772 -1.058 9.283
126 HG2 GLN 18 HG2 GLN 18 4.653 -2.528 7.211
127 HG3 GLN 18 HG3 GLN 18 3.048 -1.835 6.847
128 HE21 GLN 18 HE21 GLN 18 2.911 0.629 6.530
129 HE22 GLN 18 HE22 GLN 18 4.297 1.383 5.833
130 H GLY 19 H GLY 19 5.076 -2.341 11.501
131 HA2 GLY 19 HA3 GLY 19 3.270 -2.493 13.755
132 HA3 GLY 19 HA2 GLY 19 4.965 -1.943 13.810
Start of MODEL 5
1 H1 GLY 1 H GLY 1 2.658 -1.548 1.010
2 HA2 GLY 1 HA3 GLY 1 3.732 -1.199 -1.448
3 HA3 GLY 1 HA2 GLY 1 5.216 -1.336 -0.475
4 H ALA 2 H ALA 2 2.051 -3.227 -0.442
5 HA ALA 2 HA ALA 2 3.397 -5.513 -1.644
6 HB1 ALA 2 HB1 ALA 2 4.079 -5.691 0.787
7 HB2 ALA 2 HB2 ALA 2 2.344 -5.691 1.256
8 HB3 ALA 2 HB3 ALA 2 3.038 -7.047 0.327
9 H PHE 3 H PHE 3 1.488 -7.494 -1.328
10 HA PHE 3 HA PHE 3 -0.466 -6.422 -3.074
11 HB2 PHE 3 HB2 PHE 3 -0.676 -9.040 -1.489
12 HB3 PHE 3 HB3 PHE 3 -1.545 -8.634 -2.992
13 HD1 PHE 3 HD1 PHE 3 -0.047 -7.910 -5.059
14 HD2 PHE 3 HD2 PHE 3 1.397 -10.253 -1.745
15 HE1 PHE 3 HE1 PHE 3 1.921 -8.595 -6.395
16 HE2 PHE 3 HE2 PHE 3 3.343 -10.957 -3.093
17 HZ PHE 3 HZ PHE 3 3.629 -10.109 -5.411
18 H VAL 4 H VAL 4 -0.625 -6.750 0.553
19 HA VAL 4 HA VAL 4 -3.243 -5.398 0.409
20 HB VAL 4 HB VAL 4 -3.813 -7.775 0.010
21 HG11 VAL 4 HG11 VAL 4 -2.442 -8.386 2.705
22 HG12 VAL 4 HG12 VAL 4 -3.380 -9.542 1.722
23 HG13 VAL 4 HG13 VAL 4 -1.849 -8.886 1.094
24 HG21 VAL 4 HG21 VAL 4 -5.493 -8.097 1.788
25 HG22 VAL 4 HG22 VAL 4 -4.638 -6.970 2.871
26 HG23 VAL 4 HG23 VAL 4 -5.407 -6.366 1.370
27 H GLY 5 H GLY 5 -3.973 -4.528 2.527
28 HA2 GLY 5 HA3 GLY 5 -3.177 -5.014 4.978
29 HA3 GLY 5 HA2 GLY 5 -1.678 -4.244 4.409
30 H GLN 6 H GLN 6 -1.634 -1.888 4.359
31 HA GLN 6 HA GLN 6 -4.199 -0.446 4.422
32 HB2 GLN 6 HB2 GLN 6 -3.815 0.476 6.736
33 HB3 GLN 6 HB3 GLN 6 -3.858 -1.281 6.763
34 HG2 GLN 6 HG2 GLN 6 -2.064 -0.403 8.219
35 HG3 GLN 6 HG3 GLN 6 -1.415 -1.402 6.914
36 HE21 GLN 6 HE21 GLN 6 -2.238 2.142 7.551
37 HE22 GLN 6 HE22 GLN 6 -0.803 2.737 6.811
38 HA PRO 7 HA PRO 7 -1.912 2.341 2.066
39 HB2 PRO 7 HB2 PRO 7 -2.057 4.915 3.303
40 HB3 PRO 7 HB3 PRO 7 -3.346 4.185 2.310
41 HG2 PRO 7 HG2 PRO 7 -3.082 3.983 5.346
42 HG3 PRO 7 HG3 PRO 7 -4.519 4.517 4.414
43 HD2 PRO 7 HD2 PRO 7 -4.466 1.995 5.258
44 HD3 PRO 7 HD3 PRO 7 -4.789 2.185 3.500
45 H GLU 8 H GLU 8 0.406 2.496 1.868
46 HA GLU 8 HA GLU 8 1.978 2.187 4.283
47 HB2 GLU 8 HB2 GLU 8 2.807 2.770 1.386
48 HB3 GLU 8 HB3 GLU 8 3.966 2.552 2.726
49 HG2 GLU 8 HG2 GLU 8 3.204 0.267 3.136
50 HG3 GLU 8 HG3 GLU 8 1.826 0.465 2.030
51 H ALA 9 H ALA 9 1.670 4.950 1.847
52 HA ALA 9 HA ALA 9 2.986 6.711 3.824
53 HB1 ALA 9 HB1 ALA 9 2.760 8.474 2.113
54 HB2 ALA 9 HB2 ALA 9 3.558 7.013 1.457
55 HB3 ALA 9 HB3 ALA 9 1.863 7.368 1.036
56 H VAL 10 H VAL 10 -0.216 6.723 2.039
57 HA VAL 10 HA VAL 10 -1.756 7.251 4.328
58 HB VAL 10 HB VAL 10 -0.697 9.393 4.647
59 HG11 VAL 10 HG11 VAL 10 -0.500 11.174 3.035
60 HG12 VAL 10 HG12 VAL 10 0.174 9.718 2.258
61 HG13 VAL 10 HG13 VAL 10 -1.458 10.313 1.816
62 HG21 VAL 10 HG21 VAL 10 -3.452 9.874 3.369
63 HG22 VAL 10 HG22 VAL 10 -3.166 9.283 5.030
64 HG23 VAL 10 HG23 VAL 10 -2.629 10.917 4.557
65 H ASN 11 H ASN 11 -1.501 8.224 0.777
66 HA ASN 11 HA ASN 11 -4.365 7.688 0.457
67 HB2 ASN 11 HB2 ASN 11 -3.164 9.382 -0.932
68 HB3 ASN 11 HB3 ASN 11 -2.126 8.117 -1.620
69 HD21 ASN 11 HD21 ASN 11 -3.377 6.238 -2.837
70 HD22 ASN 11 HD22 ASN 11 -4.752 6.747 -3.736
71 HA PRO 12 HA PRO 12 -3.217 3.269 0.127
72 HB2 PRO 12 HB2 PRO 12 -5.355 2.174 -1.216
73 HB3 PRO 12 HB3 PRO 12 -5.542 2.926 0.396
74 HG2 PRO 12 HG2 PRO 12 -5.981 4.343 -2.288
75 HG3 PRO 12 HG3 PRO 12 -7.199 4.131 -0.987
76 HD2 PRO 12 HD2 PRO 12 -5.756 6.422 -1.077
77 HD3 PRO 12 HD3 PRO 12 -5.907 5.610 0.524
78 H LEU 13 H LEU 13 -1.322 4.245 -1.218
79 HA LEU 13 HA LEU 13 -1.507 3.390 -4.074
80 HB2 LEU 13 HB2 LEU 13 0.903 4.501 -2.527
81 HB3 LEU 13 HB3 LEU 13 0.813 4.189 -4.273
82 HG LEU 13 HG LEU 13 -0.886 6.247 -2.726
83 HD11 LEU 13 HD11 LEU 13 0.588 7.979 -3.764
84 HD12 LEU 13 HD12 LEU 13 1.586 6.691 -4.503
85 HD13 LEU 13 HD13 LEU 13 1.524 6.876 -2.725
86 HD21 LEU 13 HD21 LEU 13 -2.055 5.529 -4.847
87 HD22 LEU 13 HD22 LEU 13 -0.555 5.820 -5.770
88 HD23 LEU 13 HD23 LEU 13 -1.430 7.181 -5.013
89 H GLY 14 H GLY 14 0.509 2.682 -1.049
90 HA2 GLY 14 HA3 GLY 14 1.007 -0.040 -2.211
91 HA3 GLY 14 HA2 GLY 14 1.997 0.803 -1.007
92 H ARG 15 H ARG 15 0.335 -1.872 -0.870
93 HA ARG 15 HA ARG 15 -1.138 -1.156 1.654
94 HB2 ARG 15 HB2 ARG 15 -1.738 -3.435 -0.320
95 HB3 ARG 15 HB3 ARG 15 -2.577 -3.001 1.187
96 HG2 ARG 15 HG2 ARG 15 -3.987 -2.093 -0.428
97 HG3 ARG 15 HG3 ARG 15 -3.047 -0.670 0.075
98 HD2 ARG 15 HD2 ARG 15 -3.295 -0.701 -2.421
99 HD3 ARG 15 HD3 ARG 15 -1.627 -0.898 -1.981
100 HE ARG 15 HE ARG 15 -1.547 -3.043 -2.830
101 HH11 ARG 15 HH11 ARG 15 -5.035 -2.092 -2.536
102 HH12 ARG 15 HH12 ARG 15 -5.548 -3.506 -3.439
103 HH21 ARG 15 HH21 ARG 15 -2.340 -4.806 -3.956
104 HH22 ARG 15 HH22 ARG 15 -4.071 -5.005 -4.223
105 H GLU 16 H GLU 16 0.736 -1.534 3.097
106 HA GLU 16 HA GLU 16 1.348 -4.484 3.367
107 HB2 GLU 16 HB2 GLU 16 3.026 -1.992 4.015
108 HB3 GLU 16 HB3 GLU 16 3.270 -3.486 4.945
109 HG2 GLU 16 HG2 GLU 16 3.992 -4.764 3.078
110 HG3 GLU 16 HG3 GLU 16 3.481 -3.511 1.923
111 H ILE 17 H ILE 17 1.292 -5.237 5.642
112 HA ILE 17 HA ILE 17 -0.116 -3.355 7.482
113 HB ILE 17 HB ILE 17 -0.356 -5.111 9.079
114 HG12 ILE 17 HG12 ILE 17 1.058 -7.049 7.131
115 HG13 ILE 17 HG13 ILE 17 1.729 -6.419 8.657
116 HG21 ILE 17 HG21 ILE 17 -2.072 -6.446 7.873
117 HG22 ILE 17 HG22 ILE 17 -2.055 -4.800 7.220
118 HG23 ILE 17 HG23 ILE 17 -1.258 -6.122 6.312
119 HD11 ILE 17 HD11 ILE 17 -0.698 -8.292 8.388
120 HD12 ILE 17 HD12 ILE 17 0.900 -8.656 9.075
121 HD13 ILE 17 HD13 ILE 17 -0.185 -7.514 9.918
122 H GLN 18 H GLN 18 1.096 -2.458 9.308
123 HA GLN 18 HA GLN 18 3.955 -3.285 9.497
124 HB2 GLN 18 HB2 GLN 18 3.013 -0.407 8.874
125 HB3 GLN 18 HB3 GLN 18 4.697 -0.923 9.171
126 HG2 GLN 18 HG2 GLN 18 4.564 -2.416 7.113
127 HG3 GLN 18 HG3 GLN 18 2.934 -1.764 6.781
128 HE21 GLN 18 HE21 GLN 18 2.773 0.728 6.515
129 HE22 GLN 18 HE22 GLN 18 4.119 1.493 5.752
130 H GLY 19 H GLY 19 5.055 -2.129 11.415
131 HA2 GLY 19 HA3 GLY 19 3.271 -2.339 13.682
132 HA3 GLY 19 HA2 GLY 19 4.949 -1.734 13.721
Start of MODEL 6
1 H1 GLY 1 H GLY 1 2.617 -1.556 1.022
2 HA2 GLY 1 HA3 GLY 1 3.557 -1.202 -1.484
3 HA3 GLY 1 HA2 GLY 1 5.091 -1.308 -0.593
4 H ALA 2 H ALA 2 2.019 -3.365 -0.190
5 HA ALA 2 HA ALA 2 3.391 -5.561 -1.600
6 HB1 ALA 2 HB1 ALA 2 3.051 -7.110 0.353
7 HB2 ALA 2 HB2 ALA 2 4.071 -5.741 0.820
8 HB3 ALA 2 HB3 ALA 2 2.340 -5.768 1.295
9 H PHE 3 H PHE 3 1.389 -7.541 -1.183
10 HA PHE 3 HA PHE 3 -0.477 -6.400 -3.029
11 HB2 PHE 3 HB2 PHE 3 -0.738 -9.079 -1.569
12 HB3 PHE 3 HB3 PHE 3 -1.519 -8.624 -3.105
13 HD1 PHE 3 HD1 PHE 3 0.108 -7.787 -5.042
14 HD2 PHE 3 HD2 PHE 3 1.360 -10.272 -1.755
15 HE1 PHE 3 HE1 PHE 3 2.181 -8.364 -6.263
16 HE2 PHE 3 HE2 PHE 3 3.415 -10.866 -2.992
17 HZ PHE 3 HZ PHE 3 3.851 -9.889 -5.234
18 H VAL 4 H VAL 4 -0.682 -6.776 0.574
19 HA VAL 4 HA VAL 4 -3.303 -5.442 0.421
20 HB VAL 4 HB VAL 4 -3.895 -7.802 0.019
21 HG11 VAL 4 HG11 VAL 4 -3.447 -9.592 1.707
22 HG12 VAL 4 HG12 VAL 4 -1.922 -8.939 1.062
23 HG13 VAL 4 HG13 VAL 4 -2.487 -8.451 2.687
24 HG21 VAL 4 HG21 VAL 4 -5.550 -8.133 1.827
25 HG22 VAL 4 HG22 VAL 4 -4.671 -7.013 2.898
26 HG23 VAL 4 HG23 VAL 4 -5.464 -6.402 1.413
27 H GLY 5 H GLY 5 -4.004 -4.538 2.535
28 HA2 GLY 5 HA3 GLY 5 -3.161 -5.002 4.987
29 HA3 GLY 5 HA2 GLY 5 -1.676 -4.241 4.368
30 H GLN 6 H GLN 6 -1.641 -1.887 4.326
31 HA GLN 6 HA GLN 6 -4.206 -0.441 4.463
32 HB2 GLN 6 HB2 GLN 6 -3.787 0.411 6.790
33 HB3 GLN 6 HB3 GLN 6 -3.783 -1.344 6.788
34 HG2 GLN 6 HG2 GLN 6 -1.971 -0.471 8.194
35 HG3 GLN 6 HG3 GLN 6 -1.336 -1.408 6.835
36 HE21 GLN 6 HE21 GLN 6 -2.228 2.091 7.610
37 HE22 GLN 6 HE22 GLN 6 -0.831 2.744 6.842
38 HA PRO 7 HA PRO 7 -1.973 2.365 2.105
39 HB2 PRO 7 HB2 PRO 7 -2.099 4.944 3.318
40 HB3 PRO 7 HB3 PRO 7 -3.428 4.191 2.396
41 HG2 PRO 7 HG2 PRO 7 -3.029 4.010 5.419
42 HG3 PRO 7 HG3 PRO 7 -4.505 4.540 4.552
43 HD2 PRO 7 HD2 PRO 7 -4.391 2.017 5.401
44 HD3 PRO 7 HD3 PRO 7 -4.824 2.204 3.666
45 H GLU 8 H GLU 8 0.339 2.573 1.848
46 HA GLU 8 HA GLU 8 1.962 2.219 4.230
47 HB2 GLU 8 HB2 GLU 8 2.737 2.818 1.321
48 HB3 GLU 8 HB3 GLU 8 3.919 2.571 2.634
49 HG2 GLU 8 HG2 GLU 8 3.108 0.291 3.045
50 HG3 GLU 8 HG3 GLU 8 1.733 0.525 1.939
51 H ALA 9 H ALA 9 1.642 5.007 1.820
52 HA ALA 9 HA ALA 9 2.966 6.742 3.820
53 HB1 ALA 9 HB1 ALA 9 2.767 8.523 2.123
54 HB2 ALA 9 HB2 ALA 9 3.567 7.064 1.466
55 HB3 ALA 9 HB3 ALA 9 1.879 7.429 1.026
56 H VAL 10 H VAL 10 -0.216 6.807 2.000
57 HA VAL 10 HA VAL 10 -1.769 7.304 4.290
58 HB VAL 10 HB VAL 10 -0.707 9.440 4.638
59 HG11 VAL 10 HG11 VAL 10 -0.487 11.235 3.052
60 HG12 VAL 10 HG12 VAL 10 0.182 9.786 2.257
61 HG13 VAL 10 HG13 VAL 10 -1.444 10.400 1.816
62 HG21 VAL 10 HG21 VAL 10 -3.182 9.335 5.002
63 HG22 VAL 10 HG22 VAL 10 -2.634 10.972 4.549
64 HG23 VAL 10 HG23 VAL 10 -3.452 9.943 3.344
65 H ASN 11 H ASN 11 -1.504 8.329 0.753
66 HA ASN 11 HA ASN 11 -4.362 7.821 0.406
67 HB2 ASN 11 HB2 ASN 11 -3.117 9.464 -1.002
68 HB3 ASN 11 HB3 ASN 11 -2.092 8.170 -1.652
69 HD21 ASN 11 HD21 ASN 11 -3.349 6.287 -2.855
70 HD22 ASN 11 HD22 ASN 11 -4.706 6.798 -3.781
71 HA PRO 12 HA PRO 12 -3.297 3.380 0.156
72 HB2 PRO 12 HB2 PRO 12 -5.454 2.297 -1.168
73 HB3 PRO 12 HB3 PRO 12 -5.632 3.091 0.424
74 HG2 PRO 12 HG2 PRO 12 -6.027 4.455 -2.295
75 HG3 PRO 12 HG3 PRO 12 -7.258 4.297 -0.999
76 HD2 PRO 12 HD2 PRO 12 -5.762 6.556 -1.129
77 HD3 PRO 12 HD3 PRO 12 -5.950 5.785 0.487
78 H LEU 13 H LEU 13 -1.391 4.335 -1.224
79 HA LEU 13 HA LEU 13 -1.590 3.446 -4.062
80 HB2 LEU 13 HB2 LEU 13 0.849 4.477 -2.509
81 HB3 LEU 13 HB3 LEU 13 0.768 4.149 -4.253
82 HG LEU 13 HG LEU 13 -0.866 6.291 -2.755
83 HD11 LEU 13 HD11 LEU 13 1.570 6.822 -2.730
84 HD12 LEU 13 HD12 LEU 13 0.698 7.947 -3.800
85 HD13 LEU 13 HD13 LEU 13 1.649 6.607 -4.503
86 HD21 LEU 13 HD21 LEU 13 -2.033 5.592 -4.879
87 HD22 LEU 13 HD22 LEU 13 -0.510 5.806 -5.787
88 HD23 LEU 13 HD23 LEU 13 -1.339 7.214 -5.063
89 H GLY 14 H GLY 14 0.368 2.695 -1.011
90 HA2 GLY 14 HA3 GLY 14 0.882 -0.013 -2.190
91 HA3 GLY 14 HA2 GLY 14 1.861 0.826 -0.978
92 H ARG 15 H ARG 15 0.491 -1.862 -0.752
93 HA ARG 15 HA ARG 15 -1.159 -1.251 1.686
94 HB2 ARG 15 HB2 ARG 15 -1.613 -3.544 -0.313
95 HB3 ARG 15 HB3 ARG 15 -2.541 -3.106 1.139
96 HG2 ARG 15 HG2 ARG 15 -3.894 -2.214 -0.522
97 HG3 ARG 15 HG3 ARG 15 -2.942 -0.784 -0.069
98 HD2 ARG 15 HD2 ARG 15 -3.074 -0.888 -2.551
99 HD3 ARG 15 HD3 ARG 15 -1.439 -1.242 -2.085
100 HE ARG 15 HE ARG 15 -1.573 -3.410 -2.851
101 HH11 ARG 15 HH11 ARG 15 -4.944 -2.086 -2.647
102 HH12 ARG 15 HH12 ARG 15 -5.588 -3.452 -3.539
103 HH21 ARG 15 HH21 ARG 15 -2.529 -5.099 -3.965
104 HH22 ARG 15 HH22 ARG 15 -4.266 -5.118 -4.264
105 H GLU 16 H GLU 16 0.788 -1.539 3.101
106 HA GLU 16 HA GLU 16 1.452 -4.476 3.413
107 HB2 GLU 16 HB2 GLU 16 3.100 -1.955 4.000
108 HB3 GLU 16 HB3 GLU 16 3.382 -3.444 4.930
109 HG2 GLU 16 HG2 GLU 16 4.102 -4.716 3.067
110 HG3 GLU 16 HG3 GLU 16 3.524 -3.502 1.906
111 H ILE 17 H ILE 17 1.205 -5.266 5.628
112 HA ILE 17 HA ILE 17 -0.069 -3.343 7.507
113 HB ILE 17 HB ILE 17 -0.260 -5.120 9.126
114 HG12 ILE 17 HG12 ILE 17 0.812 -7.115 7.024
115 HG13 ILE 17 HG13 ILE 17 1.738 -6.520 8.426
116 HG21 ILE 17 HG21 ILE 17 -2.129 -6.319 8.021
117 HG22 ILE 17 HG22 ILE 17 -2.078 -4.666 7.386
118 HG23 ILE 17 HG23 ILE 17 -1.407 -6.011 6.415
119 HD11 ILE 17 HD11 ILE 17 -0.833 -8.207 8.561
120 HD12 ILE 17 HD12 ILE 17 0.823 -8.713 8.959
121 HD13 ILE 17 HD13 ILE 17 0.003 -7.495 9.975
122 H GLN 18 H GLN 18 1.141 -2.522 9.362
123 HA GLN 18 HA GLN 18 3.971 -3.412 9.575
124 HB2 GLN 18 HB2 GLN 18 3.120 -0.510 8.940
125 HB3 GLN 18 HB3 GLN 18 4.780 -1.049 9.312
126 HG2 GLN 18 HG2 GLN 18 4.727 -2.537 7.251
127 HG3 GLN 18 HG3 GLN 18 3.122 -1.867 6.846
128 HE21 GLN 18 HE21 GLN 18 2.957 0.562 6.435
129 HE22 GLN 18 HE22 GLN 18 4.356 1.337 5.789
130 H GLY 19 H GLY 19 5.063 -2.313 11.531
131 HA2 GLY 19 HA3 GLY 19 3.105 -2.282 13.732
132 HA3 GLY 19 HA2 GLY 19 4.868 -2.077 13.866
Start of MODEL 7
1 H1 GLY 1 H GLY 1 2.664 -1.548 1.002
2 HA2 GLY 1 HA3 GLY 1 3.786 -1.200 -1.423
3 HA3 GLY 1 HA2 GLY 1 5.253 -1.330 -0.428
4 H ALA 2 H ALA 2 2.059 -3.185 -0.523
5 HA ALA 2 HA ALA 2 3.396 -5.507 -1.639
6 HB1 ALA 2 HB1 ALA 2 4.062 -5.681 0.798
7 HB2 ALA 2 HB2 ALA 2 2.323 -5.652 1.251
8 HB3 ALA 2 HB3 ALA 2 3.004 -7.022 0.335
9 H PHE 3 H PHE 3 1.505 -7.465 -1.370
10 HA PHE 3 HA PHE 3 -0.456 -6.403 -3.088
11 HB2 PHE 3 HB2 PHE 3 -0.673 -9.013 -1.478
12 HB3 PHE 3 HB3 PHE 3 -1.563 -8.630 -2.972
13 HD1 PHE 3 HD2 PHE 3 -0.080 -7.923 -5.066
14 HD2 PHE 3 HD1 PHE 3 1.399 -10.234 -1.745
15 HE1 PHE 3 HE2 PHE 3 1.861 -8.640 -6.423
16 HE2 PHE 3 HE1 PHE 3 3.318 -10.970 -3.117
17 HZ PHE 3 HZ PHE 3 3.573 -10.155 -5.450
18 H VAL 4 H VAL 4 -0.619 -6.734 0.542
19 HA VAL 4 HA VAL 4 -3.240 -5.381 0.402
20 HB VAL 4 HB VAL 4 -3.799 -7.754 -0.011
21 HG11 VAL 4 HG11 VAL 4 -3.374 -9.526 1.702
22 HG12 VAL 4 HG12 VAL 4 -1.841 -8.866 1.084
23 HG13 VAL 4 HG13 VAL 4 -2.444 -8.370 2.693
24 HG21 VAL 4 HG21 VAL 4 -5.490 -8.086 1.757
25 HG22 VAL 4 HG22 VAL 4 -4.643 -6.961 2.848
26 HG23 VAL 4 HG23 VAL 4 -5.403 -6.354 1.344
27 H GLY 5 H GLY 5 -3.978 -4.523 2.521
28 HA2 GLY 5 HA3 GLY 5 -3.199 -5.020 4.973
29 HA3 GLY 5 HA2 GLY 5 -1.694 -4.256 4.415
30 H GLN 6 H GLN 6 -1.639 -1.896 4.369
31 HA GLN 6 HA GLN 6 -4.198 -0.435 4.413
32 HB2 GLN 6 HB2 GLN 6 -3.821 0.489 6.720
33 HB3 GLN 6 HB3 GLN 6 -3.882 -1.268 6.763
34 HG2 GLN 6 HG2 GLN 6 -2.088 -0.393 8.219
35 HG3 GLN 6 HG3 GLN 6 -1.437 -1.407 6.926
36 HE21 GLN 6 HE21 GLN 6 -2.242 2.150 7.549
37 HE22 GLN 6 HE22 GLN 6 -0.794 2.727 6.817
38 HA PRO 7 HA PRO 7 -1.886 2.329 2.064
39 HB2 PRO 7 HB2 PRO 7 -2.038 4.902 3.304
40 HB3 PRO 7 HB3 PRO 7 -3.322 4.181 2.294
41 HG2 PRO 7 HG2 PRO 7 -3.091 3.980 5.326
42 HG3 PRO 7 HG3 PRO 7 -4.518 4.511 4.378
43 HD2 PRO 7 HD2 PRO 7 -4.480 1.986 5.219
44 HD3 PRO 7 HD3 PRO 7 -4.779 2.177 3.459
45 H GLU 8 H GLU 8 0.431 2.476 1.883
46 HA GLU 8 HA GLU 8 1.973 2.177 4.310
47 HB2 GLU 8 HB2 GLU 8 2.837 2.753 1.417
48 HB3 GLU 8 HB3 GLU 8 3.988 2.549 2.763
49 HG2 GLU 8 HG2 GLU 8 3.242 0.260 3.178
50 HG3 GLU 8 HG3 GLU 8 1.860 0.444 2.073
51 H ALA 9 H ALA 9 1.694 4.934 1.868
52 HA ALA 9 HA ALA 9 2.998 6.698 3.848
53 HB1 ALA 9 HB1 ALA 9 3.575 6.999 1.480
54 HB2 ALA 9 HB2 ALA 9 1.881 7.353 1.057
55 HB3 ALA 9 HB3 ALA 9 2.776 8.460 2.134
56 H VAL 10 H VAL 10 -0.199 6.702 2.057
57 HA VAL 10 HA VAL 10 -1.743 7.239 4.341
58 HB VAL 10 HB VAL 10 -0.683 9.387 4.648
59 HG11 VAL 10 HG11 VAL 10 -1.444 10.288 1.813
60 HG12 VAL 10 HG12 VAL 10 -0.488 11.156 3.029
61 HG13 VAL 10 HG13 VAL 10 0.189 9.696 2.260
62 HG21 VAL 10 HG21 VAL 10 -3.440 9.859 3.368
63 HG22 VAL 10 HG22 VAL 10 -3.154 9.276 5.032
64 HG23 VAL 10 HG23 VAL 10 -2.615 10.908 4.550
65 H ASN 11 H ASN 11 -1.483 8.191 0.784
66 HA ASN 11 HA ASN 11 -4.349 7.648 0.466
67 HB2 ASN 11 HB2 ASN 11 -3.152 9.357 -0.914
68 HB3 ASN 11 HB3 ASN 11 -2.115 8.098 -1.611
69 HD21 ASN 11 HD21 ASN 11 -3.362 6.218 -2.834
70 HD22 ASN 11 HD22 ASN 11 -4.741 6.727 -3.727
71 HA PRO 12 HA PRO 12 -3.184 3.236 0.121
72 HB2 PRO 12 HB2 PRO 12 -5.312 2.138 -1.229
73 HB3 PRO 12 HB3 PRO 12 -5.505 2.881 0.386
74 HG2 PRO 12 HG2 PRO 12 -5.948 4.309 -2.290
75 HG3 PRO 12 HG3 PRO 12 -7.166 4.085 -0.991
76 HD2 PRO 12 HD2 PRO 12 -5.733 6.384 -1.068
77 HD3 PRO 12 HD3 PRO 12 -5.882 5.563 0.528
78 H LEU 13 H LEU 13 -1.288 4.219 -1.214
79 HA LEU 13 HA LEU 13 -1.464 3.376 -4.075
80 HB2 LEU 13 HB2 LEU 13 0.932 4.492 -2.522
81 HB3 LEU 13 HB3 LEU 13 0.847 4.192 -4.271
82 HG LEU 13 HG LEU 13 -0.874 6.228 -2.719
83 HD11 LEU 13 HD11 LEU 13 1.596 6.703 -4.496
84 HD12 LEU 13 HD12 LEU 13 1.537 6.882 -2.718
85 HD13 LEU 13 HD13 LEU 13 0.587 7.978 -3.753
86 HD21 LEU 13 HD21 LEU 13 -2.033 5.505 -4.834
87 HD22 LEU 13 HD22 LEU 13 -0.538 5.812 -5.762
88 HD23 LEU 13 HD23 LEU 13 -1.427 7.163 -5.000
89 H GLY 14 H GLY 14 0.559 2.674 -1.049
90 HA2 GLY 14 HA3 GLY 14 1.051 -0.057 -2.193
91 HA3 GLY 14 HA2 GLY 14 2.045 0.793 -0.997
92 H ARG 15 H ARG 15 0.294 -1.868 -0.880
93 HA ARG 15 HA ARG 15 -1.138 -1.117 1.655
94 HB2 ARG 15 HB2 ARG 15 -1.768 -3.394 -0.297
95 HB3 ARG 15 HB3 ARG 15 -2.591 -2.960 1.220
96 HG2 ARG 15 HG2 ARG 15 -4.012 -2.052 -0.388
97 HG3 ARG 15 HG3 ARG 15 -3.087 -0.634 0.148
98 HD2 ARG 15 HD2 ARG 15 -3.347 -0.634 -2.361
99 HD3 ARG 15 HD3 ARG 15 -1.675 -0.785 -1.920
100 HE ARG 15 HE ARG 15 -1.526 -2.910 -2.803
101 HH11 ARG 15 HH11 ARG 15 -5.043 -2.074 -2.502
102 HH12 ARG 15 HH12 ARG 15 -5.510 -3.494 -3.420
103 HH21 ARG 15 HH21 ARG 15 -2.261 -4.684 -3.949
104 HH22 ARG 15 HH22 ARG 15 -3.984 -4.936 -4.221
105 H GLU 16 H GLU 16 0.717 -1.526 3.118
106 HA GLU 16 HA GLU 16 1.321 -4.481 3.371
107 HB2 GLU 16 HB2 GLU 16 3.003 -1.998 4.039
108 HB3 GLU 16 HB3 GLU 16 3.238 -3.498 4.962
109 HG2 GLU 16 HG2 GLU 16 3.958 -4.767 3.089
110 HG3 GLU 16 HG3 GLU 16 3.462 -3.501 1.942
111 H ILE 17 H ILE 17 1.233 -5.254 5.630
112 HA ILE 17 HA ILE 17 -0.174 -3.387 7.481
113 HB ILE 17 HB ILE 17 -0.404 -5.152 9.073
114 HG12 ILE 17 HG12 ILE 17 1.062 -7.059 7.136
115 HG13 ILE 17 HG13 ILE 17 1.702 -6.428 8.675
116 HG21 ILE 17 HG21 ILE 17 -2.100 -4.862 7.210
117 HG22 ILE 17 HG22 ILE 17 -1.276 -6.168 6.302
118 HG23 ILE 17 HG23 ILE 17 -2.088 -6.509 7.860
119 HD11 ILE 17 HD11 ILE 17 -0.686 -8.337 8.358
120 HD12 ILE 17 HD12 ILE 17 0.907 -8.671 9.073
121 HD13 ILE 17 HD13 ILE 17 -0.216 -7.555 9.900
122 H GLN 18 H GLN 18 1.031 -2.478 9.308
123 HA GLN 18 HA GLN 18 3.898 -3.277 9.480
124 HB2 GLN 18 HB2 GLN 18 2.925 -0.409 8.890
125 HB3 GLN 18 HB3 GLN 18 4.618 -0.905 9.167
126 HG2 GLN 18 HG2 GLN 18 4.477 -2.395 7.107
127 HG3 GLN 18 HG3 GLN 18 2.847 -1.738 6.782
128 HE21 GLN 18 HE21 GLN 18 2.684 0.773 6.573
129 HE22 GLN 18 HE22 GLN 18 4.026 1.536 5.802
130 H GLY 19 H GLY 19 4.996 -2.122 11.401
131 HA2 GLY 19 HA3 GLY 19 3.239 -2.351 13.686
132 HA3 GLY 19 HA2 GLY 19 4.901 -1.706 13.708
Start of MODEL 8
1 H1 GLY 1 H GLY 1 2.649 -1.566 1.016
2 HA2 GLY 1 HA3 GLY 1 3.444 -1.200 -1.535
3 HA3 GLY 1 HA2 GLY 1 5.027 -1.269 -0.729
4 H ALA 2 H ALA 2 2.039 -3.423 -0.146
5 HA ALA 2 HA ALA 2 3.431 -5.569 -1.635
6 HB1 ALA 2 HB1 ALA 2 4.091 -5.739 0.797
7 HB2 ALA 2 HB2 ALA 2 2.355 -5.829 1.247
8 HB3 ALA 2 HB3 ALA 2 3.127 -7.134 0.294
9 H PHE 3 H PHE 3 1.268 -7.525 -0.988
10 HA PHE 3 HA PHE 3 -0.483 -6.393 -3.010
11 HB2 PHE 3 HB2 PHE 3 -0.763 -9.075 -1.565
12 HB3 PHE 3 HB3 PHE 3 -1.473 -8.624 -3.135
13 HD1 PHE 3 HD1 PHE 3 0.238 -7.774 -4.989
14 HD2 PHE 3 HD2 PHE 3 1.367 -10.218 -1.629
15 HE1 PHE 3 HE1 PHE 3 2.391 -8.299 -6.089
16 HE2 PHE 3 HE2 PHE 3 3.503 -10.761 -2.745
17 HZ PHE 3 HZ PHE 3 4.039 -9.776 -4.961
18 H VAL 4 H VAL 4 -0.772 -6.842 0.583
19 HA VAL 4 HA VAL 4 -3.386 -5.487 0.396
20 HB VAL 4 HB VAL 4 -3.986 -7.836 -0.007
21 HG11 VAL 4 HG11 VAL 4 -2.571 -8.506 2.651
22 HG12 VAL 4 HG12 VAL 4 -3.545 -9.636 1.672
23 HG13 VAL 4 HG13 VAL 4 -2.021 -8.991 1.021
24 HG21 VAL 4 HG21 VAL 4 -5.635 -8.170 1.811
25 HG22 VAL 4 HG22 VAL 4 -4.748 -7.053 2.879
26 HG23 VAL 4 HG23 VAL 4 -5.546 -6.438 1.399
27 H GLY 5 H GLY 5 -4.070 -4.535 2.492
28 HA2 GLY 5 HA3 GLY 5 -3.249 -5.004 4.951
29 HA3 GLY 5 HA2 GLY 5 -1.746 -4.272 4.339
30 H GLN 6 H GLN 6 -1.672 -1.916 4.219
31 HA GLN 6 HA GLN 6 -4.205 -0.423 4.489
32 HB2 GLN 6 HB2 GLN 6 -3.672 0.362 6.813
33 HB3 GLN 6 HB3 GLN 6 -3.652 -1.392 6.773
34 HG2 GLN 6 HG2 GLN 6 -1.757 -0.571 8.086
35 HG3 GLN 6 HG3 GLN 6 -1.195 -1.411 6.631
36 HE21 GLN 6 HE21 GLN 6 -2.115 2.023 7.644
37 HE22 GLN 6 HE22 GLN 6 -0.773 2.743 6.839
38 HA PRO 7 HA PRO 7 -1.994 2.407 2.104
39 HB2 PRO 7 HB2 PRO 7 -2.114 4.961 3.336
40 HB3 PRO 7 HB3 PRO 7 -3.467 4.200 2.456
41 HG2 PRO 7 HG2 PRO 7 -2.962 4.012 5.461
42 HG3 PRO 7 HG3 PRO 7 -4.470 4.540 4.649
43 HD2 PRO 7 HD2 PRO 7 -4.313 2.011 5.482
44 HD3 PRO 7 HD3 PRO 7 -4.820 2.211 3.769
45 H GLU 8 H GLU 8 0.319 2.529 1.836
46 HA GLU 8 HA GLU 8 1.977 2.211 4.184
47 HB2 GLU 8 HB2 GLU 8 2.693 2.821 1.263
48 HB3 GLU 8 HB3 GLU 8 3.909 2.607 2.549
49 HG2 GLU 8 HG2 GLU 8 3.165 0.317 2.992
50 HG3 GLU 8 HG3 GLU 8 1.746 0.512 1.933
51 H ALA 9 H ALA 9 1.601 5.021 1.807
52 HA ALA 9 HA ALA 9 2.929 6.744 3.823
53 HB1 ALA 9 HB1 ALA 9 1.863 7.448 1.027
54 HB2 ALA 9 HB2 ALA 9 2.736 8.537 2.140
55 HB3 ALA 9 HB3 ALA 9 3.547 7.085 1.479
56 H VAL 10 H VAL 10 -0.243 6.843 1.979
57 HA VAL 10 HA VAL 10 -1.800 7.321 4.280
58 HB VAL 10 HB VAL 10 -0.726 9.448 4.636
59 HG11 VAL 10 HG11 VAL 10 0.162 9.801 2.255
60 HG12 VAL 10 HG12 VAL 10 -1.460 10.431 1.821
61 HG13 VAL 10 HG13 VAL 10 -0.494 11.250 3.062
62 HG21 VAL 10 HG21 VAL 10 -2.645 10.992 4.554
63 HG22 VAL 10 HG22 VAL 10 -3.470 9.971 3.345
64 HG23 VAL 10 HG23 VAL 10 -3.201 9.356 5.002
65 H ASN 11 H ASN 11 -1.542 8.371 0.749
66 HA ASN 11 HA ASN 11 -4.401 7.888 0.398
67 HB2 ASN 11 HB2 ASN 11 -3.126 9.497 -1.025
68 HB3 ASN 11 HB3 ASN 11 -2.112 8.184 -1.651
69 HD21 ASN 11 HD21 ASN 11 -3.371 6.308 -2.854
70 HD22 ASN 11 HD22 ASN 11 -4.714 6.826 -3.799
71 HA PRO 12 HA PRO 12 -3.416 3.431 0.179
72 HB2 PRO 12 HB2 PRO 12 -5.576 2.376 -1.165
73 HB3 PRO 12 HB3 PRO 12 -5.761 3.186 0.418
74 HG2 PRO 12 HG2 PRO 12 -6.090 4.535 -2.317
75 HG3 PRO 12 HG3 PRO 12 -7.345 4.408 -1.040
76 HD2 PRO 12 HD2 PRO 12 -5.810 6.640 -1.158
77 HD3 PRO 12 HD3 PRO 12 -6.032 5.880 0.458
78 H LEU 13 H LEU 13 -1.491 4.401 -1.218
79 HA LEU 13 HA LEU 13 -1.665 3.447 -4.034
80 HB2 LEU 13 HB2 LEU 13 0.772 4.474 -2.467
81 HB3 LEU 13 HB3 LEU 13 0.708 4.107 -4.205
82 HG LEU 13 HG LEU 13 -0.897 6.318 -2.777
83 HD11 LEU 13 HD11 LEU 13 1.639 6.534 -4.512
84 HD12 LEU 13 HD12 LEU 13 1.553 6.794 -2.746
85 HD13 LEU 13 HD13 LEU 13 0.713 7.911 -3.850
86 HD21 LEU 13 HD21 LEU 13 -2.064 5.592 -4.890
87 HD22 LEU 13 HD22 LEU 13 -0.529 5.744 -5.792
88 HD23 LEU 13 HD23 LEU 13 -1.328 7.191 -5.113
89 H GLY 14 H GLY 14 0.216 2.740 -0.926
90 HA2 GLY 14 HA3 GLY 14 0.850 0.061 -2.096
91 HA3 GLY 14 HA2 GLY 14 1.748 0.921 -0.841
92 H ARG 15 H ARG 15 0.637 -1.796 -0.620
93 HA ARG 15 HA ARG 15 -1.207 -1.356 1.712
94 HB2 ARG 15 HB2 ARG 15 -1.419 -3.632 -0.349
95 HB3 ARG 15 HB3 ARG 15 -2.446 -3.267 1.056
96 HG2 ARG 15 HG2 ARG 15 -3.764 -2.418 -0.655
97 HG3 ARG 15 HG3 ARG 15 -2.899 -0.950 -0.154
98 HD2 ARG 15 HD2 ARG 15 -2.855 -0.994 -2.618
99 HD3 ARG 15 HD3 ARG 15 -1.254 -1.418 -2.096
100 HE ARG 15 HE ARG 15 -1.430 -3.559 -2.922
101 HH11 ARG 15 HH11 ARG 15 -4.759 -2.127 -2.805
102 HH12 ARG 15 HH12 ARG 15 -5.411 -3.435 -3.776
103 HH21 ARG 15 HH21 ARG 15 -2.396 -5.172 -4.142
104 HH22 ARG 15 HH22 ARG 15 -4.120 -5.120 -4.506
105 H GLU 16 H GLU 16 0.790 -1.531 3.149
106 HA GLU 16 HA GLU 16 1.534 -4.444 3.492
107 HB2 GLU 16 HB2 GLU 16 3.185 -1.906 3.921
108 HB3 GLU 16 HB3 GLU 16 3.518 -3.363 4.886
109 HG2 GLU 16 HG2 GLU 16 4.152 -4.699 3.044
110 HG3 GLU 16 HG3 GLU 16 3.511 -3.533 1.869
111 H ILE 17 H ILE 17 0.927 -5.246 5.595
112 HA ILE 17 HA ILE 17 -0.068 -3.296 7.555
113 HB ILE 17 HB ILE 17 -0.164 -5.127 9.195
114 HG12 ILE 17 HG12 ILE 17 0.462 -7.106 6.904
115 HG13 ILE 17 HG13 ILE 17 1.656 -6.606 8.128
116 HG21 ILE 17 HG21 ILE 17 -2.209 -6.164 8.238
117 HG22 ILE 17 HG22 ILE 17 -2.134 -4.472 7.719
118 HG23 ILE 17 HG23 ILE 17 -1.651 -5.769 6.588
119 HD11 ILE 17 HD11 ILE 17 0.680 -8.758 8.758
120 HD12 ILE 17 HD12 ILE 17 0.170 -7.522 9.942
121 HD13 ILE 17 HD13 ILE 17 -0.973 -8.110 8.696
122 H GLN 18 H GLN 18 1.166 -2.494 9.377
123 HA GLN 18 HA GLN 18 3.951 -3.485 9.652
124 HB2 GLN 18 HB2 GLN 18 3.218 -0.570 8.928
125 HB3 GLN 18 HB3 GLN 18 4.844 -1.129 9.405
126 HG2 GLN 18 HG2 GLN 18 4.903 -2.654 7.388
127 HG3 GLN 18 HG3 GLN 18 3.313 -2.015 6.892
128 HE21 GLN 18 HE21 GLN 18 3.122 0.328 6.272
129 HE22 GLN 18 HE22 GLN 18 4.542 1.126 5.709
130 H GLY 19 H GLY 19 5.037 -2.407 11.624
131 HA2 GLY 19 HA3 GLY 19 3.018 -2.205 13.766
132 HA3 GLY 19 HA2 GLY 19 4.785 -2.108 13.949
Start of MODEL 9
1 H1 GLY 1 H GLY 1 2.603 -1.616 1.056
2 HA2 GLY 1 HA3 GLY 1 3.517 -1.261 -1.485
3 HA3 GLY 1 HA2 GLY 1 5.046 -1.358 -0.582
4 H ALA 2 H ALA 2 1.980 -3.425 -0.166
5 HA ALA 2 HA ALA 2 3.364 -5.620 -1.575
6 HB1 ALA 2 HB1 ALA 2 2.947 -7.175 0.366
7 HB2 ALA 2 HB2 ALA 2 3.989 -5.828 0.855
8 HB3 ALA 2 HB3 ALA 2 2.249 -5.821 1.299
9 H PHE 3 H PHE 3 1.392 -7.587 -1.297
10 HA PHE 3 HA PHE 3 -0.473 -6.419 -3.112
11 HB2 PHE 3 HB2 PHE 3 -0.755 -9.117 -1.691
12 HB3 PHE 3 HB3 PHE 3 -1.523 -8.641 -3.224
13 HD1 PHE 3 HD1 PHE 3 0.125 -7.778 -5.137
14 HD2 PHE 3 HD2 PHE 3 1.330 -10.330 -1.887
15 HE1 PHE 3 HE1 PHE 3 2.203 -8.350 -6.351
16 HE2 PHE 3 HE2 PHE 3 3.389 -10.920 -3.118
17 HZ PHE 3 HZ PHE 3 3.851 -9.907 -5.337
18 H VAL 4 H VAL 4 -0.708 -6.827 0.483
19 HA VAL 4 HA VAL 4 -3.314 -5.474 0.322
20 HB VAL 4 HB VAL 4 -3.923 -7.825 -0.126
21 HG11 VAL 4 HG11 VAL 4 -2.559 -8.523 2.550
22 HG12 VAL 4 HG12 VAL 4 -3.513 -9.643 1.542
23 HG13 VAL 4 HG13 VAL 4 -1.973 -8.996 0.930
24 HG21 VAL 4 HG21 VAL 4 -4.738 -7.079 2.753
25 HG22 VAL 4 HG22 VAL 4 -5.503 -6.432 1.268
26 HG23 VAL 4 HG23 VAL 4 -5.610 -8.170 1.647
27 H GLY 5 H GLY 5 -4.048 -4.628 2.453
28 HA2 GLY 5 HA3 GLY 5 -3.207 -5.157 4.908
29 HA3 GLY 5 HA2 GLY 5 -1.739 -4.350 4.308
30 H GLN 6 H GLN 6 -1.765 -2.004 4.198
31 HA GLN 6 HA GLN 6 -4.317 -0.569 4.406
32 HB2 GLN 6 HB2 GLN 6 -3.959 0.209 6.770
33 HB3 GLN 6 HB3 GLN 6 -3.921 -1.547 6.712
34 HG2 GLN 6 HG2 GLN 6 -2.090 -0.808 8.129
35 HG3 GLN 6 HG3 GLN 6 -1.438 -1.495 6.627
36 HE21 GLN 6 HE21 GLN 6 0.625 -0.236 6.816
37 HE22 GLN 6 HE22 GLN 6 0.615 1.479 6.639
38 HA PRO 7 HA PRO 7 -2.028 2.241 2.142
39 HB2 PRO 7 HB2 PRO 7 -2.160 4.819 3.378
40 HB3 PRO 7 HB3 PRO 7 -3.464 4.077 2.412
41 HG2 PRO 7 HG2 PRO 7 -3.148 3.863 5.443
42 HG3 PRO 7 HG3 PRO 7 -4.601 4.400 4.542
43 HD2 PRO 7 HD2 PRO 7 -4.499 1.867 5.377
44 HD3 PRO 7 HD3 PRO 7 -4.894 2.069 3.632
45 H GLU 8 H GLU 8 0.265 2.621 1.857
46 HA GLU 8 HA GLU 8 1.910 2.145 4.221
47 HB2 GLU 8 HB2 GLU 8 2.664 2.808 1.320
48 HB3 GLU 8 HB3 GLU 8 3.851 2.523 2.621
49 HG2 GLU 8 HG2 GLU 8 3.003 0.249 2.998
50 HG3 GLU 8 HG3 GLU 8 1.643 0.516 1.880
51 H ALA 9 H ALA 9 1.642 4.999 1.881
52 HA ALA 9 HA ALA 9 2.926 6.669 3.959
53 HB1 ALA 9 HB1 ALA 9 1.891 7.447 1.169
54 HB2 ALA 9 HB2 ALA 9 2.761 8.504 2.315
55 HB3 ALA 9 HB3 ALA 9 3.571 7.064 1.627
56 H VAL 10 H VAL 10 -0.221 6.778 2.083
57 HA VAL 10 HA VAL 10 -1.819 7.195 4.355
58 HB VAL 10 HB VAL 10 -0.789 9.328 4.792
59 HG11 VAL 10 HG11 VAL 10 -1.457 10.370 1.982
60 HG12 VAL 10 HG12 VAL 10 -0.536 11.171 3.268
61 HG13 VAL 10 HG13 VAL 10 0.161 9.751 2.445
62 HG21 VAL 10 HG21 VAL 10 -3.273 9.198 5.087
63 HG22 VAL 10 HG22 VAL 10 -2.723 10.850 4.697
64 HG23 VAL 10 HG23 VAL 10 -3.501 9.853 3.441
65 H ASN 11 H ASN 11 -1.495 8.335 0.858
66 HA ASN 11 HA ASN 11 -4.339 7.827 0.435
67 HB2 ASN 11 HB2 ASN 11 -3.062 9.490 -0.919
68 HB3 ASN 11 HB3 ASN 11 -2.022 8.207 -1.567
69 HD21 ASN 11 HD21 ASN 11 -3.242 6.347 -2.832
70 HD22 ASN 11 HD22 ASN 11 -4.581 6.867 -3.777
71 HA PRO 12 HA PRO 12 -3.263 3.391 0.128
72 HB2 PRO 12 HB2 PRO 12 -5.406 2.328 -1.235
73 HB3 PRO 12 HB3 PRO 12 -5.606 3.103 0.363
74 HG2 PRO 12 HG2 PRO 12 -5.962 4.500 -2.345
75 HG3 PRO 12 HG3 PRO 12 -7.211 4.327 -1.069
76 HD2 PRO 12 HD2 PRO 12 -5.709 6.585 -1.153
77 HD3 PRO 12 HD3 PRO 12 -5.927 5.798 0.451
78 H LEU 13 H LEU 13 -1.349 4.389 -1.228
79 HA LEU 13 HA LEU 13 -1.519 3.576 -4.085
80 HB2 LEU 13 HB2 LEU 13 0.917 4.495 -2.455
81 HB3 LEU 13 HB3 LEU 13 0.864 4.221 -4.209
82 HG LEU 13 HG LEU 13 -0.752 6.361 -2.687
83 HD11 LEU 13 HD11 LEU 13 0.879 8.006 -3.641
84 HD12 LEU 13 HD12 LEU 13 1.816 6.663 -4.358
85 HD13 LEU 13 HD13 LEU 13 1.696 6.830 -2.582
86 HD21 LEU 13 HD21 LEU 13 -0.327 5.955 -5.721
87 HD22 LEU 13 HD22 LEU 13 -1.141 7.361 -4.976
88 HD23 LEU 13 HD23 LEU 13 -1.879 5.752 -4.862
89 H GLY 14 H GLY 14 0.350 2.679 -1.020
90 HA2 GLY 14 HA3 GLY 14 0.765 -0.031 -2.248
91 HA3 GLY 14 HA2 GLY 14 1.811 0.765 -1.062
92 H ARG 15 H ARG 15 0.529 -1.850 -0.698
93 HA ARG 15 HA ARG 15 -1.166 -1.213 1.700
94 HB2 ARG 15 HB2 ARG 15 -1.588 -3.557 -0.252
95 HB3 ARG 15 HB3 ARG 15 -2.525 -3.106 1.191
96 HG2 ARG 15 HG2 ARG 15 -3.891 -2.262 -0.491
97 HG3 ARG 15 HG3 ARG 15 -2.950 -0.814 -0.070
98 HD2 ARG 15 HD2 ARG 15 -3.041 -0.941 -2.537
99 HD3 ARG 15 HD3 ARG 15 -1.423 -1.363 -2.073
100 HE ARG 15 HE ARG 15 -1.652 -3.529 -2.813
101 HH11 ARG 15 HH11 ARG 15 -4.960 -2.055 -2.618
102 HH12 ARG 15 HH12 ARG 15 -5.661 -3.385 -3.522
103 HH21 ARG 15 HH21 ARG 15 -2.679 -5.169 -3.939
104 HH22 ARG 15 HH22 ARG 15 -4.414 -5.108 -4.246
105 H GLU 16 H GLU 16 0.737 -1.480 3.176
106 HA GLU 16 HA GLU 16 1.364 -4.412 3.543
107 HB2 GLU 16 HB2 GLU 16 3.147 -1.952 3.955
108 HB3 GLU 16 HB3 GLU 16 3.394 -3.409 4.946
109 HG2 GLU 16 HG2 GLU 16 3.965 -4.802 3.115
110 HG3 GLU 16 HG3 GLU 16 3.423 -3.599 1.926
111 H ILE 17 H ILE 17 1.010 -5.133 5.745
112 HA ILE 17 HA ILE 17 -0.098 -3.121 7.599
113 HB ILE 17 HB ILE 17 -0.274 -4.840 9.284
114 HG12 ILE 17 HG12 ILE 17 0.682 -6.923 7.210
115 HG13 ILE 17 HG13 ILE 17 1.678 -6.303 8.551
116 HG21 ILE 17 HG21 ILE 17 -2.134 -4.392 7.586
117 HG22 ILE 17 HG22 ILE 17 -1.514 -5.763 6.623
118 HG23 ILE 17 HG23 ILE 17 -2.196 -6.032 8.253
119 HD11 ILE 17 HD11 ILE 17 0.736 -8.456 9.190
120 HD12 ILE 17 HD12 ILE 17 -0.006 -7.186 10.204
121 HD13 ILE 17 HD13 ILE 17 -0.924 -7.919 8.853
122 H GLN 18 H GLN 18 1.136 -2.170 9.337
123 HA GLN 18 HA GLN 18 3.939 -3.105 9.647
124 HB2 GLN 18 HB2 GLN 18 3.162 -0.244 8.765
125 HB3 GLN 18 HB3 GLN 18 4.803 -0.780 9.220
126 HG2 GLN 18 HG2 GLN 18 4.762 -2.437 7.289
127 HG3 GLN 18 HG3 GLN 18 3.187 -1.761 6.791
128 HE21 GLN 18 HE21 GLN 18 3.107 0.629 6.173
129 HE22 GLN 18 HE22 GLN 18 4.543 1.312 5.506
130 H GLY 19 H GLY 19 5.029 -1.880 11.531
131 HA2 GLY 19 HA3 GLY 19 3.038 -1.628 13.688
132 HA3 GLY 19 HA2 GLY 19 4.803 -1.452 13.836
Start of MODEL 10
1 H1 GLY 1 H GLY 1 2.598 -1.612 1.059
2 HA2 GLY 1 HA3 GLY 1 3.473 -1.271 -1.503
3 HA3 GLY 1 HA2 GLY 1 5.010 -1.356 -0.613
4 H ALA 2 H ALA 2 1.970 -3.445 -0.126
5 HA ALA 2 HA ALA 2 3.355 -5.637 -1.554
6 HB1 ALA 2 HB1 ALA 2 2.918 -7.184 0.391
7 HB2 ALA 2 HB2 ALA 2 3.963 -5.840 0.881
8 HB3 ALA 2 HB3 ALA 2 2.221 -5.822 1.315
9 H PHE 3 H PHE 3 1.359 -7.594 -1.266
10 HA PHE 3 HA PHE 3 -0.478 -6.408 -3.112
11 HB2 PHE 3 HB2 PHE 3 -0.774 -9.122 -1.724
12 HB3 PHE 3 HB3 PHE 3 -1.512 -8.630 -3.269
13 HD1 PHE 3 HD2 PHE 3 0.185 -7.738 -5.132
14 HD2 PHE 3 HD1 PHE 3 1.308 -10.339 -1.890
15 HE1 PHE 3 HE2 PHE 3 2.298 -8.284 -6.296
16 HE2 PHE 3 HE1 PHE 3 3.402 -10.903 -3.072
17 HZ PHE 3 HZ PHE 3 3.924 -9.851 -5.261
18 H VAL 4 H VAL 4 -0.736 -6.837 0.474
19 HA VAL 4 HA VAL 4 -3.345 -5.490 0.304
20 HB VAL 4 HB VAL 4 -3.957 -7.840 -0.145
21 HG11 VAL 4 HG11 VAL 4 -3.544 -9.660 1.515
22 HG12 VAL 4 HG12 VAL 4 -2.005 -9.008 0.900
23 HG13 VAL 4 HG13 VAL 4 -2.585 -8.544 2.526
24 HG21 VAL 4 HG21 VAL 4 -4.763 -7.099 2.738
25 HG22 VAL 4 HG22 VAL 4 -5.530 -6.450 1.255
26 HG23 VAL 4 HG23 VAL 4 -5.636 -8.189 1.632
27 H GLY 5 H GLY 5 -4.077 -4.634 2.433
28 HA2 GLY 5 HA3 GLY 5 -3.248 -5.170 4.884
29 HA3 GLY 5 HA2 GLY 5 -1.771 -4.373 4.295
30 H GLN 6 H GLN 6 -1.775 -2.023 4.181
31 HA GLN 6 HA GLN 6 -4.317 -0.569 4.416
32 HB2 GLN 6 HB2 GLN 6 -3.939 0.180 6.787
33 HB3 GLN 6 HB3 GLN 6 -3.888 -1.576 6.710
34 HG2 GLN 6 HG2 GLN 6 -2.040 -0.846 8.111
35 HG3 GLN 6 HG3 GLN 6 -1.398 -1.488 6.583
36 HE21 GLN 6 HE21 GLN 6 0.650 -0.211 6.840
37 HE22 GLN 6 HE22 GLN 6 0.621 1.506 6.672
38 HA PRO 7 HA PRO 7 -2.028 2.243 2.148
39 HB2 PRO 7 HB2 PRO 7 -2.163 4.809 3.389
40 HB3 PRO 7 HB3 PRO 7 -3.472 4.064 2.430
41 HG2 PRO 7 HG2 PRO 7 -3.126 3.862 5.453
42 HG3 PRO 7 HG3 PRO 7 -4.591 4.389 4.563
43 HD2 PRO 7 HD2 PRO 7 -4.484 1.857 5.405
44 HD3 PRO 7 HD3 PRO 7 -4.892 2.058 3.664
45 H GLU 8 H GLU 8 0.260 2.643 1.853
46 HA GLU 8 HA GLU 8 1.916 2.148 4.208
47 HB2 GLU 8 HB2 GLU 8 2.655 2.819 1.305
48 HB3 GLU 8 HB3 GLU 8 3.848 2.526 2.599
49 HG2 GLU 8 HG2 GLU 8 2.992 0.255 2.975
50 HG3 GLU 8 HG3 GLU 8 1.630 0.530 1.861
51 H ALA 9 H ALA 9 1.647 5.014 1.883
52 HA ALA 9 HA ALA 9 2.924 6.673 3.978
53 HB1 ALA 9 HB1 ALA 9 2.774 8.516 2.343
54 HB2 ALA 9 HB2 ALA 9 3.588 7.079 1.654
55 HB3 ALA 9 HB3 ALA 9 1.913 7.465 1.184
56 H VAL 10 H VAL 10 -0.208 6.799 2.075
57 HA VAL 10 HA VAL 10 -1.820 7.206 4.345
58 HB VAL 10 HB VAL 10 -0.788 9.335 4.792
59 HG11 VAL 10 HG11 VAL 10 0.172 9.761 2.452
60 HG12 VAL 10 HG12 VAL 10 -1.442 10.389 1.983
61 HG13 VAL 10 HG13 VAL 10 -0.524 11.181 3.276
62 HG21 VAL 10 HG21 VAL 10 -3.494 9.868 3.428
63 HG22 VAL 10 HG22 VAL 10 -3.273 9.207 5.074
64 HG23 VAL 10 HG23 VAL 10 -2.719 10.862 4.691
65 H ASN 11 H ASN 11 -1.483 8.358 0.853
66 HA ASN 11 HA ASN 11 -4.324 7.863 0.415
67 HB2 ASN 11 HB2 ASN 11 -3.029 9.512 -0.938
68 HB3 ASN 11 HB3 ASN 11 -1.993 8.219 -1.573
69 HD21 ASN 11 HD21 ASN 11 -3.214 6.365 -2.843
70 HD22 ASN 11 HD22 ASN 11 -4.545 6.889 -3.799
71 HA PRO 12 HA PRO 12 -3.285 3.418 0.124
72 HB2 PRO 12 HB2 PRO 12 -5.430 2.371 -1.249
73 HB3 PRO 12 HB3 PRO 12 -5.634 3.154 0.346
74 HG2 PRO 12 HG2 PRO 12 -5.958 4.542 -2.369
75 HG3 PRO 12 HG3 PRO 12 -7.218 4.385 -1.100
76 HD2 PRO 12 HD2 PRO 12 -5.698 6.630 -1.181
77 HD3 PRO 12 HD3 PRO 12 -5.932 5.850 0.424
78 H LEU 13 H LEU 13 -1.360 4.412 -1.233
79 HA LEU 13 HA LEU 13 -1.522 3.591 -4.087
80 HB2 LEU 13 HB2 LEU 13 0.916 4.485 -2.442
81 HB3 LEU 13 HB3 LEU 13 0.872 4.205 -4.197
82 HG LEU 13 HG LEU 13 -0.726 6.373 -2.695
83 HD11 LEU 13 HD11 LEU 13 1.727 6.806 -2.576
84 HD12 LEU 13 HD12 LEU 13 0.934 7.989 -3.645
85 HD13 LEU 13 HD13 LEU 13 1.857 6.631 -4.350
86 HD21 LEU 13 HD21 LEU 13 -1.084 7.367 -4.991
87 HD22 LEU 13 HD22 LEU 13 -1.847 5.770 -4.873
88 HD23 LEU 13 HD23 LEU 13 -0.287 5.945 -5.725
89 H GLY 14 H GLY 14 0.311 2.679 -1.006
90 HA2 GLY 14 HA3 GLY 14 0.732 -0.028 -2.238
91 HA3 GLY 14 HA2 GLY 14 1.772 0.767 -1.047
92 H ARG 15 H ARG 15 0.561 -1.840 -0.657
93 HA ARG 15 HA ARG 15 -1.188 -1.233 1.709
94 HB2 ARG 15 HB2 ARG 15 -1.560 -3.584 -0.244
95 HB3 ARG 15 HB3 ARG 15 -2.523 -3.131 1.181
96 HG2 ARG 15 HG2 ARG 15 -3.869 -2.306 -0.528
97 HG3 ARG 15 HG3 ARG 15 -2.941 -0.851 -0.105
98 HD2 ARG 15 HD2 ARG 15 -2.970 -0.983 -2.568
99 HD3 ARG 15 HD3 ARG 15 -1.371 -1.446 -2.079
100 HE ARG 15 HE ARG 15 -1.645 -3.607 -2.815
101 HH11 ARG 15 HH11 ARG 15 -4.915 -2.049 -2.671
102 HH12 ARG 15 HH12 ARG 15 -5.636 -3.357 -3.591
103 HH21 ARG 15 HH21 ARG 15 -2.695 -5.219 -3.963
104 HH22 ARG 15 HH22 ARG 15 -4.423 -5.112 -4.297
105 H GLU 16 H GLU 16 0.742 -1.470 3.180
106 HA GLU 16 HA GLU 16 1.386 -4.397 3.564
107 HB2 GLU 16 HB2 GLU 16 3.160 -1.929 3.952
108 HB3 GLU 16 HB3 GLU 16 3.420 -3.381 4.945
109 HG2 GLU 16 HG2 GLU 16 3.988 -4.778 3.120
110 HG3 GLU 16 HG3 GLU 16 3.423 -3.589 1.928
111 H ILE 17 H ILE 17 0.956 -5.120 5.742
112 HA ILE 17 HA ILE 17 -0.094 -3.100 7.615
113 HB ILE 17 HB ILE 17 -0.239 -4.851 9.306
114 HG12 ILE 17 HG12 ILE 17 0.492 -6.927 7.136
115 HG13 ILE 17 HG13 ILE 17 1.625 -6.362 8.390
116 HG21 ILE 17 HG21 ILE 17 -2.163 -4.285 7.740
117 HG22 ILE 17 HG22 ILE 17 -1.632 -5.618 6.677
118 HG23 ILE 17 HG23 ILE 17 -2.244 -5.957 8.320
119 HD11 ILE 17 HD11 ILE 17 0.646 -8.490 9.079
120 HD12 ILE 17 HD12 ILE 17 0.063 -7.206 10.174
121 HD13 ILE 17 HD13 ILE 17 -1.011 -7.870 8.906
122 H GLN 18 H GLN 18 1.140 -2.175 9.355
123 HA GLN 18 HA GLN 18 3.925 -3.148 9.686
124 HB2 GLN 18 HB2 GLN 18 3.193 -0.278 8.794
125 HB3 GLN 18 HB3 GLN 18 4.823 -0.828 9.273
126 HG2 GLN 18 HG2 GLN 18 4.800 -2.483 7.344
127 HG3 GLN 18 HG3 GLN 18 3.231 -1.808 6.829
128 HE21 GLN 18 HE21 GLN 18 3.148 0.546 6.144
129 HE22 GLN 18 HE22 GLN 18 4.594 1.240 5.512
130 H GLY 19 H GLY 19 5.013 -1.938 11.584
131 HA2 GLY 19 HA3 GLY 19 3.002 -1.654 13.719
132 HA3 GLY 19 HA2 GLY 19 4.767 -1.503 13.886
Start of MODEL 11
1 H1 GLY 1 H GLY 1 2.602 -1.630 1.063
2 HA2 GLY 1 HA3 GLY 1 3.509 -1.268 -1.480
3 HA3 GLY 1 HA2 GLY 1 5.039 -1.365 -0.579
4 H ALA 2 H ALA 2 1.978 -3.445 -0.160
5 HA ALA 2 HA ALA 2 3.375 -5.630 -1.577
6 HB1 ALA 2 HB1 ALA 2 2.970 -7.190 0.357
7 HB2 ALA 2 HB2 ALA 2 3.989 -5.831 0.859
8 HB3 ALA 2 HB3 ALA 2 2.245 -5.849 1.289
9 H PHE 3 H PHE 3 1.386 -7.603 -1.274
10 HA PHE 3 HA PHE 3 -0.462 -6.441 -3.117
11 HB2 PHE 3 HB2 PHE 3 -0.747 -9.134 -1.688
12 HB3 PHE 3 HB3 PHE 3 -1.510 -8.663 -3.227
13 HD1 PHE 3 HD2 PHE 3 0.137 -7.812 -5.139
14 HD2 PHE 3 HD1 PHE 3 1.351 -10.330 -1.866
15 HE1 PHE 3 HE2 PHE 3 2.223 -8.378 -6.343
16 HE2 PHE 3 HE1 PHE 3 3.420 -10.912 -3.085
17 HZ PHE 3 HZ PHE 3 3.881 -9.912 -5.311
18 H VAL 4 H VAL 4 -0.711 -6.830 0.477
19 HA VAL 4 HA VAL 4 -3.319 -5.482 0.300
20 HB VAL 4 HB VAL 4 -3.929 -7.837 -0.135
21 HG11 VAL 4 HG11 VAL 4 -3.511 -9.649 1.537
22 HG12 VAL 4 HG12 VAL 4 -1.976 -9.000 0.915
23 HG13 VAL 4 HG13 VAL 4 -2.553 -8.525 2.538
24 HG21 VAL 4 HG21 VAL 4 -4.735 -7.086 2.745
25 HG22 VAL 4 HG22 VAL 4 -5.506 -6.443 1.262
26 HG23 VAL 4 HG23 VAL 4 -5.609 -8.180 1.645
27 H GLY 5 H GLY 5 -4.060 -4.625 2.423
28 HA2 GLY 5 HA3 GLY 5 -3.242 -5.162 4.879
29 HA3 GLY 5 HA2 GLY 5 -1.765 -4.355 4.299
30 H GLN 6 H GLN 6 -1.788 -2.007 4.160
31 HA GLN 6 HA GLN 6 -4.334 -0.568 4.404
32 HB2 GLN 6 HB2 GLN 6 -3.952 0.197 6.766
33 HB3 GLN 6 HB3 GLN 6 -3.896 -1.559 6.705
34 HG2 GLN 6 HG2 GLN 6 -2.047 -0.824 8.090
35 HG3 GLN 6 HG3 GLN 6 -1.412 -1.473 6.562
36 HE21 GLN 6 HE21 GLN 6 0.639 -0.189 6.790
37 HE22 GLN 6 HE22 GLN 6 0.605 1.526 6.623
38 HA PRO 7 HA PRO 7 -2.054 2.249 2.132
39 HB2 PRO 7 HB2 PRO 7 -2.196 4.826 3.368
40 HB3 PRO 7 HB3 PRO 7 -3.500 4.076 2.409
41 HG2 PRO 7 HG2 PRO 7 -3.170 3.862 5.440
42 HG3 PRO 7 HG3 PRO 7 -4.629 4.393 4.546
43 HD2 PRO 7 HD2 PRO 7 -4.507 1.859 5.378
44 HD3 PRO 7 HD3 PRO 7 -4.917 2.062 3.636
45 H GLU 8 H GLU 8 0.243 2.594 1.850
46 HA GLU 8 HA GLU 8 1.885 2.136 4.214
47 HB2 GLU 8 HB2 GLU 8 2.639 2.798 1.313
48 HB3 GLU 8 HB3 GLU 8 3.828 2.520 2.615
49 HG2 GLU 8 HG2 GLU 8 2.990 0.244 2.998
50 HG3 GLU 8 HG3 GLU 8 1.629 0.501 1.880
51 H ALA 9 H ALA 9 1.624 4.993 1.876
52 HA ALA 9 HA ALA 9 2.907 6.656 3.962
53 HB1 ALA 9 HB1 ALA 9 1.893 7.440 1.166
54 HB2 ALA 9 HB2 ALA 9 2.760 8.494 2.318
55 HB3 ALA 9 HB3 ALA 9 3.568 7.050 1.635
56 H VAL 10 H VAL 10 -0.228 6.789 2.067
57 HA VAL 10 HA VAL 10 -1.833 7.212 4.336
58 HB VAL 10 HB VAL 10 -0.791 9.339 4.773
59 HG11 VAL 10 HG11 VAL 10 -0.523 11.179 3.249
60 HG12 VAL 10 HG12 VAL 10 0.164 9.755 2.427
61 HG13 VAL 10 HG13 VAL 10 -1.448 10.385 1.962
62 HG21 VAL 10 HG21 VAL 10 -2.717 10.873 4.673
63 HG22 VAL 10 HG22 VAL 10 -3.498 9.878 3.417
64 HG23 VAL 10 HG23 VAL 10 -3.275 9.224 5.064
65 H ASN 11 H ASN 11 -1.497 8.351 0.840
66 HA ASN 11 HA ASN 11 -4.340 7.846 0.409
67 HB2 ASN 11 HB2 ASN 11 -3.059 9.504 -0.947
68 HB3 ASN 11 HB3 ASN 11 -2.015 8.219 -1.584
69 HD21 ASN 11 HD21 ASN 11 -3.222 6.355 -2.851
70 HD22 ASN 11 HD22 ASN 11 -4.558 6.868 -3.805
71 HA PRO 12 HA PRO 12 -3.266 3.410 0.117
72 HB2 PRO 12 HB2 PRO 12 -5.405 2.342 -1.253
73 HB3 PRO 12 HB3 PRO 12 -5.611 3.123 0.342
74 HG2 PRO 12 HG2 PRO 12 -5.953 4.512 -2.372
75 HG3 PRO 12 HG3 PRO 12 -7.209 4.343 -1.102
76 HD2 PRO 12 HD2 PRO 12 -5.705 6.600 -1.185
77 HD3 PRO 12 HD3 PRO 12 -5.931 5.818 0.420
78 H LEU 13 H LEU 13 -1.349 4.412 -1.238
79 HA LEU 13 HA LEU 13 -1.505 3.593 -4.092
80 HB2 LEU 13 HB2 LEU 13 0.926 4.502 -2.447
81 HB3 LEU 13 HB3 LEU 13 0.884 4.225 -4.201
82 HG LEU 13 HG LEU 13 -0.732 6.376 -2.695
83 HD11 LEU 13 HD11 LEU 13 1.851 6.661 -4.346
84 HD12 LEU 13 HD12 LEU 13 1.718 6.832 -2.572
85 HD13 LEU 13 HD13 LEU 13 0.917 8.011 -3.639
86 HD21 LEU 13 HD21 LEU 13 -1.846 5.771 -4.878
87 HD22 LEU 13 HD22 LEU 13 -0.286 5.963 -5.725
88 HD23 LEU 13 HD23 LEU 13 -1.098 7.374 -4.990
89 H GLY 14 H GLY 14 0.335 2.692 -1.012
90 HA2 GLY 14 HA3 GLY 14 0.763 -0.016 -2.240
91 HA3 GLY 14 HA2 GLY 14 1.800 0.781 -1.047
92 H ARG 15 H ARG 15 0.572 -1.828 -0.668
93 HA ARG 15 HA ARG 15 -1.171 -1.216 1.700
94 HB2 ARG 15 HB2 ARG 15 -1.543 -3.570 -0.252
95 HB3 ARG 15 HB3 ARG 15 -2.503 -3.122 1.176
96 HG2 ARG 15 HG2 ARG 15 -3.856 -2.297 -0.525
97 HG3 ARG 15 HG3 ARG 15 -2.931 -0.840 -0.102
98 HD2 ARG 15 HD2 ARG 15 -2.977 -0.971 -2.566
99 HD3 ARG 15 HD3 ARG 15 -1.369 -1.412 -2.082
100 HE ARG 15 HE ARG 15 -1.617 -3.577 -2.821
101 HH11 ARG 15 HH11 ARG 15 -4.908 -2.061 -2.662
102 HH12 ARG 15 HH12 ARG 15 -5.615 -3.381 -3.576
103 HH21 ARG 15 HH21 ARG 15 -2.650 -5.203 -3.961
104 HH22 ARG 15 HH22 ARG 15 -4.381 -5.120 -4.287
105 H GLU 16 H GLU 16 0.704 -1.467 3.214
106 HA GLU 16 HA GLU 16 1.335 -4.395 3.595
107 HB2 GLU 16 HB2 GLU 16 3.149 -1.950 3.954
108 HB3 GLU 16 HB3 GLU 16 3.394 -3.401 4.955
109 HG2 GLU 16 HG2 GLU 16 3.929 -4.816 3.133
110 HG3 GLU 16 HG3 GLU 16 3.371 -3.624 1.940
111 H ILE 17 H ILE 17 0.903 -5.094 5.781
112 HA ILE 17 HA ILE 17 -0.088 -3.038 7.649
113 HB ILE 17 HB ILE 17 -0.252 -4.779 9.354
114 HG12 ILE 17 HG12 ILE 17 0.379 -6.881 7.179
115 HG13 ILE 17 HG13 ILE 17 1.555 -6.344 8.406
116 HG21 ILE 17 HG21 ILE 17 -1.707 -5.502 6.745
117 HG22 ILE 17 HG22 ILE 17 -2.303 -5.835 8.395
118 HG23 ILE 17 HG23 ILE 17 -2.188 -4.162 7.822
119 HD11 ILE 17 HD11 ILE 17 -1.111 -7.774 8.986
120 HD12 ILE 17 HD12 ILE 17 0.531 -8.438 9.125
121 HD13 ILE 17 HD13 ILE 17 0.007 -7.135 10.228
122 H GLN 18 H GLN 18 1.176 -2.147 9.386
123 HA GLN 18 HA GLN 18 3.947 -3.173 9.684
124 HB2 GLN 18 HB2 GLN 18 3.255 -0.287 8.811
125 HB3 GLN 18 HB3 GLN 18 4.882 -0.871 9.260
126 HG2 GLN 18 HG2 GLN 18 4.795 -2.516 7.326
127 HG3 GLN 18 HG3 GLN 18 3.230 -1.809 6.838
128 HE21 GLN 18 HE21 GLN 18 3.182 0.566 6.196
129 HE22 GLN 18 HE22 GLN 18 4.626 1.228 5.528
130 H GLY 19 H GLY 19 5.076 -1.987 11.573
131 HA2 GLY 19 HA3 GLY 19 3.092 -1.666 13.729
132 HA3 GLY 19 HA2 GLY 19 4.861 -1.554 13.880
Start of MODEL 12
1 H1 GLY 1 H GLY 1 2.607 -1.625 1.066
2 HA2 GLY 1 HA3 GLY 1 3.551 -1.254 -1.466
3 HA3 GLY 1 HA2 GLY 1 5.065 -1.358 -0.539
4 H ALA 2 H ALA 2 1.985 -3.417 -0.197
5 HA ALA 2 HA ALA 2 3.384 -5.606 -1.592
6 HB1 ALA 2 HB1 ALA 2 2.984 -7.175 0.335
7 HB2 ALA 2 HB2 ALA 2 3.999 -5.816 0.845
8 HB3 ALA 2 HB3 ALA 2 2.255 -5.841 1.272
9 H PHE 3 H PHE 3 1.425 -7.587 -1.325
10 HA PHE 3 HA PHE 3 -0.445 -6.434 -3.139
11 HB2 PHE 3 HB2 PHE 3 -0.724 -9.122 -1.695
12 HB3 PHE 3 HB3 PHE 3 -1.500 -8.658 -3.229
13 HD1 PHE 3 HD1 PHE 3 0.141 -7.812 -5.156
14 HD2 PHE 3 HD2 PHE 3 1.361 -10.335 -1.888
15 HE1 PHE 3 HE1 PHE 3 2.211 -8.397 -6.375
16 HE2 PHE 3 HE2 PHE 3 3.412 -10.939 -3.124
17 HZ PHE 3 HZ PHE 3 3.863 -9.947 -5.356
18 H VAL 4 H VAL 4 -0.683 -6.812 0.459
19 HA VAL 4 HA VAL 4 -3.292 -5.467 0.285
20 HB VAL 4 HB VAL 4 -3.892 -7.827 -0.152
21 HG11 VAL 4 HG11 VAL 4 -2.534 -8.501 2.534
22 HG12 VAL 4 HG12 VAL 4 -3.480 -9.632 1.529
23 HG13 VAL 4 HG13 VAL 4 -1.941 -8.981 0.918
24 HG21 VAL 4 HG21 VAL 4 -4.722 -7.070 2.719
25 HG22 VAL 4 HG22 VAL 4 -5.481 -6.431 1.229
26 HG23 VAL 4 HG23 VAL 4 -5.584 -8.168 1.613
27 H GLY 5 H GLY 5 -4.043 -4.625 2.413
28 HA2 GLY 5 HA3 GLY 5 -3.220 -5.163 4.868
29 HA3 GLY 5 HA2 GLY 5 -1.751 -4.343 4.290
30 H GLN 6 H GLN 6 -1.792 -1.997 4.161
31 HA GLN 6 HA GLN 6 -4.348 -0.574 4.375
32 HB2 GLN 6 HB2 GLN 6 -3.988 0.206 6.740
33 HB3 GLN 6 HB3 GLN 6 -3.951 -1.550 6.684
34 HG2 GLN 6 HG2 GLN 6 -2.117 -0.817 8.096
35 HG3 GLN 6 HG3 GLN 6 -1.468 -1.501 6.591
36 HE21 GLN 6 HE21 GLN 6 0.597 -0.235 6.771
37 HE22 GLN 6 HE22 GLN 6 0.582 1.480 6.601
38 HA PRO 7 HA PRO 7 -2.059 2.247 2.122
39 HB2 PRO 7 HB2 PRO 7 -2.207 4.825 3.364
40 HB3 PRO 7 HB3 PRO 7 -3.501 4.081 2.389
41 HG2 PRO 7 HG2 PRO 7 -3.203 3.858 5.422
42 HG3 PRO 7 HG3 PRO 7 -4.653 4.392 4.514
43 HD2 PRO 7 HD2 PRO 7 -4.544 1.856 5.341
44 HD3 PRO 7 HD3 PRO 7 -4.930 2.062 3.594
45 H GLU 8 H GLU 8 0.239 2.592 1.852
46 HA GLU 8 HA GLU 8 1.871 2.142 4.225
47 HB2 GLU 8 HB2 GLU 8 2.636 2.798 1.326
48 HB3 GLU 8 HB3 GLU 8 3.819 2.527 2.633
49 HG2 GLU 8 HG2 GLU 8 2.989 0.249 3.016
50 HG3 GLU 8 HG3 GLU 8 1.631 0.498 1.892
51 H ALA 9 H ALA 9 1.613 4.988 1.874
52 HA ALA 9 HA ALA 9 2.895 6.662 3.949
53 HB1 ALA 9 HB1 ALA 9 3.546 7.046 1.616
54 HB2 ALA 9 HB2 ALA 9 1.869 7.432 1.153
55 HB3 ALA 9 HB3 ALA 9 2.741 8.492 2.297
56 H VAL 10 H VAL 10 -0.247 6.777 2.066
57 HA VAL 10 HA VAL 10 -1.847 7.208 4.334
58 HB VAL 10 HB VAL 10 -0.810 9.339 4.763
59 HG11 VAL 10 HG11 VAL 10 0.144 9.749 2.416
60 HG12 VAL 10 HG12 VAL 10 -1.471 10.373 1.949
61 HG13 VAL 10 HG13 VAL 10 -0.548 11.174 3.233
62 HG21 VAL 10 HG21 VAL 10 -2.739 10.868 4.661
63 HG22 VAL 10 HG22 VAL 10 -3.519 9.868 3.408
64 HG23 VAL 10 HG23 VAL 10 -3.293 9.219 5.056
65 H ASN 11 H ASN 11 -1.516 8.334 0.833
66 HA ASN 11 HA ASN 11 -4.359 7.815 0.409
67 HB2 ASN 11 HB2 ASN 11 -3.091 9.487 -0.946
68 HB3 ASN 11 HB3 ASN 11 -2.043 8.208 -1.591
69 HD21 ASN 11 HD21 ASN 11 -3.253 6.339 -2.855
70 HD22 ASN 11 HD22 ASN 11 -4.595 6.851 -3.800
71 HA PRO 12 HA PRO 12 -3.246 3.389 0.109
72 HB2 PRO 12 HB2 PRO 12 -5.384 2.303 -1.245
73 HB3 PRO 12 HB3 PRO 12 -5.587 3.082 0.352
74 HG2 PRO 12 HG2 PRO 12 -5.960 4.468 -2.360
75 HG3 PRO 12 HG3 PRO 12 -7.205 4.288 -1.081
76 HD2 PRO 12 HD2 PRO 12 -5.720 6.557 -1.177
77 HD3 PRO 12 HD3 PRO 12 -5.930 5.776 0.431
78 H LEU 13 H LEU 13 -1.345 4.400 -1.253
79 HA LEU 13 HA LEU 13 -1.512 3.575 -4.107
80 HB2 LEU 13 HB2 LEU 13 0.920 4.517 -2.484
81 HB3 LEU 13 HB3 LEU 13 0.865 4.237 -4.237
82 HG LEU 13 HG LEU 13 -0.762 6.371 -2.718
83 HD11 LEU 13 HD11 LEU 13 0.854 8.024 -3.681
84 HD12 LEU 13 HD12 LEU 13 1.798 6.686 -4.397
85 HD13 LEU 13 HD13 LEU 13 1.682 6.856 -2.621
86 HD21 LEU 13 HD21 LEU 13 -0.344 5.959 -5.752
87 HD22 LEU 13 HD22 LEU 13 -1.165 7.360 -5.009
88 HD23 LEU 13 HD23 LEU 13 -1.891 5.747 -4.887
89 H GLY 14 H GLY 14 0.369 2.704 -1.042
90 HA2 GLY 14 HA3 GLY 14 0.794 -0.010 -2.255
91 HA3 GLY 14 HA2 GLY 14 1.832 0.792 -1.066
92 H ARG 15 H ARG 15 0.544 -1.825 -0.705
93 HA ARG 15 HA ARG 15 -1.160 -1.179 1.685
94 HB2 ARG 15 HB2 ARG 15 -1.568 -3.531 -0.258
95 HB3 ARG 15 HB3 ARG 15 -2.505 -3.084 1.186
96 HG2 ARG 15 HG2 ARG 15 -3.878 -2.249 -0.494
97 HG3 ARG 15 HG3 ARG 15 -2.947 -0.794 -0.072
98 HD2 ARG 15 HD2 ARG 15 -3.042 -0.919 -2.539
99 HD3 ARG 15 HD3 ARG 15 -1.418 -1.326 -2.077
100 HE ARG 15 HE ARG 15 -1.628 -3.493 -2.821
101 HH11 ARG 15 HH11 ARG 15 -4.950 -2.052 -2.618
102 HH12 ARG 15 HH12 ARG 15 -5.640 -3.388 -3.520
103 HH21 ARG 15 HH21 ARG 15 -2.640 -5.143 -3.945
104 HH22 ARG 15 HH22 ARG 15 -4.376 -5.099 -4.248
105 H GLU 16 H GLU 16 0.683 -1.457 3.216
106 HA GLU 16 HA GLU 16 1.295 -4.388 3.589
107 HB2 GLU 16 HB2 GLU 16 3.132 -1.958 3.952
108 HB3 GLU 16 HB3 GLU 16 3.361 -3.407 4.959
109 HG2 GLU 16 HG2 GLU 16 3.882 -4.834 3.137
110 HG3 GLU 16 HG3 GLU 16 3.352 -3.629 1.942
111 H ILE 17 H ILE 17 0.940 -5.077 5.798
112 HA ILE 17 HA ILE 17 -0.049 -3.001 7.662
113 HB ILE 17 HB ILE 17 -0.278 -4.719 9.355
114 HG12 ILE 17 HG12 ILE 17 0.466 -6.847 7.242
115 HG13 ILE 17 HG13 ILE 17 1.561 -6.291 8.533
116 HG21 ILE 17 HG21 ILE 17 -2.161 -4.144 7.731
117 HG22 ILE 17 HG22 ILE 17 -1.649 -5.526 6.723
118 HG23 ILE 17 HG23 ILE 17 -2.297 -5.792 8.366
119 HD11 ILE 17 HD11 ILE 17 0.516 -8.383 9.217
120 HD12 ILE 17 HD12 ILE 17 -0.094 -7.073 10.266
121 HD13 ILE 17 HD13 ILE 17 -1.122 -7.742 8.961
122 H GLN 18 H GLN 18 1.240 -2.167 9.420
123 HA GLN 18 HA GLN 18 4.018 -3.204 9.628
124 HB2 GLN 18 HB2 GLN 18 3.306 -0.298 8.849
125 HB3 GLN 18 HB3 GLN 18 4.944 -0.900 9.227
126 HG2 GLN 18 HG2 GLN 18 4.779 -2.495 7.253
127 HG3 GLN 18 HG3 GLN 18 3.205 -1.763 6.834
128 HE21 GLN 18 HE21 GLN 18 3.165 0.653 6.307
129 HE22 GLN 18 HE22 GLN 18 4.588 1.313 5.590
130 H GLY 19 H GLY 19 5.198 -2.062 11.517
131 HA2 GLY 19 HA3 GLY 19 3.369 -1.981 13.761
132 HA3 GLY 19 HA2 GLY 19 5.098 -1.543 13.803
Start of MODEL 13
1 H1 GLY 1 H GLY 1 2.615 -1.630 1.059
2 HA2 GLY 1 HA3 GLY 1 3.560 -1.265 -1.470
3 HA3 GLY 1 HA2 GLY 1 5.077 -1.369 -0.548
4 H ALA 2 H ALA 2 1.988 -3.412 -0.217
5 HA ALA 2 HA ALA 2 3.380 -5.612 -1.600
6 HB1 ALA 2 HB1 ALA 2 2.261 -5.838 1.269
7 HB2 ALA 2 HB2 ALA 2 2.976 -7.178 0.330
8 HB3 ALA 2 HB3 ALA 2 4.004 -5.826 0.833
9 H PHE 3 H PHE 3 1.425 -7.588 -1.338
10 HA PHE 3 HA PHE 3 -0.451 -6.437 -3.140
11 HB2 PHE 3 HB2 PHE 3 -0.735 -9.117 -1.684
12 HB3 PHE 3 HB3 PHE 3 -1.516 -8.657 -3.216
13 HD1 PHE 3 HD2 PHE 3 0.115 -7.824 -5.156
14 HD2 PHE 3 HD1 PHE 3 1.344 -10.341 -1.887
15 HE1 PHE 3 HE2 PHE 3 2.173 -8.427 -6.389
16 HE2 PHE 3 HE1 PHE 3 3.382 -10.963 -3.137
17 HZ PHE 3 HZ PHE 3 3.822 -9.983 -5.376
18 H VAL 4 H VAL 4 -0.684 -6.809 0.461
19 HA VAL 4 HA VAL 4 -3.288 -5.454 0.290
20 HB VAL 4 HB VAL 4 -3.894 -7.811 -0.152
21 HG11 VAL 4 HG11 VAL 4 -2.546 -8.492 2.537
22 HG12 VAL 4 HG12 VAL 4 -3.492 -9.619 1.529
23 HG13 VAL 4 HG13 VAL 4 -1.949 -8.974 0.923
24 HG21 VAL 4 HG21 VAL 4 -5.592 -8.148 1.608
25 HG22 VAL 4 HG22 VAL 4 -4.728 -7.054 2.718
26 HG23 VAL 4 HG23 VAL 4 -5.483 -6.411 1.226
27 H GLY 5 H GLY 5 -4.038 -4.615 2.420
28 HA2 GLY 5 HA3 GLY 5 -3.213 -5.149 4.878
29 HA3 GLY 5 HA2 GLY 5 -1.743 -4.335 4.294
30 H GLN 6 H GLN 6 -1.778 -1.989 4.175
31 HA GLN 6 HA GLN 6 -4.333 -0.561 4.369
32 HB2 GLN 6 HB2 GLN 6 -3.985 0.226 6.735
33 HB3 GLN 6 HB3 GLN 6 -3.959 -1.530 6.680
34 HG2 GLN 6 HG2 GLN 6 -2.133 -0.798 8.108
35 HG3 GLN 6 HG3 GLN 6 -1.477 -1.499 6.615
36 HE21 GLN 6 HE21 GLN 6 0.595 -0.254 6.782
37 HE22 GLN 6 HE22 GLN 6 0.597 1.461 6.606
38 HA PRO 7 HA PRO 7 -2.029 2.252 2.121
39 HB2 PRO 7 HB2 PRO 7 -2.162 4.828 3.366
40 HB3 PRO 7 HB3 PRO 7 -3.459 4.095 2.385
41 HG2 PRO 7 HG2 PRO 7 -3.172 3.868 5.419
42 HG3 PRO 7 HG3 PRO 7 -4.616 4.411 4.506
43 HD2 PRO 7 HD2 PRO 7 -4.527 1.875 5.331
44 HD3 PRO 7 HD3 PRO 7 -4.903 2.083 3.583
45 H GLU 8 H GLU 8 0.271 2.587 1.855
46 HA GLU 8 HA GLU 8 1.897 2.131 4.231
47 HB2 GLU 8 HB2 GLU 8 2.670 2.786 1.334
48 HB3 GLU 8 HB3 GLU 8 3.850 2.510 2.643
49 HG2 GLU 8 HG2 GLU 8 3.014 0.233 3.020
50 HG3 GLU 8 HG3 GLU 8 1.655 0.490 1.899
51 H ALA 9 H ALA 9 1.640 4.977 1.881
52 HA ALA 9 HA ALA 9 2.930 6.652 3.950
53 HB1 ALA 9 HB1 ALA 9 1.880 7.424 1.163
54 HB2 ALA 9 HB2 ALA 9 2.760 8.483 2.301
55 HB3 ALA 9 HB3 ALA 9 3.562 7.039 1.612
56 H VAL 10 H VAL 10 -0.226 6.756 2.091
57 HA VAL 10 HA VAL 10 -1.816 7.183 4.364
58 HB VAL 10 HB VAL 10 -0.781 9.313 4.802
59 HG11 VAL 10 HG11 VAL 10 -1.453 10.358 1.994
60 HG12 VAL 10 HG12 VAL 10 -0.530 11.157 3.278
61 HG13 VAL 10 HG13 VAL 10 0.164 9.738 2.454
62 HG21 VAL 10 HG21 VAL 10 -3.495 9.844 3.458
63 HG22 VAL 10 HG22 VAL 10 -3.264 9.185 5.102
64 HG23 VAL 10 HG23 VAL 10 -2.713 10.838 4.714
65 H ASN 11 H ASN 11 -1.490 8.321 0.868
66 HA ASN 11 HA ASN 11 -4.335 7.809 0.445
67 HB2 ASN 11 HB2 ASN 11 -3.067 9.486 -0.901
68 HB3 ASN 11 HB3 ASN 11 -2.023 8.210 -1.557
69 HD21 ASN 11 HD21 ASN 11 -3.240 6.352 -2.829
70 HD22 ASN 11 HD22 ASN 11 -4.582 6.872 -3.769
71 HA PRO 12 HA PRO 12 -3.232 3.381 0.117
72 HB2 PRO 12 HB2 PRO 12 -5.371 2.311 -1.247
73 HB3 PRO 12 HB3 PRO 12 -5.573 3.077 0.356
74 HG2 PRO 12 HG2 PRO 12 -5.943 4.484 -2.345
75 HG3 PRO 12 HG3 PRO 12 -7.189 4.297 -1.067
76 HD2 PRO 12 HD2 PRO 12 -5.700 6.565 -1.145
77 HD3 PRO 12 HD3 PRO 12 -5.910 5.770 0.457
78 H LEU 13 H LEU 13 -1.325 4.389 -1.233
79 HA LEU 13 HA LEU 13 -1.493 3.581 -4.093
80 HB2 LEU 13 HB2 LEU 13 0.938 4.521 -2.468
81 HB3 LEU 13 HB3 LEU 13 0.882 4.251 -4.223
82 HG LEU 13 HG LEU 13 -0.750 6.371 -2.688
83 HD11 LEU 13 HD11 LEU 13 1.693 6.863 -2.594
84 HD12 LEU 13 HD12 LEU 13 0.859 8.035 -3.645
85 HD13 LEU 13 HD13 LEU 13 1.807 6.704 -4.371
86 HD21 LEU 13 HD21 LEU 13 -1.160 7.372 -4.972
87 HD22 LEU 13 HD22 LEU 13 -1.881 5.756 -4.859
88 HD23 LEU 13 HD23 LEU 13 -0.336 5.978 -5.726
89 H GLY 14 H GLY 14 0.396 2.699 -1.035
90 HA2 GLY 14 HA3 GLY 14 0.812 -0.013 -2.257
91 HA3 GLY 14 HA2 GLY 14 1.856 0.784 -1.069
92 H ARG 15 H ARG 15 0.529 -1.836 -0.727
93 HA ARG 15 HA ARG 15 -1.144 -1.180 1.683
94 HB2 ARG 15 HB2 ARG 15 -1.586 -3.520 -0.268
95 HB3 ARG 15 HB3 ARG 15 -2.510 -3.072 1.185
96 HG2 ARG 15 HG2 ARG 15 -3.886 -2.221 -0.484
97 HG3 ARG 15 HG3 ARG 15 -2.945 -0.775 -0.057
98 HD2 ARG 15 HD2 ARG 15 -3.065 -0.892 -2.528
99 HD3 ARG 15 HD3 ARG 15 -1.436 -1.285 -2.074
100 HE ARG 15 HE ARG 15 -1.630 -3.453 -2.824
101 HH11 ARG 15 HH11 ARG 15 -4.964 -2.042 -2.602
102 HH12 ARG 15 HH12 ARG 15 -5.646 -3.385 -3.500
103 HH21 ARG 15 HH21 ARG 15 -2.633 -5.111 -3.943
104 HH22 ARG 15 HH22 ARG 15 -4.372 -5.083 -4.236
105 H GLU 16 H GLU 16 0.705 -1.479 3.198
106 HA GLU 16 HA GLU 16 1.309 -4.415 3.549
107 HB2 GLU 16 HB2 GLU 16 3.132 -1.982 3.957
108 HB3 GLU 16 HB3 GLU 16 3.357 -3.440 4.951
109 HG2 GLU 16 HG2 GLU 16 3.901 -4.846 3.119
110 HG3 GLU 16 HG3 GLU 16 3.381 -3.630 1.931
111 H ILE 17 H ILE 17 0.976 -5.128 5.759
112 HA ILE 17 HA ILE 17 -0.117 -3.098 7.607
113 HB ILE 17 HB ILE 17 -0.324 -4.808 9.293
114 HG12 ILE 17 HG12 ILE 17 0.637 -6.908 7.239
115 HG13 ILE 17 HG13 ILE 17 1.618 -6.291 8.592
116 HG21 ILE 17 HG21 ILE 17 -2.250 -5.987 8.255
117 HG22 ILE 17 HG22 ILE 17 -2.167 -4.353 7.575
118 HG23 ILE 17 HG23 ILE 17 -1.552 -5.738 6.629
119 HD11 ILE 17 HD11 ILE 17 -0.097 -7.156 10.223
120 HD12 ILE 17 HD12 ILE 17 -1.000 -7.887 8.860
121 HD13 ILE 17 HD13 ILE 17 0.651 -8.434 9.226
122 H GLN 18 H GLN 18 1.128 -2.160 9.344
123 HA GLN 18 HA GLN 18 3.923 -3.120 9.646
124 HB2 GLN 18 HB2 GLN 18 3.167 -0.253 8.768
125 HB3 GLN 18 HB3 GLN 18 4.807 -0.807 9.210
126 HG2 GLN 18 HG2 GLN 18 4.731 -2.463 7.278
127 HG3 GLN 18 HG3 GLN 18 3.160 -1.769 6.791
128 HE21 GLN 18 HE21 GLN 18 3.106 0.639 6.209
129 HE22 GLN 18 HE22 GLN 18 4.540 1.300 5.516
130 H GLY 19 H GLY 19 5.029 -1.891 11.528
131 HA2 GLY 19 HA3 GLY 19 3.158 -1.816 13.730
132 HA3 GLY 19 HA2 GLY 19 4.864 -1.297 13.791
Start of MODEL 14
1 H1 GLY 1 H GLY 1 2.586 -1.603 1.055
2 HA2 GLY 1 HA3 GLY 1 3.469 -1.258 -1.496
3 HA3 GLY 1 HA2 GLY 1 5.009 -1.348 -0.613
4 H ALA 2 H ALA 2 1.969 -3.442 -0.120
5 HA ALA 2 HA ALA 2 3.357 -5.631 -1.549
6 HB1 ALA 2 HB1 ALA 2 2.223 -5.814 1.319
7 HB2 ALA 2 HB2 ALA 2 2.924 -7.175 0.397
8 HB3 ALA 2 HB3 ALA 2 3.966 -5.829 0.886
9 H PHE 3 H PHE 3 1.363 -7.591 -1.254
10 HA PHE 3 HA PHE 3 -0.473 -6.416 -3.108
11 HB2 PHE 3 HB2 PHE 3 -0.775 -9.120 -1.705
12 HB3 PHE 3 HB3 PHE 3 -1.504 -8.638 -3.259
13 HD1 PHE 3 HD2 PHE 3 0.198 -7.752 -5.120
14 HD2 PHE 3 HD1 PHE 3 1.310 -10.340 -1.861
15 HE1 PHE 3 HE2 PHE 3 2.316 -8.303 -6.275
16 HE2 PHE 3 HE1 PHE 3 3.409 -10.909 -3.035
17 HZ PHE 3 HZ PHE 3 3.938 -9.866 -5.227
18 H VAL 4 H VAL 4 -0.736 -6.837 0.481
19 HA VAL 4 HA VAL 4 -3.347 -5.492 0.306
20 HB VAL 4 HB VAL 4 -3.956 -7.844 -0.137
21 HG11 VAL 4 HG11 VAL 4 -2.569 -8.547 2.528
22 HG12 VAL 4 HG12 VAL 4 -3.531 -9.665 1.524
23 HG13 VAL 4 HG13 VAL 4 -1.998 -9.011 0.899
24 HG21 VAL 4 HG21 VAL 4 -5.628 -8.199 1.651
25 HG22 VAL 4 HG22 VAL 4 -4.749 -7.107 2.750
26 HG23 VAL 4 HG23 VAL 4 -5.529 -6.460 1.273
27 H GLY 5 H GLY 5 -4.081 -4.632 2.428
28 HA2 GLY 5 HA3 GLY 5 -3.258 -5.161 4.881
29 HA3 GLY 5 HA2 GLY 5 -1.777 -4.366 4.295
30 H GLN 6 H GLN 6 -1.782 -2.016 4.174
31 HA GLN 6 HA GLN 6 -4.324 -0.564 4.410
32 HB2 GLN 6 HB2 GLN 6 -3.942 0.189 6.778
33 HB3 GLN 6 HB3 GLN 6 -3.891 -1.567 6.706
34 HG2 GLN 6 HG2 GLN 6 -2.043 -0.836 8.101
35 HG3 GLN 6 HG3 GLN 6 -1.403 -1.483 6.574
36 HE21 GLN 6 HE21 GLN 6 0.647 -0.204 6.804
37 HE22 GLN 6 HE22 GLN 6 0.616 1.513 6.640
38 HA PRO 7 HA PRO 7 -2.038 2.250 2.140
39 HB2 PRO 7 HB2 PRO 7 -2.177 4.820 3.380
40 HB3 PRO 7 HB3 PRO 7 -3.484 4.071 2.421
41 HG2 PRO 7 HG2 PRO 7 -3.142 3.866 5.447
42 HG3 PRO 7 HG3 PRO 7 -4.606 4.393 4.556
43 HD2 PRO 7 HD2 PRO 7 -4.492 1.861 5.395
44 HD3 PRO 7 HD3 PRO 7 -4.902 2.062 3.653
45 H GLU 8 H GLU 8 0.251 2.650 1.848
46 HA GLU 8 HA GLU 8 1.904 2.161 4.205
47 HB2 GLU 8 HB2 GLU 8 2.646 2.827 1.303
48 HB3 GLU 8 HB3 GLU 8 3.840 2.538 2.597
49 HG2 GLU 8 HG2 GLU 8 2.984 0.267 2.977
50 HG3 GLU 8 HG3 GLU 8 1.622 0.540 1.863
51 H ALA 9 H ALA 9 1.644 5.024 1.873
52 HA ALA 9 HA ALA 9 2.919 6.684 3.966
53 HB1 ALA 9 HB1 ALA 9 3.584 7.086 1.642
54 HB2 ALA 9 HB2 ALA 9 1.909 7.473 1.171
55 HB3 ALA 9 HB3 ALA 9 2.771 8.525 2.328
56 H VAL 10 H VAL 10 -0.213 6.808 2.064
57 HA VAL 10 HA VAL 10 -1.823 7.223 4.331
58 HB VAL 10 HB VAL 10 -0.791 9.355 4.769
59 HG11 VAL 10 HG11 VAL 10 0.168 9.771 2.426
60 HG12 VAL 10 HG12 VAL 10 -1.445 10.397 1.956
61 HG13 VAL 10 HG13 VAL 10 -0.526 11.194 3.245
62 HG21 VAL 10 HG21 VAL 10 -3.497 9.884 3.404
63 HG22 VAL 10 HG22 VAL 10 -3.276 9.231 5.053
64 HG23 VAL 10 HG23 VAL 10 -2.721 10.882 4.662
65 H ASN 11 H ASN 11 -1.489 8.362 0.834
66 HA ASN 11 HA ASN 11 -4.331 7.864 0.402
67 HB2 ASN 11 HB2 ASN 11 -3.040 9.510 -0.955
68 HB3 ASN 11 HB3 ASN 11 -2.003 8.218 -1.591
69 HD21 ASN 11 HD21 ASN 11 -3.223 6.359 -2.854
70 HD22 ASN 11 HD22 ASN 11 -4.556 6.879 -3.809
71 HA PRO 12 HA PRO 12 -3.286 3.421 0.120
72 HB2 PRO 12 HB2 PRO 12 -5.431 2.365 -1.247
73 HB3 PRO 12 HB3 PRO 12 -5.633 3.151 0.346
74 HG2 PRO 12 HG2 PRO 12 -5.965 4.534 -2.371
75 HG3 PRO 12 HG3 PRO 12 -7.222 4.377 -1.101
76 HD2 PRO 12 HD2 PRO 12 -5.703 6.625 -1.189
77 HD3 PRO 12 HD3 PRO 12 -5.935 5.847 0.419
78 H LEU 13 H LEU 13 -1.364 4.411 -1.240
79 HA LEU 13 HA LEU 13 -1.527 3.585 -4.092
80 HB2 LEU 13 HB2 LEU 13 0.911 4.484 -2.452
81 HB3 LEU 13 HB3 LEU 13 0.867 4.201 -4.205
82 HG LEU 13 HG LEU 13 -0.734 6.367 -2.704
83 HD11 LEU 13 HD11 LEU 13 0.924 7.988 -3.656
84 HD12 LEU 13 HD12 LEU 13 1.849 6.630 -4.360
85 HD13 LEU 13 HD13 LEU 13 1.719 6.807 -2.586
86 HD21 LEU 13 HD21 LEU 13 -1.096 7.360 -5.002
87 HD22 LEU 13 HD22 LEU 13 -1.855 5.762 -4.883
88 HD23 LEU 13 HD23 LEU 13 -0.295 5.940 -5.733
89 H GLY 14 H GLY 14 0.309 2.679 -1.011
90 HA2 GLY 14 HA3 GLY 14 0.733 -0.029 -2.239
91 HA3 GLY 14 HA2 GLY 14 1.772 0.769 -1.048
92 H ARG 15 H ARG 15 0.556 -1.840 -0.660
93 HA ARG 15 HA ARG 15 -1.192 -1.230 1.705
94 HB2 ARG 15 HB2 ARG 15 -1.561 -3.584 -0.247
95 HB3 ARG 15 HB3 ARG 15 -2.525 -3.133 1.177
96 HG2 ARG 15 HG2 ARG 15 -3.871 -2.310 -0.533
97 HG3 ARG 15 HG3 ARG 15 -2.946 -0.854 -0.107
98 HD2 ARG 15 HD2 ARG 15 -2.976 -0.987 -2.572
99 HD3 ARG 15 HD3 ARG 15 -1.374 -1.442 -2.082
100 HE ARG 15 HE ARG 15 -1.638 -3.605 -2.818
101 HH11 ARG 15 HH11 ARG 15 -4.916 -2.059 -2.677
102 HH12 ARG 15 HH12 ARG 15 -5.629 -3.371 -3.598
103 HH21 ARG 15 HH21 ARG 15 -2.680 -5.220 -3.967
104 HH22 ARG 15 HH22 ARG 15 -4.408 -5.120 -4.303
105 H GLU 16 H GLU 16 0.736 -1.460 3.179
106 HA GLU 16 HA GLU 16 1.384 -4.386 3.571
107 HB2 GLU 16 HB2 GLU 16 3.154 -1.917 3.952
108 HB3 GLU 16 HB3 GLU 16 3.416 -3.367 4.947
109 HG2 GLU 16 HG2 GLU 16 3.977 -4.771 3.123
110 HG3 GLU 16 HG3 GLU 16 3.428 -3.576 1.929
111 H ILE 17 H ILE 17 0.947 -5.101 5.750
112 HA ILE 17 HA ILE 17 -0.070 -3.064 7.630
113 HB ILE 17 HB ILE 17 -0.223 -4.825 9.321
114 HG12 ILE 17 HG12 ILE 17 0.399 -6.902 7.120
115 HG13 ILE 17 HG13 ILE 17 1.586 -6.373 8.340
116 HG21 ILE 17 HG21 ILE 17 -1.684 -5.519 6.710
117 HG22 ILE 17 HG22 ILE 17 -2.272 -5.876 8.358
118 HG23 ILE 17 HG23 ILE 17 -2.166 -4.195 7.806
119 HD11 ILE 17 HD11 ILE 17 0.571 -8.480 9.049
120 HD12 ILE 17 HD12 ILE 17 0.060 -7.187 10.170
121 HD13 ILE 17 HD13 ILE 17 -1.072 -7.814 8.933
122 H GLN 18 H GLN 18 1.183 -2.187 9.382
123 HA GLN 18 HA GLN 18 3.957 -3.203 9.678
124 HB2 GLN 18 HB2 GLN 18 3.257 -0.311 8.836
125 HB3 GLN 18 HB3 GLN 18 4.883 -0.893 9.288
126 HG2 GLN 18 HG2 GLN 18 4.815 -2.515 7.333
127 HG3 GLN 18 HG3 GLN 18 3.248 -1.812 6.848
128 HE21 GLN 18 HE21 GLN 18 3.186 0.547 6.189
129 HE22 GLN 18 HE22 GLN 18 4.634 1.234 5.555
130 H GLY 19 H GLY 19 5.072 -2.050 11.590
131 HA2 GLY 19 HA3 GLY 19 3.074 -1.743 13.736
132 HA3 GLY 19 HA2 GLY 19 4.843 -1.650 13.902
Start of MODEL 15
1 H1 GLY 1 H GLY 1 2.617 -1.627 1.062
2 HA2 GLY 1 HA3 GLY 1 3.634 -1.256 -1.451
3 HA3 GLY 1 HA2 GLY 1 5.117 -1.383 -0.475
4 H ALA 2 H ALA 2 2.002 -3.389 -0.247
5 HA ALA 2 HA ALA 2 3.387 -5.601 -1.607
6 HB1 ALA 2 HB1 ALA 2 2.278 -5.835 1.261
7 HB2 ALA 2 HB2 ALA 2 3.011 -7.166 0.323
8 HB3 ALA 2 HB3 ALA 2 4.023 -5.804 0.831
9 H PHE 3 H PHE 3 1.457 -7.583 -1.343
10 HA PHE 3 HA PHE 3 -0.439 -6.458 -3.129
11 HB2 PHE 3 HB2 PHE 3 -0.701 -9.123 -1.630
12 HB3 PHE 3 HB3 PHE 3 -1.518 -8.686 -3.150
13 HD1 PHE 3 HD1 PHE 3 0.063 -7.894 -5.139
14 HD2 PHE 3 HD2 PHE 3 1.386 -10.329 -1.843
15 HE1 PHE 3 HE1 PHE 3 2.090 -8.523 -6.411
16 HE2 PHE 3 HE2 PHE 3 3.393 -10.974 -3.129
17 HZ PHE 3 HZ PHE 3 3.770 -10.050 -5.404
18 H VAL 4 H VAL 4 -0.660 -6.815 0.477
19 HA VAL 4 HA VAL 4 -3.264 -5.454 0.309
20 HB VAL 4 HB VAL 4 -3.862 -7.817 -0.127
21 HG11 VAL 4 HG11 VAL 4 -1.924 -8.966 0.962
22 HG12 VAL 4 HG12 VAL 4 -2.527 -8.479 2.573
23 HG13 VAL 4 HG13 VAL 4 -3.467 -9.614 1.568
24 HG21 VAL 4 HG21 VAL 4 -4.712 -7.046 2.736
25 HG22 VAL 4 HG22 VAL 4 -5.456 -6.410 1.236
26 HG23 VAL 4 HG23 VAL 4 -5.568 -8.145 1.627
27 H GLY 5 H GLY 5 -4.021 -4.619 2.441
28 HA2 GLY 5 HA3 GLY 5 -3.189 -5.136 4.893
29 HA3 GLY 5 HA2 GLY 5 -1.721 -4.317 4.311
30 H GLN 6 H GLN 6 -1.775 -1.973 4.198
31 HA GLN 6 HA GLN 6 -4.338 -0.555 4.343
32 HB2 GLN 6 HB2 GLN 6 -4.022 0.254 6.707
33 HB3 GLN 6 HB3 GLN 6 -4.007 -1.504 6.670
34 HG2 GLN 6 HG2 GLN 6 -2.205 -0.765 8.126
35 HG3 GLN 6 HG3 GLN 6 -1.531 -1.504 6.659
36 HE21 GLN 6 HE21 GLN 6 0.551 -0.276 6.770
37 HE22 GLN 6 HE22 GLN 6 0.571 1.439 6.588
38 HA PRO 7 HA PRO 7 -2.022 2.261 2.112
39 HB2 PRO 7 HB2 PRO 7 -2.154 4.830 3.375
40 HB3 PRO 7 HB3 PRO 7 -3.441 4.110 2.369
41 HG2 PRO 7 HG2 PRO 7 -3.192 3.877 5.401
42 HG3 PRO 7 HG3 PRO 7 -4.626 4.419 4.470
43 HD2 PRO 7 HD2 PRO 7 -4.566 1.874 5.286
44 HD3 PRO 7 HD3 PRO 7 -4.908 2.091 3.537
45 H GLU 8 H GLU 8 0.280 2.580 1.861
46 HA GLU 8 HA GLU 8 1.891 2.133 4.246
47 HB2 GLU 8 HB2 GLU 8 2.682 2.782 1.351
48 HB3 GLU 8 HB3 GLU 8 3.854 2.507 2.668
49 HG2 GLU 8 HG2 GLU 8 3.014 0.232 3.046
50 HG3 GLU 8 HG3 GLU 8 1.665 0.481 1.910
51 H ALA 9 H ALA 9 1.636 4.968 1.884
52 HA ALA 9 HA ALA 9 2.929 6.653 3.938
53 HB1 ALA 9 HB1 ALA 9 1.862 7.410 1.154
54 HB2 ALA 9 HB2 ALA 9 2.748 8.476 2.282
55 HB3 ALA 9 HB3 ALA 9 3.548 7.030 1.594
56 H VAL 10 H VAL 10 -0.237 6.739 2.097
57 HA VAL 10 HA VAL 10 -1.818 7.179 4.372
58 HB VAL 10 HB VAL 10 -0.781 9.314 4.796
59 HG11 VAL 10 HG11 VAL 10 -0.541 11.150 3.262
60 HG12 VAL 10 HG12 VAL 10 0.153 9.726 2.443
61 HG13 VAL 10 HG13 VAL 10 -1.469 10.341 1.985
62 HG21 VAL 10 HG21 VAL 10 -2.714 10.835 4.710
63 HG22 VAL 10 HG22 VAL 10 -3.504 9.835 3.461
64 HG23 VAL 10 HG23 VAL 10 -3.262 9.183 5.108
65 H ASN 11 H ASN 11 -1.504 8.297 0.868
66 HA ASN 11 HA ASN 11 -4.352 7.776 0.461
67 HB2 ASN 11 HB2 ASN 11 -3.096 9.466 -0.886
68 HB3 ASN 11 HB3 ASN 11 -2.051 8.195 -1.551
69 HD21 ASN 11 HD21 ASN 11 -3.271 6.335 -2.820
70 HD22 ASN 11 HD22 ASN 11 -4.622 6.856 -3.752
71 HA PRO 12 HA PRO 12 -3.230 3.354 0.118
72 HB2 PRO 12 HB2 PRO 12 -5.366 2.279 -1.244
73 HB3 PRO 12 HB3 PRO 12 -5.566 3.038 0.363
74 HG2 PRO 12 HG2 PRO 12 -5.953 4.454 -2.330
75 HG3 PRO 12 HG3 PRO 12 -7.194 4.256 -1.048
76 HD2 PRO 12 HD2 PRO 12 -5.717 6.532 -1.122
77 HD3 PRO 12 HD3 PRO 12 -5.916 5.729 0.477
78 H LEU 13 H LEU 13 -1.327 4.364 -1.228
79 HA LEU 13 HA LEU 13 -1.498 3.558 -4.089
80 HB2 LEU 13 HB2 LEU 13 0.929 4.527 -2.477
81 HB3 LEU 13 HB3 LEU 13 0.867 4.254 -4.232
82 HG LEU 13 HG LEU 13 -0.783 6.355 -2.688
83 HD11 LEU 13 HD11 LEU 13 0.798 8.038 -3.656
84 HD12 LEU 13 HD12 LEU 13 1.757 6.720 -4.388
85 HD13 LEU 13 HD13 LEU 13 1.655 6.879 -2.611
86 HD21 LEU 13 HD21 LEU 13 -1.222 7.351 -4.969
87 HD22 LEU 13 HD22 LEU 13 -1.920 5.725 -4.847
88 HD23 LEU 13 HD23 LEU 13 -0.384 5.966 -5.727
89 H GLY 14 H GLY 14 0.423 2.700 -1.041
90 HA2 GLY 14 HA3 GLY 14 0.843 -0.015 -2.250
91 HA3 GLY 14 HA2 GLY 14 1.881 0.785 -1.060
92 H ARG 15 H ARG 15 0.503 -1.840 -0.746
93 HA ARG 15 HA ARG 15 -1.152 -1.169 1.674
94 HB2 ARG 15 HB2 ARG 15 -1.603 -3.506 -0.272
95 HB3 ARG 15 HB3 ARG 15 -2.516 -3.061 1.187
96 HG2 ARG 15 HG2 ARG 15 -3.902 -2.208 -0.475
97 HG3 ARG 15 HG3 ARG 15 -2.968 -0.760 -0.041
98 HD2 ARG 15 HD2 ARG 15 -3.109 -0.871 -2.512
99 HD3 ARG 15 HD3 ARG 15 -1.469 -1.224 -2.063
100 HE ARG 15 HE ARG 15 -1.610 -3.393 -2.825
101 HH11 ARG 15 HH11 ARG 15 -4.979 -2.068 -2.590
102 HH12 ARG 15 HH12 ARG 15 -5.630 -3.430 -3.485
103 HH21 ARG 15 HH21 ARG 15 -2.575 -5.076 -3.940
104 HH22 ARG 15 HH22 ARG 15 -4.314 -5.092 -4.227
105 H GLU 16 H GLU 16 0.682 -1.475 3.199
106 HA GLU 16 HA GLU 16 1.271 -4.413 3.556
107 HB2 GLU 16 HB2 GLU 16 3.102 -1.984 3.973
108 HB3 GLU 16 HB3 GLU 16 3.324 -3.445 4.963
109 HG2 GLU 16 HG2 GLU 16 3.876 -4.844 3.128
110 HG3 GLU 16 HG3 GLU 16 3.345 -3.629 1.944
111 H ILE 17 H ILE 17 1.011 -5.107 5.790
112 HA ILE 17 HA ILE 17 -0.094 -3.059 7.625
113 HB ILE 17 HB ILE 17 -0.363 -4.749 9.302
114 HG12 ILE 17 HG12 ILE 17 0.743 -6.856 7.330
115 HG13 ILE 17 HG13 ILE 17 1.615 -6.217 8.747
116 HG21 ILE 17 HG21 ILE 17 -2.140 -4.356 7.492
117 HG22 ILE 17 HG22 ILE 17 -1.482 -5.773 6.625
118 HG23 ILE 17 HG23 ILE 17 -2.239 -5.963 8.233
119 HD11 ILE 17 HD11 ILE 17 0.649 -8.365 9.334
120 HD12 ILE 17 HD12 ILE 17 -0.208 -7.098 10.257
121 HD13 ILE 17 HD13 ILE 17 -0.982 -7.866 8.836
122 H GLN 18 H GLN 18 1.173 -2.145 9.365
123 HA GLN 18 HA GLN 18 3.972 -3.113 9.599
124 HB2 GLN 18 HB2 GLN 18 3.199 -0.237 8.784
125 HB3 GLN 18 HB3 GLN 18 4.850 -0.797 9.165
126 HG2 GLN 18 HG2 GLN 18 4.705 -2.432 7.216
127 HG3 GLN 18 HG3 GLN 18 3.127 -1.719 6.782
128 HE21 GLN 18 HE21 GLN 18 3.081 0.723 6.286
129 HE22 GLN 18 HE22 GLN 18 4.492 1.374 5.539
130 H GLY 19 H GLY 19 5.126 -1.907 11.465
131 HA2 GLY 19 HA3 GLY 19 3.201 -1.685 13.686
132 HA3 GLY 19 HA2 GLY 19 4.969 -1.506 13.782
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